#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 -5.54 -3.81 1.61 2.88 -1.26 -5.00 113.62 102.49 2dao n SER 2 Ca 0.00 -0.55 -0.12 0.00 -1.33 0.00 0.00 58.87 56.86 2dao n SER 2 Cb 0.00 -5.04 -0.11 0.00 -0.75 0.00 0.00 64.21 58.30 2dao n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dao s SER 3 N -3.52 -0.16 0.61 -3.46 0.01 -1.26 -5.10 113.70 100.82 2dao s SER 3 Ca 0.47 0.27 0.00 0.00 1.31 0.00 0.00 55.95 58.00 2dao s SER 3 Cb -0.21 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.39 2dao s SER 3 CO 0.73 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.84 2dao n GLY 4 N 2.59 1.92 3.65 3.44 0.00 -1.26 -4.76 105.19 110.77 2dao n GLY 4 Ca -0.15 -0.59 -0.49 0.00 0.00 0.00 0.00 46.02 44.78 2dao n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dao n SER 5 N 2.33 2.57 -3.61 1.61 3.41 -1.26 -4.97 113.62 113.71 2dao n SER 5 Ca 0.00 1.08 -0.16 0.00 -0.26 0.00 0.00 58.87 59.53 2dao n SER 5 Cb 0.00 -1.31 -0.07 0.00 -0.26 0.00 0.00 64.21 62.57 2dao n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dao s SER 6 N 1.33 -0.55 0.00 4.04 1.04 -1.26 -4.98 113.70 113.33 2dao s SER 6 Ca 0.84 0.69 0.00 0.00 0.48 0.00 0.00 55.95 57.96 2dao s SER 6 Cb -0.81 0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2dao s SER 6 CO 0.45 -0.49 0.00 0.61 0.98 0.00 0.00 173.24 174.79 2dao n GLY 7 N 1.40 3.05 0.16 7.32 0.00 -1.26 -4.87 105.19 110.99 2dao n GLY 7 Ca -0.18 -1.17 -0.06 0.00 0.00 0.00 0.00 46.02 44.61 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 -3.88 0.55 0.84 0.00 0.52 -1.26 -5.17 118.95 110.55 2dao s ARG 9 Ca -0.06 1.24 -0.11 0.00 -0.52 0.00 0.00 55.73 56.28 2dao s ARG 9 Cb 0.01 0.47 0.18 0.00 0.52 0.00 0.00 34.95 36.13 2dao s ARG 9 CO 0.18 -0.19 0.40 1.28 0.02 0.00 0.00 175.30 177.00 2dao n LEU 10 N 4.99 0.00 -0.03 2.53 4.77 -1.26 -4.80 117.00 123.19 2dao n LEU 10 Ca -0.15 -0.41 -0.02 0.00 -0.03 0.00 0.00 56.01 55.41 2dao n LEU 10 Cb 0.53 -0.61 -0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2dao n LEU 10 CO -0.01 -2.24 -0.12 0.25 -1.33 0.00 0.00 177.39 173.94 2dao h LEU 11 N 0.00 0.00 -0.68 2.23 5.85 -1.97 -3.07 115.31 117.67 2dao h LEU 11 Ca -0.18 0.00 0.21 0.00 0.84 0.00 0.00 57.88 58.74 2dao h LEU 11 Cb 0.62 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 41.52 2dao h LEU 11 CO 0.11 0.35 0.08 -2.67 -0.34 0.00 0.00 178.44 175.97 2dao n TRP 12 N -3.47 0.50 -0.04 1.25 4.27 -1.26 0.19 117.44 118.89 2dao n TRP 12 Ca -0.02 0.82 -0.14 0.00 -3.89 0.00 0.00 57.50 54.27 2dao n TRP 12 Cb 0.09 -1.05 -0.08 0.00 -1.36 0.00 0.00 31.31 28.90 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 0.36 -1.09 -0.67 3.58 -1.95 -3.12 116.42 113.53 2dao h ASP 13 Ca 0.45 -0.57 0.32 0.00 0.42 0.00 0.00 57.03 57.64 2dao h ASP 13 Cb 0.98 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.88 2dao h ASP 13 CO -0.62 0.86 1.22 0.00 -2.88 0.00 0.00 179.24 177.82 2dao n TYR 14 N -4.51 0.00 0.26 0.28 9.36 0.50 0.31 117.16 123.35 2dao n TYR 14 Ca -0.07 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.01 2dao n TYR 14 Cb 0.42 -0.27 -0.07 0.00 -0.63 0.00 0.00 39.34 38.78 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 0.34 0.00 2.97 2.07 -1.43 -2.78 116.25 117.42 2dao h VAL 15 Ca 0.52 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.60 2dao h VAL 15 Cb 2.95 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 33.20 2dao h VAL 15 CO -0.01 0.05 0.33 0.22 0.02 0.00 0.00 177.57 178.19 2dao h TYR 16 N -1.00 0.00 0.06 1.57 3.20 -0.32 0.29 116.97 120.77 2dao h TYR 16 Ca -0.07 0.00 -0.26 0.00 3.14 0.00 0.00 58.73 61.54 2dao h TYR 16 Cb 0.61 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.89 2dao h TYR 16 CO 0.01 0.00 -1.10 0.37 -1.64 0.00 0.00 178.16 175.80 2dao h GLN 17 N 0.00 0.52 0.06 1.82 5.75 -1.38 -3.27 115.11 118.60 2dao h GLN 17 Ca 0.00 -0.63 -0.00 0.00 -0.15 0.00 0.00 58.65 57.87 2dao h GLN 17 Cb 0.67 0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.42 2dao h GLN 17 CO 0.00 1.25 -0.03 -0.07 -2.65 0.00 0.00 178.83 177.33 2dao h LEU 18 N 0.26 -0.07 -0.83 -2.39 3.38 -0.35 -3.34 115.31 111.97 2dao h LEU 18 Ca -0.13 -0.25 0.24 0.00 0.09 0.00 0.00 57.88 57.82 2dao h LEU 18 Cb 1.76 0.02 -0.16 0.00 0.09 0.00 0.00 40.66 42.37 2dao h LEU 18 CO 0.20 0.54 0.04 0.18 0.09 0.00 0.00 178.44 179.50 2dao n LEU 19 N -4.79 -0.07 -0.12 1.67 7.99 -0.74 -0.47 117.00 120.46 2dao n LEU 19 Ca -0.04 1.42 -0.08 0.00 -0.01 0.00 0.00 56.01 57.30 2dao n LEU 19 Cb 0.15 -0.53 -0.06 0.00 -0.11 0.00 0.00 43.42 42.88 2dao n LEU 19 CO 0.12 -1.44 0.50 -1.28 -1.51 0.00 0.00 177.39 173.77 2dao h SER 20 N 0.00 -1.19 -4.08 -1.43 0.87 -1.68 -3.41 113.55 102.63 2dao h SER 20 Ca 0.52 0.16 -0.54 0.00 -1.23 0.00 0.00 61.79 60.70 2dao h SER 20 Cb 1.10 0.50 0.13 0.00 -0.44 0.00 0.00 62.40 63.68 2dao h SER 20 CO -0.78 -0.23 0.52 -1.81 -0.53 0.00 0.00 176.83 174.01 2dao s ASP 21 N -4.23 5.07 -0.07 6.23 1.01 0.38 -4.95 116.67 120.11 2dao s ASP 21 Ca -0.09 2.57 0.20 0.00 0.71 0.00 0.00 52.55 55.94 2dao s ASP 21 Cb 0.05 -2.62 -0.28 0.00 1.01 0.00 0.00 42.92 41.09 2dao s ASP 21 CO 0.38 -1.68 0.40 -1.54 0.21 0.00 0.00 175.17 172.94 2dao n SER 22 N -1.47 0.11 0.00 0.27 3.41 -1.26 -4.14 113.62 110.54 2dao n SER 22 Ca 0.13 0.05 0.05 0.00 -0.26 0.00 0.00 58.87 58.84 2dao n SER 22 Cb 0.48 1.45 0.28 0.00 -0.26 0.00 0.00 64.21 66.15 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 -2.49 0.13 0.00 4.33 1.74 -1.26 -1.34 116.66 117.77 2dao n ARG 23 Ca -0.14 0.20 0.07 0.00 -0.77 0.00 0.00 57.85 57.21 2dao n ARG 23 Cb 0.78 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.65 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 -1.32 0.00 -0.23 -1.55 4.02 -1.26 -4.62 117.16 112.20 2dao n TYR 24 Ca 0.05 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.03 2dao n TYR 24 Cb 0.10 0.00 0.19 0.00 -0.02 0.00 0.00 39.34 39.60 2dao n TYR 24 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 2dao n GLU 25 N -1.20 -0.05 -0.18 -0.72 0.00 -0.45 0.21 120.64 118.24 2dao n GLU 25 Ca 0.03 1.00 -0.00 0.00 0.00 0.00 0.00 57.16 58.19 2dao n GLU 25 Cb 0.24 -1.59 0.09 0.00 0.00 0.00 0.00 31.44 30.18 2dao n GLU 25 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 2dao h ASN 26 N 0.00 -0.20 -0.18 4.31 4.21 -1.82 -1.97 115.58 119.94 2dao h ASN 26 Ca 0.40 0.13 -0.08 0.00 1.21 0.00 0.00 56.30 57.95 2dao h ASN 26 Cb 0.80 0.23 -0.00 0.00 -1.12 0.00 0.00 38.32 38.22 2dao h ASN 26 CO -0.63 -0.08 -0.21 -0.26 -1.29 0.00 0.00 177.43 174.96 2dao h PHE 27 N 0.14 0.57 -2.14 1.19 0.04 0.21 -3.41 116.94 113.53 2dao h PHE 27 Ca 0.29 -0.18 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 2dao h PHE 27 Cb 0.46 -0.12 -0.22 0.00 2.20 0.00 0.00 35.95 38.27 2dao h PHE 27 CO -0.32 0.85 -0.02 -1.50 -0.60 0.00 0.00 178.31 176.71 2dao s ILE 28 N -4.25 -0.00 0.29 -0.55 2.07 -0.39 -1.29 121.20 117.08 2dao s ILE 28 Ca -0.14 0.01 0.03 0.00 -1.41 0.00 0.00 60.65 59.15 2dao s ILE 28 Cb 0.06 -0.92 -0.06 0.00 0.13 0.00 0.00 42.46 41.67 2dao s ILE 28 CO 0.78 0.01 0.06 0.00 -1.91 0.00 0.00 174.94 173.88 2dao s ARG 29 N 1.31 1.54 -0.43 3.50 1.70 -1.20 -3.62 118.95 121.75 2dao s ARG 29 Ca -0.08 -1.84 -0.27 0.00 -0.47 0.00 0.00 55.73 53.07 2dao s ARG 29 Cb -0.05 -0.66 0.02 0.00 -0.57 0.00 0.00 34.95 33.69 2dao s ARG 29 CO -0.14 -0.21 1.00 -1.58 -1.08 0.00 0.00 175.30 173.29 2dao s TRP 30 N -3.45 2.94 -0.01 5.89 0.23 -1.26 -3.25 118.94 120.04 2dao s TRP 30 Ca 0.36 0.64 -0.19 0.00 -2.03 0.00 0.00 56.10 54.89 2dao s TRP 30 Cb 0.08 -4.02 -0.10 0.00 0.03 0.00 0.00 33.47 29.46 2dao s TRP 30 CO 0.14 -1.06 0.83 0.93 0.96 0.00 0.00 176.95 178.75 2dao h GLU 31 N 8.91 -0.65 -2.72 4.98 4.39 -0.81 -3.42 114.58 125.26 2dao h GLU 31 Ca -0.23 0.04 -0.60 0.00 0.34 0.00 0.00 59.36 58.92 2dao h GLU 31 Cb 1.07 0.15 -0.39 0.00 -0.10 0.00 0.00 28.75 29.47 2dao h GLU 31 CO 1.05 -0.43 -0.81 -0.51 -1.16 0.00 0.00 179.01 177.14 2dao s ASP 32 N -4.43 3.05 0.39 1.42 1.11 0.02 -4.98 116.67 113.25 2dao s ASP 32 Ca -0.10 -2.61 0.16 0.00 0.18 0.00 0.00 52.55 50.18 2dao s ASP 32 Cb 0.01 -0.71 1.04 0.00 1.07 0.00 0.00 42.92 44.32 2dao s ASP 32 CO 0.29 -0.25 1.80 0.11 1.18 0.00 0.00 175.17 178.30 2dao h LYS 33 N 6.56 0.45 -0.84 8.23 1.79 -1.82 0.74 116.57 131.69 2dao h LYS 33 Ca 0.08 -0.03 0.20 0.00 -2.18 0.00 0.00 60.65 58.72 2dao h LYS 33 Cb 0.93 -0.10 -0.15 0.00 -1.58 0.00 0.00 32.23 31.33 2dao h LYS 33 CO 0.39 0.30 -0.03 1.05 -1.08 0.00 0.00 179.45 180.08 2dao h GLU 34 N 0.46 0.06 -0.25 3.15 4.11 -1.95 0.96 114.58 121.13 2dao h GLU 34 Ca 0.55 -0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.91 2dao h GLU 34 Cb 1.29 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.49 2dao h GLU 34 CO -0.27 0.04 -0.05 0.45 0.07 0.00 0.00 179.01 179.25 2dao n SER 35 N -5.42 3.04 -4.04 3.06 2.88 -0.35 -4.96 113.62 107.83 2dao n SER 35 Ca 0.16 -3.35 -0.31 0.00 -1.33 0.00 0.00 58.87 54.04 2dao n SER 35 Cb 0.54 -0.56 -0.00 0.00 -0.75 0.00 0.00 64.21 63.43 2dao n SER 35 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2dao n LYS 36 N -0.91 -4.05 -3.11 -1.46 5.02 0.33 -3.98 118.16 110.00 2dao n LYS 36 Ca 0.25 0.47 -0.41 0.00 -2.02 0.00 0.00 58.31 56.60 2dao n LYS 36 Cb 0.90 -5.11 -0.06 0.00 -0.02 0.00 0.00 35.03 30.74 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 -3.46 4.99 0.25 -0.18 1.01 0.11 -2.73 121.20 121.19 2dao s ILE 37 Ca 0.52 1.14 0.10 0.00 0.00 0.00 0.00 60.65 62.40 2dao s ILE 37 Cb -0.27 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.22 2dao s ILE 37 CO 0.88 0.04 -0.07 0.72 0.00 0.00 0.00 174.94 176.51 2dao s PHE 38 N 2.44 2.59 -0.11 3.97 -0.71 -0.82 -0.08 117.98 125.24 2dao s PHE 38 Ca 0.26 -0.25 -0.04 0.00 -1.04 0.00 0.00 56.93 55.87 2dao s PHE 38 Cb -0.16 -1.17 0.06 0.00 -1.21 0.00 0.00 43.02 40.54 2dao s PHE 38 CO 0.09 0.62 0.19 0.50 -1.34 0.00 0.00 175.22 175.27 2dao s ARG 39 N -3.44 0.08 -0.73 1.99 3.52 -1.20 -1.42 118.95 117.75 2dao s ARG 39 Ca 0.29 0.53 -0.26 0.00 -0.13 0.00 0.00 55.73 56.17 2dao s ARG 39 Cb -0.07 -0.41 -0.06 0.00 -1.56 0.00 0.00 34.95 32.85 2dao s ARG 39 CO 0.18 -0.37 2.09 0.42 -0.81 0.00 0.00 175.30 176.81 2dao s ILE 40 N 2.32 3.26 0.32 4.11 1.01 -0.92 -3.76 121.20 127.55 2dao s ILE 40 Ca 0.03 -0.07 0.09 0.00 0.00 0.00 0.00 60.65 60.70 2dao s ILE 40 Cb -0.13 -3.63 0.38 0.00 0.01 0.00 0.00 42.46 39.09 2dao s ILE 40 CO -0.07 -0.61 1.51 0.52 0.00 0.00 0.00 174.94 176.29 2dao n VAL 41 N 7.88 -0.40 -3.55 2.92 0.31 -0.41 -4.13 118.33 120.94 2dao n VAL 41 Ca 0.35 2.05 -0.11 0.00 -0.01 0.00 0.00 64.34 66.61 2dao n VAL 41 Cb 0.49 -3.12 -0.11 0.00 -0.91 0.00 0.00 33.84 30.19 2dao n VAL 41 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2dao s ASP 42 N -4.82 0.26 0.19 4.52 1.11 -1.14 -5.04 116.67 111.76 2dao s ASP 42 Ca -0.11 0.51 -0.05 0.00 0.18 0.00 0.00 52.55 53.08 2dao s ASP 42 Cb 0.30 0.97 0.10 0.00 1.07 0.00 0.00 42.92 45.36 2dao s ASP 42 CO 0.75 -0.26 1.54 1.55 1.18 0.00 0.00 175.17 179.92 2dao h PRO 43 N 8.23 0.72 -0.60 8.23 0.13 -1.90 0.12 132.00 146.93 2dao h PRO 43 Ca -0.16 -0.38 -0.04 0.00 -0.87 0.00 0.00 66.00 64.54 2dao h PRO 43 Cb 1.13 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 2dao h PRO 43 CO 0.19 0.99 0.20 -0.97 -0.23 0.00 0.00 178.00 178.18 2dao h ASN 44 N 0.59 0.86 0.50 1.44 -0.73 -1.96 0.18 115.58 116.46 2dao h ASN 44 Ca 0.05 -0.20 -0.30 0.00 1.87 0.00 0.00 56.30 57.72 2dao h ASN 44 Cb 0.95 -0.22 0.01 0.00 0.27 0.00 0.00 38.32 39.32 2dao h ASN 44 CO 0.09 0.83 -1.39 1.23 -0.37 0.00 0.00 177.43 177.82 2dao h GLY 45 N 0.84 0.37 0.65 1.57 0.00 -1.97 -3.24 103.07 101.29 2dao h GLY 45 Ca 0.19 -0.95 -0.03 0.00 0.00 0.00 0.00 47.33 46.55 2dao h GLY 45 CO -0.01 0.83 -0.07 -2.00 0.00 0.00 0.00 176.54 175.29 2dao h LEU 46 N 0.09 0.20 -0.16 3.11 7.12 -0.71 -3.28 115.31 121.68 2dao h LEU 46 Ca -0.19 -0.46 0.05 0.00 0.13 0.00 0.00 57.88 57.40 2dao h LEU 46 Cb 2.03 -0.06 -0.07 0.00 -0.53 0.00 0.00 40.66 42.04 2dao h LEU 46 CO 0.21 0.62 -0.34 0.00 -0.13 0.00 0.00 178.44 178.80 2dao h ALA 47 N 0.58 -0.39 -0.92 1.25 0.00 -0.77 -1.12 119.26 117.90 2dao h ALA 47 Ca 0.01 0.03 0.33 0.00 0.00 0.00 0.00 54.91 55.28 2dao h ALA 47 Cb 0.56 0.65 -0.17 0.00 0.00 0.00 0.00 17.79 18.83 2dao h ALA 47 CO 0.02 -0.81 0.30 0.54 0.00 0.00 0.00 179.25 179.30 2dao n ARG 48 N -5.41 -0.06 -0.19 0.00 1.74 -1.22 0.20 116.66 111.71 2dao n ARG 48 Ca -0.03 1.31 -0.10 0.00 -0.77 0.00 0.00 57.85 58.27 2dao n ARG 48 Cb 0.33 -2.24 0.01 0.00 -1.02 0.00 0.00 32.46 29.55 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 0.99 -0.72 0.55 3.38 -1.29 0.49 115.31 118.70 2dao h LEU 49 Ca 0.69 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 58.20 2dao h LEU 49 Cb 1.69 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 2dao h LEU 49 CO -0.77 1.07 -0.52 -0.25 0.09 0.00 0.00 178.44 178.06 2dao h TRP 50 N 0.89 0.39 0.00 1.13 2.91 0.26 -3.02 115.95 118.51 2dao h TRP 50 Ca 0.15 -0.13 -0.16 0.00 1.13 0.00 0.00 58.89 59.89 2dao h TRP 50 Cb 0.58 -0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.13 2dao h TRP 50 CO 0.04 0.77 -1.01 0.78 -1.03 0.00 0.00 178.44 177.99 2dao h GLY 51 N 1.30 0.00 0.40 2.65 0.00 -0.18 -3.22 103.07 104.02 2dao h GLY 51 Ca 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 2dao h GLY 51 CO 0.08 0.00 -0.19 -0.57 0.00 0.00 0.00 176.54 175.86 2dao h ASN 52 N 0.00 -0.45 0.06 0.19 -1.24 0.04 0.21 115.58 114.38 2dao h ASN 52 Ca -0.09 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.94 2dao h ASN 52 Cb 1.56 0.12 0.00 0.00 0.73 0.00 0.00 38.32 40.72 2dao h ASN 52 CO 0.07 -0.25 0.00 0.00 -1.29 0.00 0.00 177.43 175.95 2dao n HIS 53 N -3.83 0.62 -0.50 0.67 1.44 -1.15 -0.69 115.22 111.78 2dao n HIS 53 Ca -0.07 0.32 0.06 0.00 -2.01 0.00 0.00 57.72 56.02 2dao n HIS 53 Cb 0.21 -1.01 0.33 0.00 0.12 0.00 0.00 29.99 29.64 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 -2.13 4.06 -4.27 -1.40 4.76 -1.12 -4.91 118.16 113.15 2dao n LYS 54 Ca -0.01 -2.56 -0.37 0.00 -2.87 0.00 0.00 58.31 52.50 2dao n LYS 54 Cb 0.05 -2.08 -0.06 0.00 -1.84 0.00 0.00 35.03 31.10 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 0.58 -2.29 -4.74 4.39 5.15 0.14 -4.91 115.26 113.58 2dao n ASN 55 Ca 0.23 -1.03 -0.34 0.00 -0.60 0.00 0.00 54.58 52.84 2dao n ASN 55 Cb 0.99 -1.95 -0.08 0.00 -0.53 0.00 0.00 39.78 38.21 2dao n ASN 55 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2dao s ARG 56 N -6.96 3.00 -0.18 1.20 6.06 0.71 -5.05 118.95 117.73 2dao s ARG 56 Ca 0.74 -0.47 -0.11 0.00 -2.50 0.00 0.00 55.73 53.39 2dao s ARG 56 Cb -0.42 -2.82 -0.05 0.00 0.06 0.00 0.00 34.95 31.72 2dao s ARG 56 CO 0.91 0.66 0.17 0.99 -2.50 0.00 0.00 175.30 175.53 2dao s THR 57 N -1.08 5.39 -1.29 4.11 2.01 -1.26 -4.46 115.64 119.06 2dao s THR 57 Ca 0.19 0.27 -0.06 0.00 0.31 0.00 0.00 61.69 62.40 2dao s THR 57 Cb -0.12 -3.50 -0.00 0.00 0.01 0.00 0.00 72.50 68.89 2dao s THR 57 CO 0.10 0.45 0.62 0.59 -0.69 0.00 0.00 174.62 175.69 2dao n ASN 58 N 3.35 -2.19 -4.60 3.53 3.02 -1.26 -4.84 115.26 112.27 2dao n ASN 58 Ca -0.16 -0.95 -0.43 0.00 -0.03 0.00 0.00 54.58 53.02 2dao n ASN 58 Cb 0.52 -3.50 -0.03 0.00 -0.61 0.00 0.00 39.78 36.17 2dao n ASN 58 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2dao s MET 59 N -6.16 3.43 0.12 3.52 -2.45 -1.26 -4.99 119.30 111.51 2dao s MET 59 Ca 0.15 1.32 -0.01 0.00 -1.25 0.00 0.00 55.69 55.90 2dao s MET 59 Cb -0.05 -4.14 -0.04 0.00 1.25 0.00 0.00 34.83 31.84 2dao s MET 59 CO 0.85 -1.74 0.30 -0.08 1.05 0.00 0.00 175.02 175.40 2dao s THR 60 N 6.40 5.28 0.52 10.11 -1.32 -1.26 -4.40 115.64 130.97 2dao s THR 60 Ca 0.75 -0.28 0.21 0.00 -1.21 0.00 0.00 61.69 61.16 2dao s THR 60 Cb -0.20 -3.66 0.34 0.00 -1.51 0.00 0.00 72.50 67.47 2dao s THR 60 CO 0.33 0.03 2.06 0.22 -2.21 0.00 0.00 174.62 175.06 2dao h TYR 61 N 2.72 0.01 -0.57 9.09 3.20 -1.94 -2.06 116.97 127.42 2dao h TYR 61 Ca -0.46 0.00 0.11 0.00 3.14 0.00 0.00 58.73 61.52 2dao h TYR 61 Cb 1.17 -0.00 -0.09 0.00 1.54 0.00 0.00 36.73 39.35 2dao h TYR 61 CO 0.59 0.00 0.04 1.49 -1.64 0.00 0.00 178.16 178.64 2dao h GLU 62 N 0.01 0.15 0.00 1.82 4.57 -1.99 0.32 114.58 119.46 2dao h GLU 62 Ca 0.14 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2dao h GLU 62 Cb 0.56 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2dao h GLU 62 CO -0.00 0.10 -0.02 1.63 -1.18 0.00 0.00 179.01 179.54 2dao n LYS 63 N -5.22 0.18 -0.02 1.92 5.02 -0.80 -3.75 118.16 115.49 2dao n LYS 63 Ca 0.08 0.14 -0.00 0.00 -2.02 0.00 0.00 58.31 56.51 2dao n LYS 63 Cb 0.31 -1.70 -0.00 0.00 -0.02 0.00 0.00 35.03 33.62 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 -1.72 1.97 4.05 -0.25 -3.33 114.93 115.64 2dao h MET 64 Ca 0.00 0.00 0.50 0.00 -0.28 0.00 0.00 59.70 59.92 2dao h MET 64 Cb 0.66 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 31.39 2dao h MET 64 CO 0.00 0.00 1.25 0.66 0.23 0.00 0.00 176.91 179.05 2dao h SER 65 N -0.36 0.00 -0.79 1.39 4.64 -0.92 -0.73 113.55 116.78 2dao h SER 65 Ca 0.00 0.00 0.25 0.00 -0.47 0.00 0.00 61.79 61.57 2dao h SER 65 Cb 0.01 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 61.95 2dao h SER 65 CO 0.00 0.00 0.12 0.54 -0.87 0.00 0.00 176.83 176.62 2dao n ARG 66 N -3.99 -0.06 0.02 4.77 5.12 -1.25 -1.17 116.66 120.11 2dao n ARG 66 Ca 0.38 1.16 -0.01 0.00 -1.93 0.00 0.00 57.85 57.46 2dao n ARG 66 Cb 1.78 -1.90 -0.00 0.00 -1.16 0.00 0.00 32.46 31.18 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 1.58 -0.75 -0.72 7.54 0.00 -1.37 -3.01 119.26 122.53 2dao h ALA 67 Ca 0.53 -0.01 0.27 0.00 0.00 0.00 0.00 54.91 55.70 2dao h ALA 67 Cb 1.19 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.87 2dao h ALA 67 CO -0.71 -0.74 0.28 1.28 0.00 0.00 0.00 179.25 179.36 2dao n LEU 68 N -2.16 0.16 0.16 0.00 7.99 -0.32 -0.13 117.00 122.71 2dao n LEU 68 Ca -0.01 1.20 -0.08 0.00 -0.01 0.00 0.00 56.01 57.12 2dao n LEU 68 Cb 0.02 -0.55 -0.04 0.00 -0.11 0.00 0.00 43.42 42.74 2dao n LEU 68 CO 0.01 -1.31 0.51 -0.09 -1.51 0.00 0.00 177.39 175.00 2dao h ARG 69 N 0.00 -0.46 -1.14 3.23 9.65 -1.22 -1.54 114.38 122.89 2dao h ARG 69 Ca 0.56 0.03 0.37 0.00 -1.10 0.00 0.00 59.98 59.85 2dao h ARG 69 Cb 1.42 0.11 -0.13 0.00 -1.39 0.00 0.00 29.97 29.97 2dao h ARG 69 CO -0.59 -0.31 0.70 0.45 2.80 0.00 0.00 179.97 183.02 2dao h HIS 70 N -0.48 0.71 -0.23 2.20 3.86 -0.39 1.31 115.15 122.12 2dao h HIS 70 Ca -0.04 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 2dao h HIS 70 Cb 0.39 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 2dao h HIS 70 CO -0.03 -0.18 -0.23 1.88 0.86 0.00 0.00 177.93 180.23 2dao h TYR 71 N 0.20 0.47 -1.03 2.45 0.05 -0.97 -2.87 116.97 115.27 2dao h TYR 71 Ca 0.76 -0.09 0.26 0.00 0.05 0.00 0.00 58.73 59.71 2dao h TYR 71 Cb 2.09 -0.12 -0.10 0.00 1.01 0.00 0.00 36.73 39.61 2dao h TYR 71 CO -0.01 0.62 0.65 1.88 -1.05 0.00 0.00 178.16 180.25 2dao h TYR 72 N 0.38 0.78 0.00 4.88 0.05 0.27 0.59 116.97 123.93 2dao h TYR 72 Ca 0.06 0.03 -0.15 0.00 0.05 0.00 0.00 58.73 58.72 2dao h TYR 72 Cb 0.61 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 38.10 2dao h TYR 72 CO 0.02 0.07 -0.71 0.87 -1.05 0.00 0.00 178.16 177.35 2dao h LYS 73 N 0.46 0.00 0.00 4.88 6.56 -1.53 -2.88 116.57 124.05 2dao h LYS 73 Ca 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.20 2dao h LYS 73 Cb 1.41 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.07 2dao h LYS 73 CO -0.35 0.71 0.00 1.28 -2.06 0.00 0.00 179.45 179.03 2dao n LEU 74 N -3.66 0.00 -3.70 2.94 4.77 0.20 -4.86 117.00 112.70 2dao n LEU 74 Ca -0.01 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.72 2dao n LEU 74 Cb 0.70 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.85 2dao n LEU 74 CO 0.43 0.00 0.16 0.59 -1.33 0.00 0.00 177.39 177.25 2dao n ASN 75 N -0.85 -5.03 -0.05 -1.43 5.03 -1.00 -4.89 115.26 107.03 2dao n ASN 75 Ca 0.13 -0.65 -0.07 0.00 0.87 0.00 0.00 54.58 54.86 2dao n ASN 75 Cb 0.06 -4.57 -0.05 0.00 -1.02 0.00 0.00 39.78 34.20 2dao n ASN 75 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 2dao n ILE 76 N -4.76 0.60 -4.15 2.41 5.41 -1.19 -4.19 119.36 113.48 2dao n ILE 76 Ca -0.03 -0.24 -0.15 0.00 1.00 0.00 0.00 62.75 63.33 2dao n ILE 76 Cb 0.57 -0.86 -0.14 0.00 -0.71 0.00 0.00 39.64 38.49 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 -2.21 0.46 0.11 1.39 1.01 -1.26 -2.46 121.20 118.24 2dao s ILE 77 Ca -0.14 -0.41 0.09 0.00 0.00 0.00 0.00 60.65 60.19 2dao s ILE 77 Cb 0.04 -0.42 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 2dao s ILE 77 CO 0.25 0.02 -0.23 -0.13 0.00 0.00 0.00 174.94 174.85 2dao s ARG 78 N -0.44 1.21 -0.45 2.79 1.81 -0.31 -3.80 118.95 119.77 2dao s ARG 78 Ca -0.00 -1.21 -0.10 0.00 -1.72 0.00 0.00 55.73 52.69 2dao s ARG 78 Cb -0.04 -1.54 0.10 0.00 -0.45 0.00 0.00 34.95 33.02 2dao s ARG 78 CO -0.00 0.36 0.32 0.21 -0.68 0.00 0.00 175.30 175.51 2dao s LYS 79 N -1.93 2.60 0.27 3.54 2.20 -1.26 -0.38 119.74 124.79 2dao s LYS 79 Ca 0.09 -1.59 -0.30 0.00 -0.36 0.00 0.00 55.97 53.80 2dao s LYS 79 Cb -0.10 -3.90 -0.12 0.00 -1.51 0.00 0.00 37.83 32.20 2dao s LYS 79 CO 0.05 -1.08 1.64 -1.21 -0.36 0.00 0.00 175.35 174.38 2dao s GLU 80 N 1.43 4.12 1.18 4.03 2.02 -1.11 -4.99 118.70 125.37 2dao s GLU 80 Ca 0.04 2.60 -0.18 0.00 0.02 0.00 0.00 54.97 57.45 2dao s GLU 80 Cb -0.25 -3.03 0.28 0.00 0.10 0.00 0.00 34.13 31.22 2dao s GLU 80 CO 0.01 -0.68 1.11 -1.25 0.02 0.00 0.00 175.26 174.48 2dao s PRO 81 N -0.05 -1.04 0.00 0.39 0.04 -1.26 -4.20 135.00 128.88 2dao s PRO 81 Ca 0.67 0.00 0.00 0.00 0.04 0.00 0.00 61.00 61.71 2dao s PRO 81 Cb -0.49 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2dao s PRO 81 CO 0.44 -3.60 0.00 0.41 0.04 0.00 0.00 177.00 174.29 2dao n GLY 82 N -0.96 1.01 2.34 0.56 0.00 -1.26 -4.86 105.19 102.02 2dao n GLY 82 Ca 0.12 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.23 -0.02 1.61 1.13 -1.26 -5.02 117.38 111.59 2dao n GLN 83 Ca 0.00 -0.76 -0.02 0.00 -1.94 0.00 0.00 57.00 54.27 2dao n GLN 83 Cb 0.00 -1.24 -0.01 0.00 0.11 0.00 0.00 30.24 29.10 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 -2.61 0.13 -2.60 -1.09 0.63 -1.26 -4.82 116.66 105.04 2dao n ARG 84 Ca 0.07 0.05 -0.32 0.00 -0.92 0.00 0.00 57.85 56.73 2dao n ARG 84 Cb 0.31 -0.62 -0.00 0.00 0.45 0.00 0.00 32.46 32.60 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 -3.14 5.67 -4.57 6.15 7.99 -1.26 -5.01 117.00 122.83 2dao n LEU 85 Ca -0.04 -5.38 -0.35 0.00 -0.01 0.00 0.00 56.01 50.24 2dao n LEU 85 Cb 0.13 -0.75 -0.11 0.00 -0.11 0.00 0.00 43.42 42.58 2dao n LEU 85 CO 0.05 2.17 -0.28 -0.22 -1.51 0.00 0.00 177.39 177.60 2dao s LEU 86 N -3.78 3.61 0.06 2.23 1.98 -1.26 -2.16 118.68 119.36 2dao s LEU 86 Ca 0.47 -0.02 0.05 0.00 -2.89 0.00 0.00 54.13 51.73 2dao s LEU 86 Cb 0.31 -1.91 -0.03 0.00 0.66 0.00 0.00 46.19 45.22 2dao s LEU 86 CO -0.19 0.14 -0.13 -0.36 -1.89 0.00 0.00 176.35 173.91 2dao s PHE 87 N 0.58 1.12 -0.16 5.38 0.08 -0.51 -2.76 117.98 121.72 2dao s PHE 87 Ca 0.02 -0.46 0.00 0.00 0.12 0.00 0.00 56.93 56.61 2dao s PHE 87 Cb -0.13 -0.64 0.03 0.00 -0.57 0.00 0.00 43.02 41.71 2dao s PHE 87 CO 0.02 0.03 -0.11 0.50 -0.10 0.00 0.00 175.22 175.55 2dao s ARG 88 N -1.66 2.04 -1.33 0.44 3.52 0.49 -1.95 118.95 120.50 2dao s ARG 88 Ca -0.03 -0.58 -0.15 0.00 -0.13 0.00 0.00 55.73 54.84 2dao s ARG 88 Cb -0.10 -2.09 0.09 0.00 -1.56 0.00 0.00 34.95 31.29 2dao s ARG 88 CO 0.02 -0.31 1.85 1.19 -0.81 0.00 0.00 175.30 177.24 2dao n PHE 89 N 4.79 4.16 0.00 5.12 3.72 -1.11 -1.16 117.46 132.98 2dao n PHE 89 Ca -0.15 -2.96 0.00 0.00 -0.05 0.00 0.00 57.45 54.28 2dao n PHE 89 Cb 0.49 -2.45 0.00 0.00 -0.94 0.00 0.00 39.48 36.58 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 6.64 0.00 -2.33 -1.08 2.81 -1.03 -4.63 117.12 117.50 2dao n MET 90 Ca 0.47 0.48 -0.34 0.00 -1.81 0.00 0.00 57.70 56.50 2dao n MET 90 Cb 0.42 -1.24 -0.01 0.00 -0.71 0.00 0.00 33.22 31.68 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 -1.97 3.52 0.27 0.03 2.47 -1.19 -4.99 119.74 117.88 2dao s LYS 91 Ca 0.00 1.43 -0.29 0.00 -1.56 0.00 0.00 55.97 55.54 2dao s LYS 91 Cb 0.00 -2.05 -0.10 0.00 -1.46 0.00 0.00 37.83 34.23 2dao s LYS 91 CO 0.00 -0.68 1.30 0.99 0.16 0.00 0.00 175.35 177.13 2dao s THR 92 N -1.99 2.97 0.03 3.43 2.01 -1.26 -4.92 115.64 115.91 2dao s THR 92 Ca 0.69 0.88 -0.21 0.00 0.31 0.00 0.00 61.69 63.36 2dao s THR 92 Cb -0.19 -3.56 -0.15 0.00 0.01 0.00 0.00 72.50 68.61 2dao s THR 92 CO 0.26 0.17 1.34 1.55 -0.69 0.00 0.00 174.62 177.25 2dao h PRO 93 N 4.38 0.32 -0.12 4.92 0.13 -1.94 -3.05 132.00 136.64 2dao h PRO 93 Ca -0.47 -0.17 0.04 0.00 -0.87 0.00 0.00 66.00 64.53 2dao h PRO 93 Cb 1.22 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2dao h PRO 93 CO 0.72 0.71 0.13 -0.44 -0.23 0.00 0.00 178.00 178.89 2dao h ASP 94 N -0.06 0.00 -0.30 1.44 3.32 -2.01 -2.40 116.42 116.41 2dao h ASP 94 Ca 0.02 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.14 2dao h ASP 94 Cb 0.65 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.13 2dao h ASP 94 CO 0.03 0.00 -0.15 -0.08 -1.72 0.00 0.00 179.24 177.32 2dao h GLU 95 N 0.00 -0.10 0.32 3.56 4.22 -1.93 -2.69 114.58 117.96 2dao h GLU 95 Ca 0.06 0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.49 2dao h GLU 95 Cb 0.32 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2dao h GLU 95 CO -0.00 -0.07 -0.15 0.82 -2.18 0.00 0.00 179.01 177.43 2dao h ILE 96 N -0.11 0.71 -0.72 2.32 5.03 -1.58 -3.18 117.51 119.99 2dao h ILE 96 Ca 0.16 -0.42 0.12 0.00 -0.12 0.00 0.00 64.86 64.59 2dao h ILE 96 Cb 0.34 0.93 -0.12 0.00 -3.03 0.00 0.00 36.82 34.94 2dao h ILE 96 CO -0.37 0.08 -0.25 0.23 -0.68 0.00 0.00 178.15 177.17 2dao n MET 97 N -5.18 -0.14 0.00 2.37 2.81 -1.07 -1.35 117.12 114.57 2dao n MET 97 Ca -0.10 1.11 0.00 0.00 -1.81 0.00 0.00 57.70 56.90 2dao n MET 97 Cb 0.25 -1.65 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 2dao n MET 97 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2dao n SER 98 N -5.09 0.00 0.00 7.83 7.64 -1.04 -4.93 113.62 118.04 2dao n SER 98 Ca 0.09 0.78 0.00 0.00 1.01 0.00 0.00 58.87 60.75 2dao n SER 98 Cb 0.31 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 2dao n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dao n GLY 99 N -0.99 0.38 0.99 0.23 0.00 -0.45 -5.13 105.19 100.22 2dao n GLY 99 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 46.02 45.83 2dao n GLY 99 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2dao n ARG 100 N 0.00 0.00 -2.14 1.61 0.63 -1.26 -5.08 116.66 110.41 2dao n ARG 100 Ca 0.00 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.65 2dao n ARG 100 Cb 0.00 -0.01 0.04 0.00 0.45 0.00 0.00 32.46 32.95 2dao n ARG 100 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2dao s THR 101 N -1.01 3.40 -0.53 5.15 2.01 -1.26 -4.85 115.64 118.55 2dao s THR 101 Ca -0.00 0.18 -0.25 0.00 0.31 0.00 0.00 61.69 61.93 2dao s THR 101 Cb 0.00 -3.41 -0.14 0.00 0.01 0.00 0.00 72.50 68.96 2dao s THR 101 CO 0.00 -0.48 1.67 -0.67 -0.69 0.00 0.00 174.62 174.46 2dao n ASP 102 N -2.82 0.33 -2.97 3.53 2.03 -1.26 -4.47 116.55 110.92 2dao n ASP 102 Ca 0.06 0.27 -0.37 0.00 0.52 0.00 0.00 54.79 55.27 2dao n ASP 102 Cb 0.58 -0.62 -0.09 0.00 -0.72 0.00 0.00 41.12 40.27 2dao n ASP 102 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2dao n ARG 103 N 5.49 0.00 -0.04 -0.67 1.74 -1.26 -4.72 116.66 117.20 2dao n ARG 103 Ca 0.42 0.00 0.15 0.00 -0.77 0.00 0.00 57.85 57.64 2dao n ARG 103 Cb 0.00 -1.03 0.57 0.00 -1.02 0.00 0.00 32.46 30.99 2dao n ARG 103 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2dao h LEU 104 N 6.87 0.22 -1.85 0.55 6.46 -1.94 -1.91 115.31 123.71 2dao h LEU 104 Ca -0.06 0.01 0.55 0.00 -0.12 0.00 0.00 57.88 58.26 2dao h LEU 104 Cb 0.95 -0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.74 2dao h LEU 104 CO 0.82 0.13 1.30 -0.33 -0.62 0.00 0.00 178.44 179.74 2dao h GLU 105 N 0.24 0.00 -0.84 1.25 4.39 -1.97 0.47 114.58 118.12 2dao h GLU 105 Ca 0.26 -0.00 0.21 0.00 0.34 0.00 0.00 59.36 60.17 2dao h GLU 105 Cb 0.70 -0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.22 2dao h GLU 105 CO -0.05 0.00 0.24 1.25 -1.16 0.00 0.00 179.01 179.29 2dao h HIS 106 N 0.00 0.37 -0.09 4.33 2.76 -1.69 0.23 115.15 121.06 2dao h HIS 106 Ca 0.93 0.05 -0.06 0.00 -2.20 0.00 0.00 60.37 59.09 2dao h HIS 106 Cb 3.58 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 32.48 2dao h HIS 106 CO -0.00 -0.15 0.08 1.28 -1.30 0.00 0.00 177.93 177.84 2dao n LEU 107 N -5.18 5.50 -0.03 0.26 4.77 0.17 -4.30 117.00 118.19 2dao n LEU 107 Ca 0.19 -2.55 -0.14 0.00 -0.03 0.00 0.00 56.01 53.48 2dao n LEU 107 Cb 0.61 -1.10 -0.10 0.00 -2.33 0.00 0.00 43.42 40.50 2dao n LEU 107 CO 0.09 1.04 0.54 -0.08 -1.33 0.00 0.00 177.39 177.65 2dao h GLU 108 N 1.06 0.11 0.04 3.23 4.57 -0.72 -3.34 114.58 119.53 2dao h GLU 108 Ca 0.06 -0.08 -0.38 0.00 -1.18 0.00 0.00 59.36 57.78 2dao h GLU 108 Cb 0.99 0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.54 2dao h GLU 108 CO 0.14 0.70 -2.22 0.43 -1.18 0.00 0.00 179.01 176.88 2dao n SER 109 N -4.69 2.02 -0.24 1.04 7.64 -1.26 -4.39 113.62 113.74 2dao n SER 109 Ca -0.08 0.09 0.13 0.00 1.01 0.00 0.00 58.87 60.01 2dao n SER 109 Cb 0.36 -0.66 0.25 0.00 -1.01 0.00 0.00 64.21 63.15 2dao n SER 109 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2dao n GLN 110 N -3.56 -0.05 0.39 1.43 -0.06 -1.26 0.68 117.38 114.95 2dao n GLN 110 Ca -0.41 1.05 -0.19 0.00 -2.00 0.00 0.00 57.00 55.45 2dao n GLN 110 Cb 0.97 -1.71 -0.09 0.00 -4.06 0.00 0.00 30.24 25.35 2dao n GLN 110 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2dao h GLU 111 N 0.00 -1.00 -7.25 3.69 5.08 -1.77 -3.43 114.58 109.91 2dao h GLU 111 Ca 0.47 0.07 -0.52 0.00 -1.00 0.00 0.00 59.36 58.38 2dao h GLU 111 Cb 1.04 0.23 0.13 0.00 0.50 0.00 0.00 28.75 30.65 2dao h GLU 111 CO -0.64 -0.66 0.34 -0.51 -1.00 0.00 0.00 179.01 176.53 2dao s LEU 112 N -10.07 3.18 -0.51 1.33 1.43 0.22 -4.79 118.68 109.46 2dao s LEU 112 Ca -0.18 2.01 -0.19 0.00 -1.03 0.00 0.00 54.13 54.74 2dao s LEU 112 Cb 0.04 -4.55 0.06 0.00 0.03 0.00 0.00 46.19 41.77 2dao s LEU 112 CO 0.61 -2.06 0.64 -0.44 0.23 0.00 0.00 176.35 175.33 2dao s SER 113 N -2.81 6.22 0.00 2.29 0.01 -1.26 -4.90 113.70 113.25 2dao s SER 113 Ca 0.66 -0.95 0.00 0.00 1.31 0.00 0.00 55.95 56.97 2dao s SER 113 Cb -0.21 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2dao s SER 113 CO 0.49 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.84 2dao n GLY 114 N 5.18 3.24 0.00 3.44 0.00 -1.26 -5.00 105.19 110.79 2dao n GLY 114 Ca -0.07 -0.70 0.06 0.00 0.00 0.00 0.00 46.02 45.31 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 0.49 -1.04 1.61 -0.04 -1.26 -4.89 135.00 129.87 2dao n PRO 115 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 2dao n PRO 115 Cb 0.00 -1.35 -0.04 0.00 -0.04 0.00 0.00 33.50 32.07 2dao n PRO 115 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dao n SER 116 N -0.85 -0.49 -4.57 3.54 2.88 -1.26 -4.66 113.62 108.21 2dao n SER 116 Ca 0.08 0.82 -0.53 0.00 -1.33 0.00 0.00 58.87 57.92 2dao n SER 116 Cb 0.04 -0.67 -0.06 0.00 -0.75 0.00 0.00 64.21 62.76 2dao n SER 116 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dao n SER 117 N 1.27 1.35 0.00 -3.46 3.41 -1.26 -5.05 113.62 109.89 2dao n SER 117 Ca 0.14 1.13 0.00 0.00 -0.26 0.00 0.00 58.87 59.87 2dao n SER 117 Cb 0.12 -1.15 0.00 0.00 -0.26 0.00 0.00 64.21 62.92 2dao n SER 117 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49