#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 5.33 0.21 1.61 1.04 -1.26 -4.99 113.70 115.64 2dao s SER 2 Ca 0.00 -0.20 -0.12 0.00 0.48 0.00 0.00 55.95 56.11 2dao s SER 2 Cb 0.00 -1.97 0.27 0.00 0.10 0.00 0.00 66.02 64.42 2dao s SER 2 CO 0.00 -0.05 1.65 0.77 0.98 0.00 0.00 173.24 176.59 2dao h SER 3 N 8.27 -0.35 0.00 7.02 4.64 -2.13 -3.45 113.55 127.54 2dao h SER 3 Ca -0.37 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2dao h SER 3 Cb 1.17 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 2dao h SER 3 CO 0.58 -0.14 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 2dao n GLY 4 N -1.38 1.13 2.86 -0.77 0.00 -1.26 -5.12 105.19 100.65 2dao n GLY 4 Ca 0.08 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 4.35 -0.01 1.61 0.01 -1.26 -4.99 113.70 113.41 2dao s SER 5 Ca 0.00 -1.89 -0.25 0.00 1.31 0.00 0.00 55.95 55.12 2dao s SER 5 Cb 0.00 -1.21 -0.19 0.00 0.21 0.00 0.00 66.02 64.83 2dao s SER 5 CO 0.00 -0.40 1.29 -1.28 0.41 0.00 0.00 173.24 173.26 2dao h SER 6 N 7.85 0.09 0.00 2.44 0.87 -2.00 -3.48 113.55 119.32 2dao h SER 6 Ca -0.09 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 2dao h SER 6 Cb 1.01 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 2dao h SER 6 CO 0.49 0.55 0.00 0.61 -0.53 0.00 0.00 176.83 177.96 2dao n GLY 7 N 0.20 1.80 2.17 5.77 0.00 -1.26 -4.84 105.19 109.04 2dao n GLY 7 Ca -0.08 0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 2dao n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dao s ARG 9 N -1.23 0.17 0.55 0.00 1.81 -1.26 -5.16 118.95 113.84 2dao s ARG 9 Ca 0.48 0.34 0.01 0.00 -1.72 0.00 0.00 55.73 54.83 2dao s ARG 9 Cb 0.31 -0.91 0.03 0.00 -0.45 0.00 0.00 34.95 33.93 2dao s ARG 9 CO -0.11 -0.56 0.78 -0.51 -0.68 0.00 0.00 175.30 174.22 2dao s LEU 10 N 2.34 3.27 0.00 2.53 1.02 -1.26 -4.95 118.68 121.63 2dao s LEU 10 Ca 0.06 0.04 0.00 0.00 0.02 0.00 0.00 54.13 54.25 2dao s LEU 10 Cb -0.15 -2.90 0.00 0.00 0.02 0.00 0.00 46.19 43.16 2dao s LEU 10 CO -0.11 -1.15 0.18 -0.11 0.02 0.00 0.00 176.35 175.18 2dao n LEU 11 N -2.37 0.63 -0.39 1.79 7.94 -1.26 -2.10 117.00 121.24 2dao n LEU 11 Ca 0.08 0.47 0.32 0.00 -1.11 0.00 0.00 56.01 55.76 2dao n LEU 11 Cb 0.60 -0.37 0.52 0.00 0.53 0.00 0.00 43.42 44.70 2dao n LEU 11 CO 0.46 -0.37 0.94 -2.67 -1.11 0.00 0.00 177.39 174.64 2dao n TRP 12 N -1.61 0.39 -0.02 1.96 4.27 -1.26 0.23 117.44 121.40 2dao n TRP 12 Ca 0.00 0.39 -0.15 0.00 -3.89 0.00 0.00 57.50 53.85 2dao n TRP 12 Cb 0.00 -0.78 -0.11 0.00 -1.36 0.00 0.00 31.31 29.06 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 0.26 -0.81 -0.67 3.58 -1.99 -3.21 116.42 113.57 2dao h ASP 13 Ca 0.65 -0.78 0.24 0.00 0.42 0.00 0.00 57.03 57.56 2dao h ASP 13 Cb 2.24 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 43.18 2dao h ASP 13 CO -0.26 1.00 1.09 0.22 -2.88 0.00 0.00 179.24 178.40 2dao h TYR 14 N -0.46 0.00 0.17 0.28 3.20 0.35 -0.96 116.97 119.55 2dao h TYR 14 Ca -0.04 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 2dao h TYR 14 Cb 1.04 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.30 2dao h TYR 14 CO 0.18 0.00 -0.17 0.28 -1.64 0.00 0.00 178.16 176.81 2dao h VAL 15 N 0.00 0.00 -0.85 1.81 2.07 -1.53 -3.04 116.25 114.71 2dao h VAL 15 Ca 0.39 0.00 0.10 0.00 0.82 0.00 0.00 66.70 68.00 2dao h VAL 15 Cb 2.55 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 32.21 2dao h VAL 15 CO -0.00 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 177.15 2dao n TYR 16 N -3.33 -0.22 -0.25 1.57 9.36 -0.36 0.93 117.16 124.85 2dao n TYR 16 Ca -0.04 1.06 0.18 0.00 3.32 0.00 0.00 57.90 62.42 2dao n TYR 16 Cb 0.15 -0.66 0.34 0.00 -0.63 0.00 0.00 39.34 38.54 2dao n TYR 16 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 2dao n GLN 17 N -5.13 -0.05 0.07 2.98 0.00 -1.15 0.19 117.38 114.27 2dao n GLN 17 Ca 0.04 1.09 -0.10 0.00 -0.00 0.00 0.00 57.00 58.04 2dao n GLN 17 Cb 0.27 -1.85 -0.07 0.00 0.00 0.00 0.00 30.24 28.59 2dao n GLN 17 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2dao h LEU 18 N 0.00 -0.22 -0.86 1.69 3.38 0.54 -3.24 115.31 116.60 2dao h LEU 18 Ca 0.56 -0.28 0.14 0.00 0.09 0.00 0.00 57.88 58.39 2dao h LEU 18 Cb 1.34 0.06 -0.15 0.00 0.09 0.00 0.00 40.66 42.00 2dao h LEU 18 CO -0.65 0.33 -0.35 -0.07 0.09 0.00 0.00 178.44 177.79 2dao h LEU 19 N -0.93 -1.28 -0.82 1.67 -0.00 0.21 0.46 115.31 114.62 2dao h LEU 19 Ca -0.03 0.28 0.18 0.00 -0.00 0.00 0.00 57.88 58.32 2dao h LEU 19 Cb 0.48 0.68 -0.11 0.00 -0.00 0.00 0.00 40.66 41.71 2dao h LEU 19 CO 0.04 -0.29 0.31 0.28 -0.00 0.00 0.00 178.44 178.78 2dao h SER 20 N -0.05 0.23 -3.38 -0.43 0.02 -1.21 -3.35 113.55 105.38 2dao h SER 20 Ca 0.32 0.14 -0.58 0.00 -0.84 0.00 0.00 61.79 60.84 2dao h SER 20 Cb 0.59 0.14 -0.09 0.00 0.14 0.00 0.00 62.40 63.18 2dao h SER 20 CO -0.89 0.02 0.79 -1.81 -1.14 0.00 0.00 176.83 173.80 2dao s ASP 21 N -5.25 6.46 0.39 3.07 1.01 0.16 -4.89 116.67 117.63 2dao s ASP 21 Ca -0.12 0.06 0.06 0.00 0.71 0.00 0.00 52.55 53.26 2dao s ASP 21 Cb 0.23 -2.50 0.81 0.00 1.01 0.00 0.00 42.92 42.47 2dao s ASP 21 CO 0.77 -1.29 2.04 0.28 0.21 0.00 0.00 175.17 177.17 2dao h SER 22 N 9.34 0.54 -0.16 0.27 0.02 -1.76 -1.55 113.55 120.25 2dao h SER 22 Ca -0.25 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 60.74 2dao h SER 22 Cb 1.07 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.47 2dao h SER 22 CO 1.12 0.38 0.61 0.03 -1.14 0.00 0.00 176.83 177.84 2dao h ARG 23 N 0.63 0.00 -0.80 3.45 3.08 -1.90 0.89 114.38 119.73 2dao h ARG 23 Ca 0.19 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.77 2dao h ARG 23 Cb -0.01 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 29.78 2dao h ARG 23 CO -0.04 0.00 0.39 0.66 -1.07 0.00 0.00 179.97 179.90 2dao n TYR 24 N -2.94 2.54 -0.04 3.04 4.02 -0.58 -4.57 117.16 118.63 2dao n TYR 24 Ca 0.02 -2.08 -0.16 0.00 -0.01 0.00 0.00 57.90 55.67 2dao n TYR 24 Cb 0.69 -0.89 -0.07 0.00 -0.02 0.00 0.00 39.34 39.05 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 1.32 0.76 -0.29 -0.72 5.08 0.71 -1.03 114.58 120.41 2dao h GLU 25 Ca 0.50 -0.57 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2dao h GLU 25 Cb 1.98 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 31.32 2dao h GLU 25 CO 1.00 1.19 0.15 -0.91 -1.00 0.00 0.00 179.01 179.43 2dao h ASN 26 N 0.48 0.34 0.19 1.42 4.21 -1.80 -2.74 115.58 117.68 2dao h ASN 26 Ca -0.03 -0.02 -0.30 0.00 1.21 0.00 0.00 56.30 57.16 2dao h ASN 26 Cb 1.28 -0.09 0.02 0.00 -1.12 0.00 0.00 38.32 38.41 2dao h ASN 26 CO 0.14 0.29 -1.39 -0.26 -1.29 0.00 0.00 177.43 174.91 2dao h PHE 27 N 0.39 0.74 -1.89 1.19 0.04 -1.88 -3.40 116.94 112.13 2dao h PHE 27 Ca 0.10 -0.54 0.04 0.00 2.80 0.00 0.00 57.97 60.38 2dao h PHE 27 Cb 0.03 -0.03 -0.22 0.00 2.20 0.00 0.00 35.95 37.93 2dao h PHE 27 CO 0.00 1.54 0.08 -1.50 -0.60 0.00 0.00 178.31 177.83 2dao s ILE 28 N -2.54 -0.08 0.31 -0.55 2.07 -0.40 -1.02 121.20 118.99 2dao s ILE 28 Ca -0.14 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.13 2dao s ILE 28 Cb 0.04 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.58 2dao s ILE 28 CO 0.87 0.00 0.11 0.00 -1.91 0.00 0.00 174.94 174.01 2dao s ARG 29 N 1.69 1.60 -0.37 3.50 3.03 -1.22 -3.93 118.95 123.25 2dao s ARG 29 Ca -0.09 -1.90 -0.28 0.00 2.03 0.00 0.00 55.73 55.49 2dao s ARG 29 Cb -0.05 -0.42 0.02 0.00 -1.03 0.00 0.00 34.95 33.46 2dao s ARG 29 CO -0.19 -0.34 1.02 -1.58 -1.13 0.00 0.00 175.30 173.09 2dao s TRP 30 N -3.52 3.05 -0.03 5.89 0.52 -1.26 -2.88 118.94 120.71 2dao s TRP 30 Ca 0.35 0.90 -0.17 0.00 0.02 0.00 0.00 56.10 57.20 2dao s TRP 30 Cb 0.07 -3.82 -0.09 0.00 -1.15 0.00 0.00 33.47 28.47 2dao s TRP 30 CO 0.15 -0.90 0.70 0.93 0.02 0.00 0.00 176.95 177.85 2dao h GLU 31 N 8.50 -0.56 -2.15 4.98 4.39 -0.69 -3.41 114.58 125.63 2dao h GLU 31 Ca -0.22 0.04 -0.58 0.00 0.34 0.00 0.00 59.36 58.94 2dao h GLU 31 Cb 1.07 0.13 -0.40 0.00 -0.10 0.00 0.00 28.75 29.45 2dao h GLU 31 CO 1.03 -0.36 -0.96 -0.25 -1.16 0.00 0.00 179.01 177.31 2dao n ASP 32 N -5.17 0.96 -0.64 1.42 9.92 -0.66 -4.95 116.55 117.43 2dao n ASP 32 Ca -0.07 -2.83 0.50 0.00 -0.53 0.00 0.00 54.79 51.86 2dao n ASP 32 Cb 0.24 -0.64 0.77 0.00 -0.64 0.00 0.00 41.12 40.85 2dao n ASP 32 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2dao n LYS 33 N 1.53 0.00 -0.32 -1.24 5.02 -1.26 -0.34 118.16 121.55 2dao n LYS 33 Ca 0.24 1.07 0.11 0.00 -2.02 0.00 0.00 58.31 57.71 2dao n LYS 33 Cb 0.49 -2.51 0.23 0.00 -0.02 0.00 0.00 35.03 33.22 2dao n LYS 33 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2dao h GLU 34 N 0.00 0.05 -0.09 1.97 5.08 -1.93 0.83 114.58 120.49 2dao h GLU 34 Ca 0.88 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 59.23 2dao h GLU 34 Cb 3.67 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 32.91 2dao h GLU 34 CO -0.01 0.03 -0.05 0.43 -1.00 0.00 0.00 179.01 178.42 2dao n SER 35 N -5.45 2.71 -3.47 1.42 7.64 0.53 -4.97 113.62 112.03 2dao n SER 35 Ca 0.19 -3.18 -0.18 0.00 1.01 0.00 0.00 58.87 56.71 2dao n SER 35 Cb 0.64 -0.48 0.09 0.00 -1.01 0.00 0.00 64.21 63.44 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 -1.15 -6.74 -3.67 1.43 5.02 0.28 -4.25 118.16 109.08 2dao n LYS 36 Ca 0.19 0.84 -0.36 0.00 -2.02 0.00 0.00 58.31 56.95 2dao n LYS 36 Cb 0.73 -5.84 -0.09 0.00 -0.02 0.00 0.00 35.03 29.81 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 -3.37 5.36 0.41 -0.18 1.01 -1.08 -1.91 121.20 121.44 2dao s ILE 37 Ca 0.09 0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.99 2dao s ILE 37 Cb -0.04 -3.50 -0.07 0.00 0.01 0.00 0.00 42.46 38.87 2dao s ILE 37 CO 0.73 0.35 0.09 0.72 0.00 0.00 0.00 174.94 176.83 2dao s PHE 38 N 1.00 2.56 -0.19 3.97 -0.71 -0.46 0.03 117.98 124.18 2dao s PHE 38 Ca 0.08 -0.63 -0.10 0.00 -1.04 0.00 0.00 56.93 55.23 2dao s PHE 38 Cb -0.13 -1.86 0.06 0.00 -1.21 0.00 0.00 43.02 39.88 2dao s PHE 38 CO 0.04 0.33 0.45 0.50 -1.34 0.00 0.00 175.22 175.20 2dao s ARG 39 N -3.80 0.44 -0.93 1.99 3.52 -1.14 -2.30 118.95 116.74 2dao s ARG 39 Ca 0.38 0.86 -0.24 0.00 -0.13 0.00 0.00 55.73 56.59 2dao s ARG 39 Cb 0.07 0.01 0.02 0.00 -1.56 0.00 0.00 34.95 33.49 2dao s ARG 39 CO 0.20 -0.16 1.58 0.42 -0.81 0.00 0.00 175.30 176.53 2dao s ILE 40 N 1.46 3.74 0.31 4.11 1.01 -1.18 -3.41 121.20 127.24 2dao s ILE 40 Ca -0.09 -0.45 0.05 0.00 0.00 0.00 0.00 60.65 60.15 2dao s ILE 40 Cb -0.08 -4.71 0.39 0.00 0.01 0.00 0.00 42.46 38.07 2dao s ILE 40 CO -0.14 -1.62 1.58 0.58 0.00 0.00 0.00 174.94 175.35 2dao h VAL 41 N 6.82 0.07 -2.76 2.92 2.07 -1.33 -3.37 116.25 120.67 2dao h VAL 41 Ca 0.08 -0.01 -0.24 0.00 0.82 0.00 0.00 66.70 67.35 2dao h VAL 41 Cb 1.02 0.02 -0.33 0.00 -1.52 0.00 0.00 31.29 30.48 2dao h VAL 41 CO 1.34 0.01 -0.56 -1.81 0.02 0.00 0.00 177.57 176.57 2dao s ASP 42 N -4.95 0.60 0.32 0.57 1.01 -1.14 -5.03 116.67 108.05 2dao s ASP 42 Ca -0.12 0.38 0.12 0.00 0.71 0.00 0.00 52.55 53.63 2dao s ASP 42 Cb 0.29 0.62 0.55 0.00 1.01 0.00 0.00 42.92 45.39 2dao s ASP 42 CO 0.78 -0.26 1.73 1.55 0.21 0.00 0.00 175.17 179.17 2dao h PRO 43 N 8.29 0.00 -0.21 8.23 0.13 -1.89 0.59 132.00 147.14 2dao h PRO 43 Ca -0.15 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.82 2dao h PRO 43 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2dao h PRO 43 CO 0.17 0.49 -0.53 -0.97 -0.23 0.00 0.00 178.00 176.93 2dao h ASN 44 N 0.00 0.69 0.58 1.44 -0.73 -1.96 -1.70 115.58 113.90 2dao h ASN 44 Ca -0.00 -0.36 -0.28 0.00 1.87 0.00 0.00 56.30 57.52 2dao h ASN 44 Cb 0.86 -0.20 -0.04 0.00 0.27 0.00 0.00 38.32 39.22 2dao h ASN 44 CO 0.06 1.09 -1.53 1.23 -0.37 0.00 0.00 177.43 177.92 2dao h GLY 45 N 0.99 0.07 0.46 1.57 0.00 -1.94 -3.28 103.07 100.94 2dao h GLY 45 Ca 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2dao h GLY 45 CO 0.10 0.17 -0.02 -2.00 0.00 0.00 0.00 176.54 174.79 2dao h LEU 46 N 0.02 -0.05 -0.33 3.11 7.12 -0.91 -3.29 115.31 120.97 2dao h LEU 46 Ca -0.22 -0.49 0.07 0.00 0.13 0.00 0.00 57.88 57.37 2dao h LEU 46 Cb 1.96 0.01 -0.07 0.00 -0.53 0.00 0.00 40.66 42.03 2dao h LEU 46 CO 0.11 0.48 -0.12 0.00 -0.13 0.00 0.00 178.44 178.78 2dao h ALA 47 N 0.30 0.17 -0.91 1.25 0.00 -1.48 -2.42 119.26 116.16 2dao h ALA 47 Ca -0.01 0.13 0.12 0.00 0.00 0.00 0.00 54.91 55.15 2dao h ALA 47 Cb 0.54 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.50 2dao h ALA 47 CO 0.01 -0.49 -0.43 0.54 0.00 0.00 0.00 179.25 178.88 2dao n ARG 48 N -5.30 -0.29 -0.34 0.00 1.74 -1.24 0.12 116.66 111.35 2dao n ARG 48 Ca 0.01 1.40 -0.00 0.00 -0.77 0.00 0.00 57.85 58.48 2dao n ARG 48 Cb 0.22 -2.07 0.15 0.00 -1.02 0.00 0.00 32.46 29.74 2dao n ARG 48 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2dao h LEU 49 N 0.00 1.07 -1.16 0.55 3.38 -1.53 0.43 115.31 118.05 2dao h LEU 49 Ca 0.25 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.13 2dao h LEU 49 Cb 0.48 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2dao h LEU 49 CO -0.89 0.76 -0.24 -0.25 0.09 0.00 0.00 178.44 177.91 2dao h TRP 50 N 1.26 0.30 0.04 1.13 2.91 0.13 -3.01 115.95 118.71 2dao h TRP 50 Ca 0.36 -0.06 -0.27 0.00 1.13 0.00 0.00 58.89 60.06 2dao h TRP 50 Cb -0.08 -0.08 -0.03 0.00 -0.51 0.00 0.00 29.16 28.46 2dao h TRP 50 CO -0.00 0.51 -1.43 0.78 -1.03 0.00 0.00 178.44 177.27 2dao h GLY 51 N 0.97 0.09 -0.00 2.65 0.00 0.97 -3.21 103.07 104.53 2dao h GLY 51 Ca 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.16 2dao h GLY 51 CO 0.04 0.19 -0.11 -0.57 0.00 0.00 0.00 176.54 176.09 2dao h ASN 52 N 0.02 -0.34 -0.35 0.19 -1.24 -0.05 0.20 115.58 114.01 2dao h ASN 52 Ca -0.18 0.04 0.02 0.00 0.71 0.00 0.00 56.30 56.89 2dao h ASN 52 Cb 1.93 0.13 -0.03 0.00 0.73 0.00 0.00 38.32 41.08 2dao h ASN 52 CO 0.12 -0.11 0.19 1.12 -1.29 0.00 0.00 177.43 177.46 2dao h HIS 53 N -0.14 0.35 0.00 0.67 2.07 -1.75 -0.42 115.15 115.93 2dao h HIS 53 Ca 0.00 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.54 2dao h HIS 53 Cb 0.15 -0.11 0.00 0.00 2.57 0.00 0.00 27.41 30.02 2dao h HIS 53 CO -0.40 0.19 0.14 1.17 -3.07 0.00 0.00 177.93 175.97 2dao n LYS 54 N -4.92 0.08 -2.86 5.12 3.00 -1.08 -4.80 118.16 112.71 2dao n LYS 54 Ca 0.00 0.55 -0.10 0.00 -0.00 0.00 0.00 58.31 58.76 2dao n LYS 54 Cb 0.07 -1.92 0.05 0.00 0.00 0.00 0.00 35.03 33.23 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 -1.94 -2.76 -3.67 3.14 4.13 0.11 -4.94 115.26 109.33 2dao n ASN 55 Ca -0.01 -0.31 -0.28 0.00 1.68 0.00 0.00 54.58 55.66 2dao n ASN 55 Cb 0.16 -2.92 -0.11 0.00 -1.54 0.00 0.00 39.78 35.37 2dao n ASN 55 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2dao s ARG 56 N -5.03 1.69 0.50 3.52 6.06 0.47 -4.95 118.95 121.21 2dao s ARG 56 Ca 0.10 -2.68 0.36 0.00 -2.50 0.00 0.00 55.73 51.01 2dao s ARG 56 Cb -0.04 -2.47 1.51 0.00 0.06 0.00 0.00 34.95 34.01 2dao s ARG 56 CO 0.38 -1.31 1.70 0.00 -2.50 0.00 0.00 175.30 173.57 2dao h THR 57 N 4.59 0.26 -2.16 4.11 1.03 -1.92 0.24 112.91 119.06 2dao h THR 57 Ca 0.18 -0.03 -0.74 0.00 -0.01 0.00 0.00 66.41 65.81 2dao h THR 57 Cb 0.84 0.18 -0.31 0.00 -1.07 0.00 0.00 68.15 67.78 2dao h THR 57 CO 0.55 0.01 0.55 0.59 -0.01 0.00 0.00 175.52 177.21 2dao n ASN 58 N -4.30 6.58 -4.48 0.00 4.13 -1.26 -4.98 115.26 110.96 2dao n ASN 58 Ca 0.33 -3.72 -0.43 0.00 1.68 0.00 0.00 54.58 52.44 2dao n ASN 58 Cb 1.43 -0.97 -0.07 0.00 -1.54 0.00 0.00 39.78 38.64 2dao n ASN 58 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 2dao s MET 59 N -4.05 3.17 0.20 3.52 1.75 0.07 -5.05 119.30 118.91 2dao s MET 59 Ca 0.44 -0.70 0.04 0.00 -1.25 0.00 0.00 55.69 54.22 2dao s MET 59 Cb 0.27 -4.03 -0.03 0.00 2.84 0.00 0.00 34.83 33.88 2dao s MET 59 CO -0.19 -1.09 0.30 -0.08 -0.65 0.00 0.00 175.02 173.30 2dao s THR 60 N 2.61 5.12 0.20 10.11 -1.32 -1.26 -4.51 115.64 126.60 2dao s THR 60 Ca 0.17 -0.95 -0.04 0.00 -1.21 0.00 0.00 61.69 59.66 2dao s THR 60 Cb -0.17 -3.72 -0.01 0.00 -1.51 0.00 0.00 72.50 67.09 2dao s THR 60 CO 0.14 -0.23 1.56 0.22 -2.21 0.00 0.00 174.62 174.10 2dao h TYR 61 N 1.63 0.79 -1.00 9.09 3.20 -1.96 -2.90 116.97 125.82 2dao h TYR 61 Ca -0.50 -0.23 0.18 0.00 3.14 0.00 0.00 58.73 61.32 2dao h TYR 61 Cb 1.22 -0.17 -0.10 0.00 1.54 0.00 0.00 36.73 39.22 2dao h TYR 61 CO 0.50 0.95 0.62 1.49 -1.64 0.00 0.00 178.16 180.08 2dao h GLU 62 N 0.54 0.75 0.00 1.82 4.81 -1.96 0.57 114.58 121.11 2dao h GLU 62 Ca 0.05 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2dao h GLU 62 Cb 0.92 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.13 2dao h GLU 62 CO 0.08 0.50 -0.20 1.63 -0.73 0.00 0.00 179.01 180.29 2dao n LYS 63 N -4.73 0.19 -0.07 1.92 5.02 -1.15 -3.68 118.16 115.66 2dao n LYS 63 Ca 0.23 0.12 -0.10 0.00 -2.02 0.00 0.00 58.31 56.54 2dao n LYS 63 Cb 0.55 -1.68 -0.07 0.00 -0.02 0.00 0.00 35.03 33.81 2dao n LYS 63 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 2dao h MET 64 N 0.00 0.00 -1.01 1.97 4.05 0.20 -3.36 114.93 116.79 2dao h MET 64 Ca 0.00 0.00 0.23 0.00 -0.28 0.00 0.00 59.70 59.65 2dao h MET 64 Cb 0.67 0.00 -0.10 0.00 -0.80 0.00 0.00 31.60 31.36 2dao h MET 64 CO 0.00 0.51 0.62 1.03 0.23 0.00 0.00 176.91 179.30 2dao h SER 65 N -1.00 0.62 -0.99 1.39 0.87 -0.95 -0.42 113.55 113.05 2dao h SER 65 Ca -0.07 0.10 0.37 0.00 -1.23 0.00 0.00 61.79 60.96 2dao h SER 65 Cb 0.67 -0.00 -0.18 0.00 -0.44 0.00 0.00 62.40 62.45 2dao h SER 65 CO -0.04 0.16 0.42 0.03 -0.53 0.00 0.00 176.83 176.87 2dao h ARG 66 N 0.57 0.04 0.18 2.24 2.47 -1.70 -1.24 114.38 116.93 2dao h ARG 66 Ca 0.59 -0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.30 2dao h ARG 66 Cb 1.20 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 2dao h ARG 66 CO -0.36 0.03 -0.09 0.00 0.56 0.00 0.00 179.97 180.11 2dao h ALA 67 N 1.98 -0.91 -0.71 0.04 0.00 -1.27 -2.94 119.26 115.43 2dao h ALA 67 Ca 0.78 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 55.85 2dao h ALA 67 Cb 1.94 0.09 -0.13 0.00 0.00 0.00 0.00 17.79 19.69 2dao h ALA 67 CO -0.78 -0.90 0.10 1.28 0.00 0.00 0.00 179.25 178.94 2dao n LEU 68 N -2.73 -0.01 0.16 0.00 7.99 -0.52 -0.16 117.00 121.73 2dao n LEU 68 Ca -0.03 1.21 -0.09 0.00 -0.01 0.00 0.00 56.01 57.09 2dao n LEU 68 Cb 0.09 -0.47 -0.05 0.00 -0.11 0.00 0.00 43.42 42.89 2dao n LEU 68 CO 0.07 -1.25 0.51 0.03 -1.51 0.00 0.00 177.39 175.25 2dao h ARG 69 N 0.00 -0.48 -1.21 3.23 2.47 -1.38 -0.53 114.38 116.48 2dao h ARG 69 Ca 0.47 0.03 0.44 0.00 -1.26 0.00 0.00 59.98 59.67 2dao h ARG 69 Cb 1.05 0.11 -0.15 0.00 -1.65 0.00 0.00 29.97 29.33 2dao h ARG 69 CO -0.64 -0.32 0.75 0.72 0.56 0.00 0.00 179.97 181.03 2dao n HIS 70 N -3.78 0.82 0.02 3.04 8.25 0.77 0.24 115.22 124.59 2dao n HIS 70 Ca -0.06 0.83 -0.14 0.00 -0.26 0.00 0.00 57.72 58.09 2dao n HIS 70 Cb 0.22 -1.25 -0.03 0.00 1.12 0.00 0.00 29.99 30.05 2dao n HIS 70 CO 0.00 0.00 0.00 1.88 0.64 0.00 0.00 176.34 178.86 2dao h TYR 71 N 0.00 0.79 -0.92 4.41 0.05 -1.01 -3.24 116.97 117.05 2dao h TYR 71 Ca 0.84 -0.36 0.27 0.00 0.05 0.00 0.00 58.73 59.52 2dao h TYR 71 Cb 2.56 -0.12 -0.15 0.00 1.01 0.00 0.00 36.73 40.03 2dao h TYR 71 CO -0.01 1.16 0.26 1.88 -1.05 0.00 0.00 178.16 180.40 2dao h TYR 72 N 0.38 0.38 0.00 4.88 0.05 0.47 1.37 116.97 124.50 2dao h TYR 72 Ca -0.05 0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.73 2dao h TYR 72 Cb 1.40 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 39.12 2dao h TYR 72 CO 0.07 -0.27 -0.23 0.87 -1.05 0.00 0.00 178.16 177.54 2dao h LYS 73 N 0.16 0.00 0.00 4.88 6.56 -1.57 -1.36 116.57 125.25 2dao h LYS 73 Ca 0.60 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.19 2dao h LYS 73 Cb 1.29 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.95 2dao h LYS 73 CO -0.71 0.23 0.00 1.28 -2.06 0.00 0.00 179.45 178.19 2dao n LEU 74 N -4.23 0.00 -3.47 2.94 4.77 0.47 -4.85 117.00 112.62 2dao n LEU 74 Ca -0.02 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.75 2dao n LEU 74 Cb 0.29 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.46 2dao n LEU 74 CO 0.37 0.00 0.19 0.59 -1.33 0.00 0.00 177.39 177.21 2dao n ASN 75 N -0.63 -4.54 -0.07 -1.43 4.13 -0.51 -4.92 115.26 107.29 2dao n ASN 75 Ca 0.05 -0.56 -0.12 0.00 1.68 0.00 0.00 54.58 55.63 2dao n ASN 75 Cb 0.02 -4.98 -0.06 0.00 -1.54 0.00 0.00 39.78 33.22 2dao n ASN 75 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2dao n ILE 76 N -4.59 0.82 -4.15 2.41 5.41 -1.21 -4.60 119.36 113.44 2dao n ILE 76 Ca -0.11 -0.28 -0.17 0.00 1.00 0.00 0.00 62.75 63.19 2dao n ILE 76 Cb 0.60 -1.26 -0.12 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 -2.28 0.96 -0.06 1.39 1.01 -1.26 -2.80 121.20 118.17 2dao s ILE 77 Ca -0.20 -1.22 0.05 0.00 0.00 0.00 0.00 60.65 59.28 2dao s ILE 77 Cb 0.06 -0.95 -0.01 0.00 0.01 0.00 0.00 42.46 41.58 2dao s ILE 77 CO 0.31 -0.25 -0.21 -0.60 0.00 0.00 0.00 174.94 174.19 2dao s ARG 78 N -1.65 2.21 -0.32 2.79 3.52 -0.62 -4.28 118.95 120.61 2dao s ARG 78 Ca -0.04 -0.75 -0.14 0.00 -0.13 0.00 0.00 55.73 54.67 2dao s ARG 78 Cb -0.10 -1.87 -0.02 0.00 -1.56 0.00 0.00 34.95 31.40 2dao s ARG 78 CO 0.02 0.28 0.32 0.21 -0.81 0.00 0.00 175.30 175.32 2dao s LYS 79 N 0.02 3.70 0.60 5.12 2.20 -1.26 -1.22 119.74 128.89 2dao s LYS 79 Ca -0.06 -0.34 -0.19 0.00 -0.36 0.00 0.00 55.97 55.02 2dao s LYS 79 Cb -0.13 -3.75 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 2dao s LYS 79 CO 0.04 -0.42 1.18 0.39 -0.36 0.00 0.00 175.35 176.18 2dao n GLU 80 N 5.29 1.18 0.02 4.03 4.71 -1.23 -4.95 120.64 129.70 2dao n GLU 80 Ca -0.10 0.45 -0.13 0.00 -0.01 0.00 0.00 57.16 57.37 2dao n GLU 80 Cb 0.50 -2.39 -0.09 0.00 -1.01 0.00 0.00 31.44 28.44 2dao n GLU 80 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 2dao h PRO 81 N 0.76 -0.09 0.00 3.49 0.13 -1.97 -3.41 132.00 130.91 2dao h PRO 81 Ca -0.50 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2dao h PRO 81 Cb 1.34 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2dao h PRO 81 CO 0.53 0.36 0.00 0.41 -0.23 0.00 0.00 178.00 179.07 2dao n GLY 82 N 0.19 -2.35 3.11 1.56 0.00 -1.26 -4.82 105.19 101.62 2dao n GLY 82 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 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 0.00 -1.37 -0.00 1.61 1.13 -1.26 -4.97 117.38 112.52 2dao n GLN 83 Ca 0.00 -0.39 -0.00 0.00 -1.94 0.00 0.00 57.00 54.66 2dao n GLN 83 Cb 0.00 -1.44 -0.00 0.00 0.11 0.00 0.00 30.24 28.91 2dao n GLN 83 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 2dao n ARG 84 N -0.75 3.26 -1.37 -1.09 0.00 -1.26 -4.70 116.66 110.76 2dao n ARG 84 Ca 0.01 -0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.57 2dao n ARG 84 Cb 0.55 -1.01 0.10 0.00 -0.00 0.00 0.00 32.46 32.10 2dao n ARG 84 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2dao n LEU 85 N -1.93 6.84 -4.40 2.89 4.32 -1.26 -4.95 117.00 118.52 2dao n LEU 85 Ca -0.00 -4.19 -0.33 0.00 -0.02 0.00 0.00 56.01 51.46 2dao n LEU 85 Cb 0.42 -0.83 -0.14 0.00 -1.62 0.00 0.00 43.42 41.25 2dao n LEU 85 CO 0.01 1.47 -0.44 -0.22 -1.22 0.00 0.00 177.39 176.99 2dao s LEU 86 N -3.65 2.76 -0.05 2.23 1.98 -1.26 -3.10 118.68 117.59 2dao s LEU 86 Ca 0.60 -0.29 0.01 0.00 -2.89 0.00 0.00 54.13 51.56 2dao s LEU 86 Cb 0.48 -1.61 0.02 0.00 0.66 0.00 0.00 46.19 45.74 2dao s LEU 86 CO 0.02 0.20 -0.04 -0.36 -1.89 0.00 0.00 176.35 174.28 2dao s PHE 87 N 0.16 0.78 -0.28 5.38 0.08 -0.97 -3.50 117.98 119.63 2dao s PHE 87 Ca -0.07 -0.23 -0.04 0.00 0.12 0.00 0.00 56.93 56.71 2dao s PHE 87 Cb -0.15 -0.71 0.02 0.00 -0.57 0.00 0.00 43.02 41.61 2dao s PHE 87 CO 0.05 -0.22 0.02 0.50 -0.10 0.00 0.00 175.22 175.46 2dao s ARG 88 N 1.08 2.95 -1.14 0.44 3.00 -0.36 -1.36 118.95 123.56 2dao s ARG 88 Ca -0.08 -0.93 -0.23 0.00 -1.00 0.00 0.00 55.73 53.48 2dao s ARG 88 Cb -0.14 -3.21 -0.09 0.00 0.00 0.00 0.00 34.95 31.51 2dao s ARG 88 CO -0.01 -0.44 1.95 -0.06 0.00 0.00 0.00 175.30 176.74 2dao s PHE 89 N 1.42 1.90 0.00 5.12 0.08 -0.81 -1.58 117.98 124.11 2dao s PHE 89 Ca 0.01 0.57 0.00 0.00 0.12 0.00 0.00 56.93 57.63 2dao s PHE 89 Cb -0.17 -3.98 0.00 0.00 -0.57 0.00 0.00 43.02 38.30 2dao s PHE 89 CO -0.00 -1.26 0.56 -1.33 -0.10 0.00 0.00 175.22 173.08 2dao n MET 90 N 8.36 0.00 -3.01 0.44 2.81 -1.12 -4.60 117.12 120.01 2dao n MET 90 Ca 0.44 0.56 -0.18 0.00 -1.81 0.00 0.00 57.70 56.71 2dao n MET 90 Cb 0.47 -0.93 0.03 0.00 -0.71 0.00 0.00 33.22 32.07 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 -2.02 2.66 0.17 0.03 2.20 -1.26 -5.02 119.74 116.51 2dao s LYS 91 Ca 0.00 -1.36 -0.30 0.00 -0.36 0.00 0.00 55.97 53.95 2dao s LYS 91 Cb 0.00 -2.72 -0.08 0.00 -1.51 0.00 0.00 37.83 33.52 2dao s LYS 91 CO 0.00 -0.46 1.26 0.99 -0.36 0.00 0.00 175.35 176.78 2dao s THR 92 N -2.46 3.47 0.17 3.43 2.01 -1.26 -4.94 115.64 116.06 2dao s THR 92 Ca 0.57 1.18 -0.07 0.00 0.31 0.00 0.00 61.69 63.68 2dao s THR 92 Cb -0.09 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 2dao s THR 92 CO 0.35 0.16 1.52 1.55 -0.69 0.00 0.00 174.62 177.51 2dao h PRO 93 N 5.63 0.79 0.00 4.92 0.13 -1.95 -2.94 132.00 138.59 2dao h PRO 93 Ca -0.44 -0.41 -0.01 0.00 -0.87 0.00 0.00 66.00 64.26 2dao h PRO 93 Cb 1.21 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2dao h PRO 93 CO 0.77 1.04 -0.06 0.22 -0.23 0.00 0.00 178.00 179.75 2dao h ASP 94 N 0.65 0.00 -0.40 1.44 3.58 -2.00 -1.44 116.42 118.25 2dao h ASP 94 Ca 0.05 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.37 2dao h ASP 94 Cb 0.96 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.00 2dao h ASP 94 CO 0.09 0.06 -0.24 -0.33 -2.88 0.00 0.00 179.24 175.94 2dao h GLU 95 N 0.00 0.92 0.02 0.28 5.08 -1.90 -3.28 114.58 115.69 2dao h GLU 95 Ca -0.00 -0.39 -0.03 0.00 -1.00 0.00 0.00 59.36 57.93 2dao h GLU 95 Cb 0.16 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2dao h GLU 95 CO 0.01 1.05 -0.13 0.82 -1.00 0.00 0.00 179.01 179.76 2dao h ILE 96 N 0.79 1.69 -0.95 3.13 5.03 -1.45 -3.30 117.51 122.45 2dao h ILE 96 Ca 0.10 -2.20 0.34 0.00 -0.12 0.00 0.00 64.86 62.98 2dao h ILE 96 Cb 0.80 3.17 -0.11 0.00 -3.03 0.00 0.00 36.82 37.65 2dao h ILE 96 CO 0.07 0.58 0.60 0.23 -0.68 0.00 0.00 178.15 178.94 2dao n MET 97 N -4.57 -0.03 -3.42 2.37 2.81 -0.61 -1.87 117.12 111.81 2dao n MET 97 Ca -0.10 0.93 -0.43 0.00 -1.81 0.00 0.00 57.70 56.29 2dao n MET 97 Cb 0.50 -1.80 -0.02 0.00 -0.71 0.00 0.00 33.22 31.19 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 -4.41 6.92 0.57 7.83 0.15 -1.24 -4.99 113.70 118.52 2dao s SER 98 Ca -0.06 -3.51 0.00 0.00 0.70 0.00 0.00 55.95 53.08 2dao s SER 98 Cb 0.23 -2.13 0.00 0.00 -1.71 0.00 0.00 66.02 62.41 2dao s SER 98 CO 0.59 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.34 2dao n GLY 99 N 2.77 -3.30 3.59 9.45 0.00 -0.78 -4.99 105.19 111.93 2dao n GLY 99 Ca 0.22 -0.86 -0.07 0.00 0.00 0.00 0.00 46.02 45.31 2dao n GLY 99 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2dao s ARG 100 N -4.77 0.42 0.65 1.61 3.00 -1.26 -4.44 118.95 114.17 2dao s ARG 100 Ca 0.00 0.05 0.17 0.00 -1.00 0.00 0.00 55.73 54.95 2dao s ARG 100 Cb 0.00 0.20 0.84 0.00 0.00 0.00 0.00 34.95 35.99 2dao s ARG 100 CO 0.00 -0.14 1.46 0.00 0.00 0.00 0.00 175.30 176.62 2dao h THR 101 N 2.32 0.03 -3.01 4.11 1.03 -1.97 -3.19 112.91 112.24 2dao h THR 101 Ca -0.15 0.00 -0.58 0.00 -0.01 0.00 0.00 66.41 65.68 2dao h THR 101 Cb 1.17 0.31 -0.40 0.00 -1.07 0.00 0.00 68.15 68.16 2dao h THR 101 CO 0.28 0.00 -0.77 -1.81 -0.01 0.00 0.00 175.52 173.21 2dao s ASP 102 N -3.78 3.79 0.08 0.00 1.11 -1.26 -5.11 116.67 111.50 2dao s ASP 102 Ca -0.02 -1.79 -0.32 0.00 0.18 0.00 0.00 52.55 50.59 2dao s ASP 102 Cb 0.06 -0.76 -0.17 0.00 1.07 0.00 0.00 42.92 43.11 2dao s ASP 102 CO 0.20 -0.39 0.78 -1.14 1.18 0.00 0.00 175.17 175.80 2dao n ARG 103 N 4.63 0.00 -0.00 8.23 0.63 -1.21 -4.87 116.66 124.07 2dao n ARG 103 Ca 0.00 0.00 0.03 0.00 -0.92 0.00 0.00 57.85 56.97 2dao n ARG 103 Cb 0.40 -1.20 -0.04 0.00 0.45 0.00 0.00 32.46 32.07 2dao n ARG 103 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2dao n LEU 104 N 1.59 0.24 -1.53 6.15 7.94 -1.26 -4.62 117.00 125.51 2dao n LEU 104 Ca 0.18 -0.36 -0.04 0.00 -1.11 0.00 0.00 56.01 54.67 2dao n LEU 104 Cb 0.14 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.10 2dao n LEU 104 CO 0.55 0.06 0.98 -0.62 -1.11 0.00 0.00 177.39 177.25 2dao n GLU 105 N -1.33 1.22 0.00 1.96 -0.58 -1.26 -3.45 120.64 117.20 2dao n GLU 105 Ca 0.01 -0.43 0.00 0.00 -0.42 0.00 0.00 57.16 56.31 2dao n GLU 105 Cb 0.13 -1.17 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 2dao n GLU 105 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 2dao n HIS 106 N 1.02 0.00 -0.29 -0.32 -0.00 -1.26 -4.69 115.22 109.69 2dao n HIS 106 Ca 0.08 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.28 2dao n HIS 106 Cb 0.54 0.00 0.25 0.00 -0.12 0.00 0.00 29.99 30.66 2dao n HIS 106 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2dao n LEU 107 N -2.05 4.34 -0.35 0.27 4.32 -1.22 -4.37 117.00 117.93 2dao n LEU 107 Ca 0.00 -2.22 -0.02 0.00 -0.02 0.00 0.00 56.01 53.76 2dao n LEU 107 Cb 0.44 -0.64 0.13 0.00 -1.62 0.00 0.00 43.42 41.73 2dao n LEU 107 CO 0.00 0.55 1.29 1.05 -1.22 0.00 0.00 177.39 179.06 2dao h GLU 108 N 2.38 1.27 -0.91 3.23 4.11 -1.84 -3.19 114.58 119.63 2dao h GLU 108 Ca 0.06 -0.08 -0.42 0.00 0.07 0.00 0.00 59.36 58.99 2dao h GLU 108 Cb 1.59 -0.29 -0.41 0.00 0.50 0.00 0.00 28.75 30.15 2dao h GLU 108 CO 0.39 0.84 -0.99 -1.13 0.07 0.00 0.00 179.01 178.19 2dao n SER 109 N -4.39 2.98 -0.09 3.06 3.41 -1.26 -4.73 113.62 112.60 2dao n SER 109 Ca 0.11 -2.98 -0.21 0.00 -0.26 0.00 0.00 58.87 55.54 2dao n SER 109 Cb 0.02 -0.46 -0.12 0.00 -0.26 0.00 0.00 64.21 63.39 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 2.62 0.02 -1.00 4.33 5.75 -1.80 -3.37 115.11 121.65 2dao h GLN 110 Ca 0.08 -0.04 -0.59 0.00 -0.15 0.00 0.00 58.65 57.95 2dao h GLN 110 Cb 1.22 0.01 -0.30 0.00 1.07 0.00 0.00 27.48 29.49 2dao h GLN 110 CO 0.55 1.02 0.76 -0.85 -2.65 0.00 0.00 178.83 177.66 2dao n GLU 111 N -4.40 2.45 -4.13 1.69 0.00 -1.26 -4.94 120.64 110.05 2dao n GLU 111 Ca -0.28 -3.12 -0.12 0.00 0.00 0.00 0.00 57.16 53.63 2dao n GLU 111 Cb 0.67 -2.22 -0.08 0.00 0.00 0.00 0.00 31.44 29.82 2dao n GLU 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2dao s LEU 112 N -3.53 0.94 -0.09 -1.84 1.43 -1.26 -4.87 118.68 109.45 2dao s LEU 112 Ca 0.60 -1.30 -0.05 0.00 -1.03 0.00 0.00 54.13 52.35 2dao s LEU 112 Cb 0.49 0.97 -0.02 0.00 0.03 0.00 0.00 46.19 47.66 2dao s LEU 112 CO 0.05 -1.02 -0.09 -1.28 0.23 0.00 0.00 176.35 174.24 2dao h SER 113 N 2.39 0.00 -1.04 2.29 0.87 -1.92 -3.48 113.55 112.66 2dao h SER 113 Ca -0.31 0.00 0.11 0.00 -1.23 0.00 0.00 61.79 60.37 2dao h SER 113 Cb 1.25 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.18 2dao h SER 113 CO 0.44 0.48 -0.15 0.61 -0.53 0.00 0.00 176.83 177.68 2dao n GLY 114 N 1.70 -0.64 3.67 5.77 0.00 -1.26 -4.53 105.19 109.90 2dao n GLY 114 Ca -0.04 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2dao n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dao s PRO 115 N -1.08 4.23 -0.45 1.61 0.04 -1.26 -4.98 135.00 133.11 2dao s PRO 115 Ca 0.00 2.02 0.02 0.00 0.04 0.00 0.00 61.00 63.08 2dao s PRO 115 Cb 0.00 -3.76 0.14 0.00 0.04 0.00 0.00 34.50 30.92 2dao s PRO 115 CO 0.00 -0.71 0.26 0.45 0.04 0.00 0.00 177.00 177.04 2dao s SER 116 N 2.48 3.53 -0.41 6.66 0.15 -1.26 -5.06 113.70 119.78 2dao s SER 116 Ca 0.66 -2.71 -0.28 0.00 0.70 0.00 0.00 55.95 54.32 2dao s SER 116 Cb -0.31 -1.00 -0.01 0.00 -1.71 0.00 0.00 66.02 63.00 2dao s SER 116 CO 0.26 -0.25 1.63 -0.44 1.20 0.00 0.00 173.24 175.64 2dao s SER 117 N 0.26 6.00 0.00 5.45 0.01 -1.26 -5.28 113.70 118.88 2dao s SER 117 Ca 0.19 0.92 0.15 0.00 1.31 0.00 0.00 55.95 58.52 2dao s SER 117 Cb -0.21 -2.53 0.87 0.00 0.21 0.00 0.00 66.02 64.36 2dao s SER 117 CO -0.02 -1.69 1.29 0.61 0.41 0.00 0.00 173.24 173.84