#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 3.67 -0.27 1.61 0.01 -1.26 -5.08 113.70 112.39 2dao s SER 2 Ca 0.00 -0.49 -0.29 0.00 1.31 0.00 0.00 55.95 56.48 2dao s SER 2 Cb 0.00 -1.58 -0.01 0.00 0.21 0.00 0.00 66.02 64.64 2dao s SER 2 CO 0.00 0.04 1.45 -0.44 0.41 0.00 0.00 173.24 174.70 2dao s SER 3 N 1.07 6.53 0.00 2.44 0.01 -1.26 -4.84 113.70 117.65 2dao s SER 3 Ca -0.00 1.39 0.00 0.00 1.31 0.00 0.00 55.95 58.64 2dao s SER 3 Cb -0.14 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.55 2dao s SER 3 CO -0.04 -1.17 0.00 0.61 0.41 0.00 0.00 173.24 173.05 2dao n GLY 4 N 4.49 2.34 3.56 3.44 0.00 -1.26 -5.03 105.19 112.73 2dao n GLY 4 Ca 0.17 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 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 0.00 6.38 -0.52 1.61 0.15 -1.26 -4.97 113.70 115.09 2dao s SER 5 Ca 0.00 -0.07 -0.02 0.00 0.70 0.00 0.00 55.95 56.56 2dao s SER 5 Cb 0.00 -2.54 0.14 0.00 -1.71 0.00 0.00 66.02 61.91 2dao s SER 5 CO 0.00 -1.51 0.32 -0.55 1.20 0.00 0.00 173.24 172.70 2dao s SER 6 N 3.09 5.17 0.00 5.45 0.15 -1.26 -4.91 113.70 121.39 2dao s SER 6 Ca 0.40 -2.51 0.00 0.00 0.70 0.00 0.00 55.95 54.54 2dao s SER 6 Cb -0.08 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.40 2dao s SER 6 CO 0.23 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2dao n GLY 7 N 3.94 0.30 2.83 9.45 0.00 -1.26 -5.13 105.19 115.31 2dao n GLY 7 Ca 0.03 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 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 4.33 0.52 -0.82 0.00 1.74 -1.26 -4.93 116.66 116.25 2dao n ARG 9 Ca -0.22 0.28 -0.30 0.00 -0.77 0.00 0.00 57.85 56.84 2dao n ARG 9 Cb 0.50 -1.49 0.26 0.00 -1.02 0.00 0.00 32.46 30.71 2dao n ARG 9 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dao s LEU 10 N -7.94 0.05 -0.09 0.55 1.02 -1.26 -4.94 118.68 106.06 2dao s LEU 10 Ca -0.27 0.72 -0.07 0.00 0.02 0.00 0.00 54.13 54.52 2dao s LEU 10 Cb 0.04 -2.33 -0.02 0.00 0.02 0.00 0.00 46.19 43.90 2dao s LEU 10 CO 0.40 -4.59 -0.14 -0.11 0.02 0.00 0.00 176.35 171.92 2dao n LEU 11 N -5.09 1.11 -0.25 1.79 7.94 -1.26 -3.06 117.00 118.18 2dao n LEU 11 Ca 0.13 0.38 0.24 0.00 -1.11 0.00 0.00 56.01 55.65 2dao n LEU 11 Cb 0.60 -0.70 0.43 0.00 0.53 0.00 0.00 43.42 44.28 2dao n LEU 11 CO 0.44 -0.44 0.77 -2.67 -1.11 0.00 0.00 177.39 174.38 2dao n TRP 12 N -3.67 0.77 0.01 1.96 4.27 -1.26 0.16 117.44 119.68 2dao n TRP 12 Ca -0.06 0.78 -0.19 0.00 -3.89 0.00 0.00 57.50 54.14 2dao n TRP 12 Cb 0.21 -1.20 -0.14 0.00 -1.36 0.00 0.00 31.31 28.82 2dao n TRP 12 CO 0.00 0.00 0.00 0.38 -2.29 0.00 0.00 177.69 175.78 2dao h ASP 13 N 0.00 0.33 -1.20 -0.67 2.03 -1.98 -3.30 116.42 111.62 2dao h ASP 13 Ca 0.61 -0.93 0.35 0.00 -0.73 0.00 0.00 57.03 56.33 2dao h ASP 13 Cb 1.67 -0.11 -0.05 0.00 -0.83 0.00 0.00 39.33 40.01 2dao h ASP 13 CO -0.51 1.34 1.22 0.00 -1.03 0.00 0.00 179.24 180.27 2dao n TYR 14 N -4.22 0.00 0.02 4.15 9.36 0.43 -1.18 117.16 125.73 2dao n TYR 14 Ca -0.15 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.05 2dao n TYR 14 Cb 0.75 -0.30 -0.01 0.00 -0.63 0.00 0.00 39.34 39.15 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 -0.77 2.97 2.07 -1.56 -3.00 116.25 115.97 2dao h VAL 15 Ca 0.57 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.16 2dao h VAL 15 Cb 3.01 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 32.69 2dao h VAL 15 CO -0.01 0.00 -0.45 0.00 0.02 0.00 0.00 177.57 177.13 2dao n TYR 16 N -2.69 -0.34 -0.25 1.57 9.36 -0.32 0.12 117.16 124.61 2dao n TYR 16 Ca -0.01 0.96 0.18 0.00 3.32 0.00 0.00 57.90 62.35 2dao n TYR 16 Cb 0.04 -0.56 0.34 0.00 -0.63 0.00 0.00 39.34 38.53 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 -4.94 -0.05 0.22 2.98 3.00 -1.14 -0.33 117.38 117.11 2dao n GLN 17 Ca 0.02 1.10 -0.09 0.00 -0.01 0.00 0.00 57.00 58.01 2dao n GLN 17 Cb 0.20 -1.86 -0.04 0.00 0.00 0.00 0.00 30.24 28.54 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 -0.51 -0.84 1.08 3.38 0.97 -3.28 115.31 116.12 2dao h LEU 18 Ca 0.56 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.70 2dao h LEU 18 Cb 1.34 0.13 -0.15 0.00 0.09 0.00 0.00 40.66 42.07 2dao h LEU 18 CO -0.65 -0.22 -0.26 0.18 0.09 0.00 0.00 178.44 177.57 2dao n LEU 19 N -4.40 -0.41 -0.17 1.67 7.99 0.54 -0.88 117.00 121.34 2dao n LEU 19 Ca -0.07 1.46 -0.05 0.00 -0.01 0.00 0.00 56.01 57.34 2dao n LEU 19 Cb 0.24 -0.39 -0.04 0.00 -0.11 0.00 0.00 43.42 43.11 2dao n LEU 19 CO 0.18 -1.36 0.39 -0.24 -1.51 0.00 0.00 177.39 174.85 2dao n SER 20 N -5.31 -0.44 -4.58 -1.43 2.88 -0.64 -4.44 113.62 99.65 2dao n SER 20 Ca 0.11 1.12 -0.34 0.00 -1.33 0.00 0.00 58.87 58.44 2dao n SER 20 Cb 0.38 -0.29 0.12 0.00 -0.75 0.00 0.00 64.21 63.67 2dao n SER 20 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2dao n ASP 21 N -3.93 -0.14 -0.00 -3.46 9.92 -0.06 -4.94 116.55 113.94 2dao n ASP 21 Ca 0.01 0.52 0.07 0.00 -0.53 0.00 0.00 54.79 54.86 2dao n ASP 21 Cb 0.11 -1.38 -0.09 0.00 -0.64 0.00 0.00 41.12 39.12 2dao n ASP 21 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2dao n SER 22 N -2.30 0.86 -0.40 -2.24 3.41 -1.26 -4.31 113.62 107.38 2dao n SER 22 Ca 0.11 -0.68 0.11 0.00 -0.26 0.00 0.00 58.87 58.16 2dao n SER 22 Cb 0.51 1.13 0.47 0.00 -0.26 0.00 0.00 64.21 66.06 2dao n SER 22 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2dao n ARG 23 N -1.47 1.53 -0.00 4.33 1.74 -1.26 -3.45 116.66 118.08 2dao n ARG 23 Ca 0.02 -0.79 0.05 0.00 -0.77 0.00 0.00 57.85 56.36 2dao n ARG 23 Cb 0.25 -1.40 -0.07 0.00 -1.02 0.00 0.00 32.46 30.23 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 -0.01 0.00 -0.41 -1.55 4.02 -1.26 -4.68 117.16 113.27 2dao n TYR 24 Ca 0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.96 2dao n TYR 24 Cb 0.27 -0.05 -0.08 0.00 -0.02 0.00 0.00 39.34 39.46 2dao n TYR 24 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2dao n GLU 25 N -1.38 -0.40 -0.47 -0.72 4.71 -1.22 0.13 120.64 121.29 2dao n GLU 25 Ca 0.01 1.50 0.39 0.00 -0.01 0.00 0.00 57.16 59.05 2dao n GLU 25 Cb 0.20 -2.21 0.67 0.00 -1.01 0.00 0.00 31.44 29.09 2dao n GLU 25 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 2dao h ASN 26 N 0.00 0.21 0.19 1.62 2.35 -1.85 0.57 115.58 118.67 2dao h ASN 26 Ca 0.19 0.13 -0.35 0.00 -0.55 0.00 0.00 56.30 55.72 2dao h ASN 26 Cb 0.44 0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.93 2dao h ASN 26 CO -0.94 -0.19 -1.82 -0.26 -1.65 0.00 0.00 177.43 172.58 2dao h PHE 27 N 0.06 0.64 -1.89 1.19 0.04 0.73 -3.38 116.94 114.32 2dao h PHE 27 Ca 0.84 -0.47 0.08 0.00 2.80 0.00 0.00 57.97 61.23 2dao h PHE 27 Cb 2.73 -0.03 -0.21 0.00 2.20 0.00 0.00 35.95 40.64 2dao h PHE 27 CO -0.01 1.69 -0.06 -1.50 -0.60 0.00 0.00 178.31 177.84 2dao s ILE 28 N -2.57 -0.76 0.27 -0.55 2.07 0.20 -0.61 121.20 119.25 2dao s ILE 28 Ca -0.17 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.12 2dao s ILE 28 Cb 0.06 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.59 2dao s ILE 28 CO 0.83 0.00 -0.04 0.00 -1.91 0.00 0.00 174.94 173.82 2dao s ARG 29 N 2.60 1.50 -0.05 3.50 1.70 -1.18 -3.56 118.95 123.46 2dao s ARG 29 Ca -0.06 -1.76 -0.30 0.00 -0.47 0.00 0.00 55.73 53.14 2dao s ARG 29 Cb -0.10 -1.02 -0.05 0.00 -0.57 0.00 0.00 34.95 33.21 2dao s ARG 29 CO -0.19 0.00 1.52 -1.58 -1.08 0.00 0.00 175.30 173.97 2dao s TRP 30 N -3.11 2.38 -0.07 5.89 0.23 -1.26 -3.25 118.94 119.74 2dao s TRP 30 Ca 0.29 0.50 -0.06 0.00 -2.03 0.00 0.00 56.10 54.81 2dao s TRP 30 Cb 0.04 -3.78 -0.03 0.00 0.03 0.00 0.00 33.47 29.73 2dao s TRP 30 CO 0.11 -3.13 0.25 1.49 0.96 0.00 0.00 176.95 176.63 2dao h GLU 31 N 8.79 -0.19 -2.65 4.98 4.22 0.73 -3.44 114.58 127.02 2dao h GLU 31 Ca -0.37 0.01 -0.60 0.00 0.08 0.00 0.00 59.36 58.49 2dao h GLU 31 Cb 1.17 0.04 -0.39 0.00 0.50 0.00 0.00 28.75 30.07 2dao h GLU 31 CO 0.94 -0.13 -0.84 -0.51 -2.18 0.00 0.00 179.01 176.29 2dao s ASP 32 N -5.04 2.73 0.65 1.04 1.01 -0.32 -4.96 116.67 111.77 2dao s ASP 32 Ca -0.03 -2.87 0.17 0.00 0.71 0.00 0.00 52.55 50.53 2dao s ASP 32 Cb 0.00 -0.72 0.81 0.00 1.01 0.00 0.00 42.92 44.02 2dao s ASP 32 CO 0.09 -0.21 1.43 0.11 0.21 0.00 0.00 175.17 176.79 2dao h LYS 33 N 6.17 0.00 -0.67 8.23 1.79 -1.84 0.71 116.57 130.95 2dao h LYS 33 Ca 0.14 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.53 2dao h LYS 33 Cb 0.91 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.53 2dao h LYS 33 CO 0.42 0.00 0.11 0.93 -1.08 0.00 0.00 179.45 179.83 2dao h GLU 34 N 0.00 1.11 -0.03 3.15 5.08 -1.94 -3.15 114.58 118.79 2dao h GLU 34 Ca 0.10 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 2dao h GLU 34 Cb 1.66 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 2dao h GLU 34 CO -0.00 1.01 -0.42 0.43 -1.00 0.00 0.00 179.01 179.03 2dao n SER 35 N -4.22 1.84 -4.38 1.42 7.64 0.24 -4.96 113.62 111.19 2dao n SER 35 Ca 0.04 -3.83 -0.37 0.00 1.01 0.00 0.00 58.87 55.72 2dao n SER 35 Cb 0.29 -0.53 -0.07 0.00 -1.01 0.00 0.00 64.21 62.89 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 -1.14 -1.48 -3.60 1.43 5.02 -0.49 -3.94 118.16 113.95 2dao n LYS 36 Ca 0.20 0.20 -0.37 0.00 -2.02 0.00 0.00 58.31 56.31 2dao n LYS 36 Cb 0.72 -4.48 -0.06 0.00 -0.02 0.00 0.00 35.03 31.19 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 -3.62 5.24 0.29 -0.18 1.01 -1.04 -3.07 121.20 119.83 2dao s ILE 37 Ca 0.53 0.60 0.07 0.00 0.00 0.00 0.00 60.65 61.84 2dao s ILE 37 Cb -0.30 -3.61 -0.06 0.00 0.01 0.00 0.00 42.46 38.50 2dao s ILE 37 CO 0.99 0.53 -0.05 0.72 0.00 0.00 0.00 174.94 177.13 2dao s PHE 38 N -0.56 1.99 -0.22 3.97 -0.71 -0.98 0.13 117.98 121.60 2dao s PHE 38 Ca 0.19 -0.71 -0.03 0.00 -1.04 0.00 0.00 56.93 55.34 2dao s PHE 38 Cb -0.14 -1.16 0.10 0.00 -1.21 0.00 0.00 43.02 40.60 2dao s PHE 38 CO 0.08 0.28 0.22 0.50 -1.34 0.00 0.00 175.22 174.95 2dao s ARG 39 N -3.73 0.20 -0.71 1.99 3.52 -1.20 -2.77 118.95 116.24 2dao s ARG 39 Ca 0.30 0.05 -0.25 0.00 -0.13 0.00 0.00 55.73 55.71 2dao s ARG 39 Cb 0.04 -1.16 -0.14 0.00 -1.56 0.00 0.00 34.95 32.14 2dao s ARG 39 CO 0.13 -0.76 2.41 -0.89 -0.81 0.00 0.00 175.30 175.38 2dao n ILE 40 N 5.31 -0.03 -0.16 4.11 5.41 -1.18 -4.06 119.36 128.75 2dao n ILE 40 Ca -0.05 -0.58 -0.03 0.00 1.00 0.00 0.00 62.75 63.09 2dao n ILE 40 Cb 0.48 -2.04 0.04 0.00 -0.71 0.00 0.00 39.64 37.41 2dao n ILE 40 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 2dao h VAL 41 N 7.66 0.46 -3.21 1.39 2.07 -1.12 -3.37 116.25 120.14 2dao h VAL 41 Ca -0.09 0.00 -0.54 0.00 0.82 0.00 0.00 66.70 66.90 2dao h VAL 41 Cb 1.13 0.46 -0.40 0.00 -1.52 0.00 0.00 31.29 30.96 2dao h VAL 41 CO 1.14 0.00 -0.76 -1.81 0.02 0.00 0.00 177.57 176.15 2dao s ASP 42 N -5.21 3.27 0.21 0.57 1.11 -0.79 -5.01 116.67 110.82 2dao s ASP 42 Ca -0.14 -1.07 -0.02 0.00 0.18 0.00 0.00 52.55 51.49 2dao s ASP 42 Cb 0.17 -0.65 0.18 0.00 1.07 0.00 0.00 42.92 43.69 2dao s ASP 42 CO 0.72 -0.34 1.57 1.55 1.18 0.00 0.00 175.17 179.85 2dao h PRO 43 N 8.21 0.59 -0.39 8.23 0.13 -1.86 -0.65 132.00 146.26 2dao h PRO 43 Ca -0.16 -0.31 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 2dao h PRO 43 Cb 1.08 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 2dao h PRO 43 CO 0.38 0.90 0.16 -0.97 -0.23 0.00 0.00 178.00 178.24 2dao h ASN 44 N 0.48 0.54 0.71 1.44 -0.73 -1.96 0.27 115.58 116.32 2dao h ASN 44 Ca 0.04 -0.17 -0.21 0.00 1.87 0.00 0.00 56.30 57.83 2dao h ASN 44 Cb 0.94 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 39.37 2dao h ASN 44 CO 0.08 0.55 -0.95 1.23 -0.37 0.00 0.00 177.43 177.98 2dao h GLY 45 N 0.48 0.16 0.32 1.57 0.00 -1.97 -3.25 103.07 100.38 2dao h GLY 45 Ca 0.13 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2dao h GLY 45 CO -0.01 0.28 -0.11 -2.00 0.00 0.00 0.00 176.54 174.70 2dao h LEU 46 N 0.07 -0.25 -0.91 3.11 7.12 -0.99 -3.31 115.31 120.14 2dao h LEU 46 Ca -0.05 -0.21 0.22 0.00 0.13 0.00 0.00 57.88 57.98 2dao h LEU 46 Cb 1.62 0.06 -0.17 0.00 -0.53 0.00 0.00 40.66 41.65 2dao h LEU 46 CO 0.14 0.27 -0.06 0.00 -0.13 0.00 0.00 178.44 178.66 2dao h ALA 47 N -0.66 0.90 -1.04 1.25 0.00 -0.61 0.84 119.26 119.95 2dao h ALA 47 Ca -0.03 0.32 0.26 0.00 0.00 0.00 0.00 54.91 55.47 2dao h ALA 47 Cb 0.44 0.59 -0.10 0.00 0.00 0.00 0.00 17.79 18.72 2dao h ALA 47 CO 0.05 -0.48 0.65 0.00 0.00 0.00 0.00 179.25 179.47 2dao h ARG 48 N 0.03 0.43 -0.53 0.00 3.08 -1.64 0.33 114.38 116.07 2dao h ARG 48 Ca 0.51 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 60.41 2dao h ARG 48 Cb 0.93 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 2dao h ARG 48 CO -0.87 0.29 -0.13 -0.07 -1.07 0.00 0.00 179.97 178.11 2dao h LEU 49 N 0.45 1.04 -0.55 3.04 3.38 0.62 0.14 115.31 123.43 2dao h LEU 49 Ca 0.62 -0.36 -0.14 0.00 0.09 0.00 0.00 57.88 58.09 2dao h LEU 49 Cb 1.44 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2dao h LEU 49 CO -0.35 1.16 -0.29 -0.25 0.09 0.00 0.00 178.44 178.80 2dao h TRP 50 N 0.91 1.00 0.00 1.13 2.91 -0.23 -2.64 115.95 119.03 2dao h TRP 50 Ca 0.14 -0.26 -0.03 0.00 1.13 0.00 0.00 58.89 59.86 2dao h TRP 50 Cb 0.71 -0.23 -0.00 0.00 -0.51 0.00 0.00 29.16 29.13 2dao h TRP 50 CO 0.05 1.04 -0.14 0.78 -1.03 0.00 0.00 178.44 179.14 2dao h GLY 51 N 0.90 0.00 0.10 2.65 0.00 -0.86 -3.09 103.07 102.77 2dao h GLY 51 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 2dao h GLY 51 CO 0.07 0.00 -0.05 -0.57 0.00 0.00 0.00 176.54 176.00 2dao h ASN 52 N 0.00 -0.12 0.00 0.19 -1.24 -0.57 0.14 115.58 113.99 2dao h ASN 52 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2dao h ASN 52 Cb 1.10 0.03 0.00 0.00 0.73 0.00 0.00 38.32 40.18 2dao h ASN 52 CO 0.02 0.03 0.07 0.00 -1.29 0.00 0.00 177.43 176.26 2dao n HIS 53 N -3.01 0.64 0.02 0.67 1.44 -1.01 -0.06 115.22 113.91 2dao n HIS 53 Ca -0.02 0.33 0.06 0.00 -2.01 0.00 0.00 57.72 56.09 2dao n HIS 53 Cb 0.05 -0.99 0.25 0.00 0.12 0.00 0.00 29.99 29.43 2dao n HIS 53 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2dao n LYS 54 N -2.18 2.98 -2.20 -1.40 4.76 -1.17 -4.89 118.16 114.06 2dao n LYS 54 Ca -0.01 -2.01 -0.09 0.00 -2.87 0.00 0.00 58.31 53.33 2dao n LYS 54 Cb 0.10 -1.73 -0.01 0.00 -1.84 0.00 0.00 35.03 31.55 2dao n LYS 54 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2dao n ASN 55 N 0.69 -2.92 -3.44 4.39 2.85 0.92 -4.92 115.26 112.82 2dao n ASN 55 Ca 0.18 0.27 -0.11 0.00 -0.11 0.00 0.00 54.58 54.80 2dao n ASN 55 Cb 0.68 -2.60 0.05 0.00 1.24 0.00 0.00 39.78 39.16 2dao n ASN 55 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2dao n ARG 56 N -2.48 0.47 -3.87 1.20 5.12 0.50 -5.04 116.66 112.56 2dao n ARG 56 Ca -0.10 -1.54 -0.11 0.00 -1.93 0.00 0.00 57.85 54.17 2dao n ARG 56 Cb 0.52 -0.26 -0.11 0.00 -1.16 0.00 0.00 32.46 31.45 2dao n ARG 56 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2dao s THR 57 N -1.27 0.07 -1.43 0.55 2.01 -1.26 -4.67 115.64 109.63 2dao s THR 57 Ca 0.34 -0.56 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 2dao s THR 57 Cb -0.02 -0.37 0.02 0.00 0.01 0.00 0.00 72.50 72.14 2dao s THR 57 CO 0.22 -0.31 0.46 -0.46 -0.69 0.00 0.00 174.62 173.85 2dao n ASN 58 N 1.82 -0.66 -4.62 3.53 6.94 -1.26 -4.89 115.26 116.13 2dao n ASN 58 Ca -0.21 -1.00 -0.43 0.00 -0.02 0.00 0.00 54.58 52.93 2dao n ASN 58 Cb 0.56 -3.05 -0.03 0.00 -2.36 0.00 0.00 39.78 34.89 2dao n ASN 58 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 2dao s MET 59 N -6.58 3.93 -0.04 -3.83 1.75 -1.26 -5.03 119.30 108.23 2dao s MET 59 Ca 0.08 0.72 0.03 0.00 -1.25 0.00 0.00 55.69 55.26 2dao s MET 59 Cb -0.04 -3.77 -0.03 0.00 2.84 0.00 0.00 34.83 33.83 2dao s MET 59 CO 0.89 -0.88 -0.10 -0.08 -0.65 0.00 0.00 175.02 174.20 2dao s THR 60 N 3.41 3.39 0.46 10.11 -1.32 -1.26 -4.13 115.64 126.30 2dao s THR 60 Ca 0.39 -0.66 0.35 0.00 -1.21 0.00 0.00 61.69 60.55 2dao s THR 60 Cb -0.12 -2.38 0.53 0.00 -1.51 0.00 0.00 72.50 69.02 2dao s THR 60 CO 0.16 0.55 1.58 0.22 -2.21 0.00 0.00 174.62 174.92 2dao h TYR 61 N 5.12 0.45 -0.70 9.09 3.20 -1.92 0.65 116.97 132.87 2dao h TYR 61 Ca -0.48 0.02 0.14 0.00 3.14 0.00 0.00 58.73 61.56 2dao h TYR 61 Cb 1.16 -0.10 -0.10 0.00 1.54 0.00 0.00 36.73 39.23 2dao h TYR 61 CO 0.54 -0.25 0.16 1.49 -1.64 0.00 0.00 178.16 178.46 2dao h GLU 62 N 0.01 0.26 0.00 1.82 4.81 -1.95 0.57 114.58 120.10 2dao h GLU 62 Ca 0.89 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 60.10 2dao h GLU 62 Cb 2.94 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 32.26 2dao h GLU 62 CO -0.41 0.17 0.00 1.63 -0.73 0.00 0.00 179.01 179.67 2dao n LYS 63 N -5.15 0.16 -0.00 1.92 5.02 0.23 -3.86 118.16 116.47 2dao n LYS 63 Ca 0.12 0.17 -0.00 0.00 -2.02 0.00 0.00 58.31 56.58 2dao n LYS 63 Cb 0.41 -1.70 -0.00 0.00 -0.02 0.00 0.00 35.03 33.72 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 -1.36 1.97 4.05 0.29 -3.35 114.93 116.53 2dao h MET 64 Ca 0.00 0.00 0.42 0.00 -0.28 0.00 0.00 59.70 59.84 2dao h MET 64 Cb 0.61 0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 31.33 2dao h MET 64 CO 0.00 0.00 0.94 0.45 0.23 0.00 0.00 176.91 178.53 2dao n SER 65 N -2.18 0.07 -0.13 1.39 2.88 -0.01 -1.18 113.62 114.46 2dao n SER 65 Ca -0.00 0.92 -0.03 0.00 -1.33 0.00 0.00 58.87 58.42 2dao n SER 65 Cb 0.00 -0.45 -0.03 0.00 -0.75 0.00 0.00 64.21 62.98 2dao n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2dao n ARG 66 N -3.84 -0.13 -0.12 -1.46 1.74 -1.25 -1.73 116.66 109.86 2dao n ARG 66 Ca 0.34 1.09 -0.05 0.00 -0.77 0.00 0.00 57.85 58.46 2dao n ARG 66 Cb 1.44 -1.62 -0.04 0.00 -1.02 0.00 0.00 32.46 31.21 2dao n ARG 66 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dao h ALA 67 N -0.48 -0.34 -0.72 7.54 0.00 -1.37 0.25 119.26 124.13 2dao h ALA 67 Ca 0.05 0.03 0.30 0.00 0.00 0.00 0.00 54.91 55.28 2dao h ALA 67 Cb 0.13 1.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.83 2dao h ALA 67 CO -0.29 -0.49 0.37 1.28 0.00 0.00 0.00 179.25 180.13 2dao n LEU 68 N -3.88 0.24 0.07 0.00 7.99 -0.70 -0.40 117.00 120.31 2dao n LEU 68 Ca -0.00 1.19 -0.03 0.00 -0.01 0.00 0.00 56.01 57.16 2dao n LEU 68 Cb 0.12 -0.58 -0.01 0.00 -0.11 0.00 0.00 43.42 42.84 2dao n LEU 68 CO -0.04 -1.33 0.50 -0.09 -1.51 0.00 0.00 177.39 174.93 2dao h ARG 69 N 0.00 -0.17 -1.57 3.23 1.12 0.04 -1.22 114.38 115.81 2dao h ARG 69 Ca 0.60 0.01 0.50 0.00 -1.11 0.00 0.00 59.98 59.99 2dao h ARG 69 Cb 1.59 0.04 -0.12 0.00 -0.01 0.00 0.00 29.97 31.47 2dao h ARG 69 CO -0.56 -0.11 1.06 0.45 -3.11 0.00 0.00 179.97 177.71 2dao h HIS 70 N -0.17 0.33 -0.25 2.20 3.86 -0.60 1.48 115.15 122.00 2dao h HIS 70 Ca -0.02 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 59.03 2dao h HIS 70 Cb 0.14 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.53 2dao h HIS 70 CO 0.14 -0.17 -0.55 1.88 0.86 0.00 0.00 177.93 180.08 2dao h TYR 71 N 0.01 1.03 -0.79 2.45 0.05 -1.07 -3.25 116.97 115.40 2dao h TYR 71 Ca 0.89 -0.39 0.16 0.00 0.05 0.00 0.00 58.73 59.44 2dao h TYR 71 Cb 3.11 -0.19 -0.15 0.00 1.01 0.00 0.00 36.73 40.52 2dao h TYR 71 CO -0.00 1.20 -0.22 1.88 -1.05 0.00 0.00 178.16 179.97 2dao h TYR 72 N 0.57 -0.48 -0.89 4.88 0.05 0.33 0.46 116.97 121.88 2dao h TYR 72 Ca 0.00 0.07 0.12 0.00 0.05 0.00 0.00 58.73 58.98 2dao h TYR 72 Cb 1.17 0.34 -0.08 0.00 1.01 0.00 0.00 36.73 39.16 2dao h TYR 72 CO 0.08 -0.35 0.52 0.87 -1.05 0.00 0.00 178.16 178.23 2dao h LYS 73 N -0.01 0.78 0.00 4.88 1.57 -1.58 0.43 116.57 122.63 2dao h LYS 73 Ca 0.37 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 2dao h LYS 73 Cb 0.58 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2dao h LYS 73 CO -0.82 0.51 0.00 1.28 -0.57 0.00 0.00 179.45 179.85 2dao n LEU 74 N -4.75 0.00 -2.10 2.94 4.77 0.16 -4.83 117.00 113.19 2dao n LEU 74 Ca 0.17 0.34 -0.09 0.00 -0.03 0.00 0.00 56.01 56.39 2dao n LEU 74 Cb 0.36 -0.34 0.04 0.00 -2.33 0.00 0.00 43.42 41.16 2dao n LEU 74 CO 0.25 -0.25 0.08 -3.20 -1.33 0.00 0.00 177.39 172.93 2dao n ASN 75 N -1.34 -2.76 -0.04 -1.43 2.85 0.15 -4.97 115.26 107.72 2dao n ASN 75 Ca 0.03 -0.28 -0.06 0.00 -0.11 0.00 0.00 54.58 54.15 2dao n ASN 75 Cb 0.06 -2.70 -0.04 0.00 1.24 0.00 0.00 39.78 38.34 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 -2.93 0.47 -4.70 -1.44 5.41 -1.22 -4.57 119.36 110.38 2dao n ILE 76 Ca -0.09 -0.17 -0.23 0.00 1.00 0.00 0.00 62.75 63.26 2dao n ILE 76 Cb 0.56 -0.96 -0.15 0.00 -0.71 0.00 0.00 39.64 38.38 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 -2.16 1.19 -0.22 1.39 1.01 -1.26 -1.83 121.20 119.31 2dao s ILE 77 Ca -0.11 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 59.91 2dao s ILE 77 Cb 0.03 -1.00 0.05 0.00 0.01 0.00 0.00 42.46 41.56 2dao s ILE 77 CO 0.18 0.34 -0.09 -0.60 0.00 0.00 0.00 174.94 174.77 2dao s ARG 78 N -0.31 1.94 -0.37 2.79 6.06 -0.90 -4.13 118.95 124.02 2dao s ARG 78 Ca 0.05 -1.00 -0.28 0.00 -2.50 0.00 0.00 55.73 51.99 2dao s ARG 78 Cb -0.06 -2.58 0.02 0.00 0.06 0.00 0.00 34.95 32.38 2dao s ARG 78 CO -0.00 -0.52 1.04 0.21 -2.50 0.00 0.00 175.30 173.53 2dao s LYS 79 N 1.33 3.91 0.29 5.12 2.20 -1.26 -1.85 119.74 129.48 2dao s LYS 79 Ca -0.05 0.79 -0.29 0.00 -0.36 0.00 0.00 55.97 56.06 2dao s LYS 79 Cb -0.18 -3.80 -0.10 0.00 -1.51 0.00 0.00 37.83 32.24 2dao s LYS 79 CO -0.07 -1.04 1.43 -1.21 -0.36 0.00 0.00 175.35 174.10 2dao s GLU 80 N 3.79 4.26 -0.01 4.03 0.41 -1.17 -4.95 118.70 125.06 2dao s GLU 80 Ca 0.44 2.34 -0.25 0.00 -0.41 0.00 0.00 54.97 57.09 2dao s GLU 80 Cb -0.11 -3.07 -0.19 0.00 -1.78 0.00 0.00 34.13 28.98 2dao s GLU 80 CO 0.20 -0.39 1.29 -1.00 -0.49 0.00 0.00 175.26 174.86 2dao h PRO 81 N 4.31 0.08 -0.57 0.39 0.13 -1.94 -3.34 132.00 131.06 2dao h PRO 81 Ca -0.47 -0.04 0.05 0.00 -0.87 0.00 0.00 66.00 64.67 2dao h PRO 81 Cb 1.22 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.28 2dao h PRO 81 CO 0.73 0.54 -0.38 0.78 -0.23 0.00 0.00 178.00 179.44 2dao h GLY 82 N -0.38 -1.49 -0.81 1.56 0.00 -2.01 -3.41 103.07 96.53 2dao h GLY 82 Ca 0.01 0.90 -0.45 0.00 0.00 0.00 0.00 47.33 47.79 2dao h GLY 82 CO 0.01 -0.34 0.39 1.20 0.00 0.00 0.00 176.54 177.79 2dao s GLN 83 N -4.62 0.63 0.00 4.80 -1.52 -1.25 -5.07 119.66 112.62 2dao s GLN 83 Ca -0.08 -0.28 0.00 0.00 -1.95 0.00 0.00 55.36 53.05 2dao s GLN 83 Cb 0.07 -1.83 0.00 0.00 -0.22 0.00 0.00 33.01 31.03 2dao s GLN 83 CO 0.40 -2.44 0.00 0.54 -0.25 0.00 0.00 175.29 173.53 2dao n ARG 84 N -3.82 0.00 -2.33 2.91 3.00 -1.26 -4.70 116.66 110.46 2dao n ARG 84 Ca 0.14 0.06 -0.41 0.00 -0.01 0.00 0.00 57.85 57.62 2dao n ARG 84 Cb 0.60 -0.39 0.00 0.00 0.00 0.00 0.00 32.46 32.67 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 7.40 -4.32 0.55 4.32 -1.26 -4.92 117.00 116.84 2dao n LEU 85 Ca 0.00 -4.98 -0.32 0.00 -0.02 0.00 0.00 56.01 50.69 2dao n LEU 85 Cb 0.00 -1.34 -0.15 0.00 -1.62 0.00 0.00 43.42 40.31 2dao n LEU 85 CO 0.00 1.86 -0.51 -0.22 -1.22 0.00 0.00 177.39 177.30 2dao s LEU 86 N -2.23 2.35 -0.00 2.23 1.98 -1.26 -3.08 118.68 118.67 2dao s LEU 86 Ca 0.45 -0.42 0.02 0.00 -2.89 0.00 0.00 54.13 51.29 2dao s LEU 86 Cb 0.15 -1.47 -0.00 0.00 0.66 0.00 0.00 46.19 45.52 2dao s LEU 86 CO -0.05 0.23 -0.05 -0.36 -1.89 0.00 0.00 176.35 174.22 2dao s PHE 87 N -0.05 0.45 -0.22 5.38 0.08 -1.12 -3.03 117.98 119.47 2dao s PHE 87 Ca -0.05 -0.10 0.01 0.00 0.12 0.00 0.00 56.93 56.90 2dao s PHE 87 Cb -0.14 -0.29 0.03 0.00 -0.57 0.00 0.00 43.02 42.05 2dao s PHE 87 CO 0.04 -0.01 -0.13 0.50 -0.10 0.00 0.00 175.22 175.52 2dao s ARG 88 N -0.17 2.72 -0.71 0.44 3.52 -0.77 -2.32 118.95 121.65 2dao s ARG 88 Ca 0.01 -1.03 -0.23 0.00 -0.13 0.00 0.00 55.73 54.35 2dao s ARG 88 Cb -0.02 -2.79 -0.18 0.00 -1.56 0.00 0.00 34.95 30.40 2dao s ARG 88 CO -0.00 -0.37 1.89 1.19 -0.81 0.00 0.00 175.30 177.19 2dao n PHE 89 N 4.58 1.70 0.00 5.12 3.72 -1.18 -2.13 117.46 129.28 2dao n PHE 89 Ca -0.18 -1.59 0.00 0.00 -0.05 0.00 0.00 57.45 55.63 2dao n PHE 89 Cb 0.47 -1.68 0.00 0.00 -0.94 0.00 0.00 39.48 37.33 2dao n PHE 89 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 2dao n MET 90 N 7.26 0.00 -3.16 -1.08 2.81 -0.76 -4.50 117.12 117.68 2dao n MET 90 Ca 0.49 0.70 -0.24 0.00 -1.81 0.00 0.00 57.70 56.83 2dao n MET 90 Cb 0.41 -1.10 -0.01 0.00 -0.71 0.00 0.00 33.22 31.82 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 -2.47 3.42 0.19 0.03 2.47 -1.22 -5.05 119.74 117.10 2dao s LYS 91 Ca 0.00 -0.26 -0.30 0.00 -1.56 0.00 0.00 55.97 53.85 2dao s LYS 91 Cb 0.00 -2.59 -0.08 0.00 -1.46 0.00 0.00 37.83 33.70 2dao s LYS 91 CO 0.00 0.00 1.25 0.99 0.16 0.00 0.00 175.35 177.75 2dao s THR 92 N -2.44 3.41 0.04 3.43 2.01 -1.26 -4.96 115.64 115.86 2dao s THR 92 Ca 0.43 1.17 -0.20 0.00 0.31 0.00 0.00 61.69 63.39 2dao s THR 92 Cb -0.10 -3.75 -0.14 0.00 0.01 0.00 0.00 72.50 68.52 2dao s THR 92 CO 0.38 0.18 1.34 1.55 -0.69 0.00 0.00 174.62 177.38 2dao h PRO 93 N 5.31 0.34 0.00 4.92 0.13 -1.97 -2.68 132.00 138.06 2dao h PRO 93 Ca -0.45 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2dao h PRO 93 Cb 1.21 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2dao h PRO 93 CO 0.76 0.73 0.03 -0.25 -0.23 0.00 0.00 178.00 179.04 2dao n ASP 94 N -4.57 0.24 -0.08 1.44 9.92 -1.26 -2.18 116.55 120.06 2dao n ASP 94 Ca -0.06 0.59 -0.09 0.00 -0.53 0.00 0.00 54.79 54.70 2dao n ASP 94 Cb 0.36 -0.62 -0.04 0.00 -0.64 0.00 0.00 41.12 40.18 2dao n ASP 94 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2dao n GLU 95 N -1.82 0.49 -0.34 -1.24 4.07 -1.10 -4.37 120.64 116.34 2dao n GLU 95 Ca -0.01 0.45 0.20 0.00 -0.06 0.00 0.00 57.16 57.74 2dao n GLU 95 Cb 0.04 -1.63 0.43 0.00 -0.06 0.00 0.00 31.44 30.22 2dao n GLU 95 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 2dao h ILE 96 N -1.00 0.52 -0.46 6.31 2.04 -1.19 -2.48 117.51 121.25 2dao h ILE 96 Ca -0.08 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.64 2dao h ILE 96 Cb 0.78 -0.03 -0.06 0.00 -0.74 0.00 0.00 36.82 36.77 2dao h ILE 96 CO -0.05 0.09 -0.27 0.23 0.00 0.00 0.00 178.15 178.15 2dao n MET 97 N -4.80 -0.20 -1.27 2.37 2.81 -0.93 -4.16 117.12 110.94 2dao n MET 97 Ca 0.27 0.99 -0.25 0.00 -1.81 0.00 0.00 57.70 56.89 2dao n MET 97 Cb 0.80 -1.46 -0.17 0.00 -0.71 0.00 0.00 33.22 31.69 2dao n MET 97 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2dao n SER 98 N -4.10 -0.68 -4.45 7.83 3.41 -0.94 -4.77 113.62 109.92 2dao n SER 98 Ca 0.01 -0.23 -0.44 0.00 -0.26 0.00 0.00 58.87 57.95 2dao n SER 98 Cb 0.12 -0.57 -0.01 0.00 -0.26 0.00 0.00 64.21 63.48 2dao n SER 98 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dao s GLY 99 N 2.90 2.26 -0.09 5.00 0.00 -1.26 -4.64 107.32 111.50 2dao s GLY 99 Ca 1.13 -3.14 -0.02 0.00 0.00 0.00 0.00 44.72 42.69 2dao s GLY 99 CO 0.46 1.97 -0.09 0.54 0.00 0.00 0.00 173.10 175.97 2dao n ARG 100 N 5.80 0.20 0.00 2.90 5.12 -1.26 -4.91 116.66 124.51 2dao n ARG 100 Ca 0.30 0.07 0.00 0.00 -1.93 0.00 0.00 57.85 56.28 2dao n ARG 100 Cb 0.45 -0.99 0.00 0.00 -1.16 0.00 0.00 32.46 30.76 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 -3.07 0.00 -3.86 0.55 -1.04 -1.26 -4.95 114.28 100.65 2dao n THR 101 Ca -0.16 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.52 2dao n THR 101 Cb 0.64 -1.36 -0.12 0.00 -1.82 0.00 0.00 70.33 67.66 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 -4.95 4.71 0.18 8.00 2.15 -1.26 -5.08 116.67 120.42 2dao s ASP 102 Ca 0.00 -2.91 0.08 0.00 0.43 0.00 0.00 52.55 50.15 2dao s ASP 102 Cb 0.00 -1.73 -0.04 0.00 -0.30 0.00 0.00 42.92 40.85 2dao s ASP 102 CO 0.00 -0.29 -0.06 0.00 -0.17 0.00 0.00 175.17 174.65 2dao s ARG 103 N -0.14 2.19 -0.08 4.34 1.70 -1.26 -4.82 118.95 120.88 2dao s ARG 103 Ca 0.17 -1.21 0.11 0.00 -0.47 0.00 0.00 55.73 54.33 2dao s ARG 103 Cb -0.23 -2.23 0.17 0.00 -0.57 0.00 0.00 34.95 32.09 2dao s ARG 103 CO -0.02 0.44 1.09 1.47 -1.08 0.00 0.00 175.30 177.20 2dao n LEU 104 N -0.04 2.17 -0.32 -1.89 -0.00 -1.26 -4.74 117.00 110.92 2dao n LEU 104 Ca -0.10 -2.62 0.03 0.00 -0.00 0.00 0.00 56.01 53.32 2dao n LEU 104 Cb 0.55 -0.26 0.18 0.00 -0.00 0.00 0.00 43.42 43.89 2dao n LEU 104 CO 0.36 0.62 1.18 -0.33 -0.00 0.00 0.00 177.39 179.22 2dao h GLU 105 N 0.00 0.88 -1.03 1.47 3.07 -1.96 -0.56 114.58 116.45 2dao h GLU 105 Ca 0.00 -0.05 0.30 0.00 -0.50 0.00 0.00 59.36 59.11 2dao h GLU 105 Cb 0.82 -0.20 -0.04 0.00 -0.84 0.00 0.00 28.75 28.49 2dao h GLU 105 CO 0.00 0.58 0.89 0.45 -1.40 0.00 0.00 179.01 179.53 2dao h HIS 106 N 0.91 0.00 -0.20 4.33 3.86 -2.04 0.49 115.15 122.50 2dao h HIS 106 Ca 0.42 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.52 2dao h HIS 106 Cb 0.33 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 28.74 2dao h HIS 106 CO -0.04 0.00 0.13 1.28 0.86 0.00 0.00 177.93 180.17 2dao n LEU 107 N -3.82 4.00 -0.05 2.43 7.99 -0.22 -4.15 117.00 123.18 2dao n LEU 107 Ca 0.22 -2.02 -0.13 0.00 -0.01 0.00 0.00 56.01 54.07 2dao n LEU 107 Cb 1.23 -0.64 -0.12 0.00 -0.11 0.00 0.00 43.42 43.78 2dao n LEU 107 CO 0.34 0.67 0.42 1.05 -1.51 0.00 0.00 177.39 178.36 2dao h GLU 108 N 0.32 -0.01 -2.30 3.23 4.11 -0.20 -3.37 114.58 116.36 2dao h GLU 108 Ca 0.12 0.00 -0.69 0.00 0.07 0.00 0.00 59.36 58.86 2dao h GLU 108 Cb 1.32 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.22 2dao h GLU 108 CO 0.23 0.83 0.12 0.45 0.07 0.00 0.00 179.01 180.70 2dao n SER 109 N -4.68 5.71 -4.40 3.06 2.88 -1.26 -4.88 113.62 110.05 2dao n SER 109 Ca -0.09 -3.66 -0.20 0.00 -1.33 0.00 0.00 58.87 53.59 2dao n SER 109 Cb 0.41 -0.85 -0.10 0.00 -0.75 0.00 0.00 64.21 62.91 2dao n SER 109 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2dao s GLN 110 N -3.72 1.51 0.00 -1.46 0.74 -1.26 -4.65 119.66 110.82 2dao s GLN 110 Ca 0.43 -1.79 0.00 0.00 0.05 0.00 0.00 55.36 54.06 2dao s GLN 110 Cb 0.22 -0.89 0.00 0.00 1.10 0.00 0.00 33.01 33.44 2dao s GLN 110 CO -0.11 -0.07 0.00 -0.85 -0.55 0.00 0.00 175.29 173.70 2dao n GLU 111 N -0.56 -2.49 -0.90 1.67 -0.00 -1.26 -4.63 120.64 112.48 2dao n GLU 111 Ca -0.04 0.00 0.05 0.00 -0.00 0.00 0.00 57.16 57.17 2dao n GLU 111 Cb 0.64 -3.71 0.10 0.00 -0.00 0.00 0.00 31.44 28.48 2dao n GLU 111 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2dao n LEU 112 N -1.96 1.70 -3.89 -1.84 4.77 -1.26 -4.75 117.00 109.78 2dao n LEU 112 Ca 0.00 -2.75 -0.27 0.00 -0.03 0.00 0.00 56.01 52.96 2dao n LEU 112 Cb 0.38 -0.25 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2dao n LEU 112 CO 0.00 0.85 -0.05 -0.24 -1.33 0.00 0.00 177.39 176.63 2dao n SER 113 N -0.38 -2.36 -4.76 -1.43 2.88 -1.26 -4.90 113.62 101.40 2dao n SER 113 Ca 0.11 -0.87 -0.39 0.00 -1.33 0.00 0.00 58.87 56.40 2dao n SER 113 Cb 0.87 -3.63 0.01 0.00 -0.75 0.00 0.00 64.21 60.71 2dao n SER 113 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dao s GLY 114 N -3.91 2.88 -0.20 0.46 0.00 -1.26 -4.93 107.32 100.35 2dao s GLY 114 Ca 0.30 1.20 -0.29 0.00 0.00 0.00 0.00 44.72 45.92 2dao s GLY 114 CO 0.85 1.73 1.60 2.56 0.00 0.00 0.00 173.10 179.84 2dao s PRO 115 N -2.54 3.86 -0.42 2.90 0.04 -1.26 -4.98 135.00 132.60 2dao s PRO 115 Ca 0.63 1.72 -0.05 0.00 0.04 0.00 0.00 61.00 63.33 2dao s PRO 115 Cb -0.37 -4.01 0.10 0.00 0.04 0.00 0.00 34.50 30.27 2dao s PRO 115 CO 0.45 -1.21 0.23 -1.54 0.04 0.00 0.00 177.00 174.98 2dao s SER 116 N 4.00 5.40 -1.28 6.66 1.04 -1.26 -4.62 113.70 123.64 2dao s SER 116 Ca 0.71 -1.89 -0.07 0.00 0.48 0.00 0.00 55.95 55.18 2dao s SER 116 Cb -0.26 -1.89 0.01 0.00 0.10 0.00 0.00 66.02 63.98 2dao s SER 116 CO 0.28 -0.56 1.11 -0.24 0.98 0.00 0.00 173.24 174.81 2dao n SER 117 N 4.72 -5.36 0.00 7.02 2.88 -1.26 -5.32 113.62 116.30 2dao n SER 117 Ca -0.05 -0.54 0.04 0.00 -1.33 0.00 0.00 58.87 56.99 2dao n SER 117 Cb 0.41 -4.89 0.23 0.00 -0.75 0.00 0.00 64.21 59.21 2dao n SER 117 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42