#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 1.33 1.08 1.61 1.04 -1.26 -5.16 113.70 112.34 2dao s SER 2 Ca 0.00 -1.46 -0.16 0.00 0.48 0.00 0.00 55.95 54.81 2dao s SER 2 Cb 0.00 0.27 0.23 0.00 0.10 0.00 0.00 66.02 66.62 2dao s SER 2 CO 0.00 -0.80 1.15 -0.44 0.98 0.00 0.00 173.24 174.13 2dao s SER 3 N -3.34 1.99 0.03 7.02 0.01 -1.26 -4.97 113.70 113.18 2dao s SER 3 Ca 0.37 0.71 -0.30 0.00 1.31 0.00 0.00 55.95 58.04 2dao s SER 3 Cb 0.07 -1.05 -0.05 0.00 0.21 0.00 0.00 66.02 65.19 2dao s SER 3 CO 0.15 -3.47 1.21 -0.83 0.41 0.00 0.00 173.24 170.72 2dao s GLY 4 N -4.01 2.30 0.00 3.44 0.00 -1.26 -4.89 107.32 102.89 2dao s GLY 4 Ca 0.69 0.80 0.00 0.00 0.00 0.00 0.00 44.72 46.21 2dao s GLY 4 CO 0.55 2.11 0.00 -1.26 0.00 0.00 0.00 173.10 174.51 2dao n SER 5 N 4.32 1.84 -3.39 1.64 2.88 -1.26 -5.12 113.62 114.52 2dao n SER 5 Ca 0.10 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.54 2dao n SER 5 Cb 0.46 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.90 2dao n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dao s SER 6 N -4.54 0.19 0.00 -3.46 1.04 -1.26 -5.15 113.70 100.52 2dao s SER 6 Ca 0.00 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.32 2dao s SER 6 Cb 0.00 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.84 2dao s SER 6 CO 0.00 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 173.42 2dao n GLY 7 N -0.50 0.74 3.85 7.32 0.00 -1.26 -5.09 105.19 110.25 2dao n GLY 7 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.31 0.89 1.30 0.00 1.81 -1.26 -5.14 118.95 114.24 2dao s ARG 9 Ca 0.43 -0.41 -0.22 0.00 -1.72 0.00 0.00 55.73 53.81 2dao s ARG 9 Cb -0.14 -0.86 0.33 0.00 -0.45 0.00 0.00 34.95 33.84 2dao s ARG 9 CO 0.20 0.23 0.89 1.28 -0.68 0.00 0.00 175.30 177.22 2dao n LEU 10 N 2.76 0.00 -0.00 2.53 4.77 -1.26 -4.86 117.00 120.94 2dao n LEU 10 Ca -0.14 -0.92 -0.00 0.00 -0.03 0.00 0.00 56.01 54.92 2dao n LEU 10 Cb 0.56 -0.93 -0.00 0.00 -2.33 0.00 0.00 43.42 40.72 2dao n LEU 10 CO 0.25 -2.53 -0.01 -0.11 -1.33 0.00 0.00 177.39 173.66 2dao n LEU 11 N 0.00 0.03 -0.34 2.23 7.94 -1.26 -3.93 117.00 121.67 2dao n LEU 11 Ca 0.13 0.00 0.28 0.00 -1.11 0.00 0.00 56.01 55.32 2dao n LEU 11 Cb 0.56 -0.44 0.47 0.00 0.53 0.00 0.00 43.42 44.54 2dao n LEU 11 CO 0.37 -0.50 0.85 -2.67 -1.11 0.00 0.00 177.39 174.34 2dao n TRP 12 N -2.53 0.42 -0.04 1.96 4.27 -1.26 0.23 117.44 120.50 2dao n TRP 12 Ca -0.00 0.43 -0.14 0.00 -3.89 0.00 0.00 57.50 53.89 2dao n TRP 12 Cb 0.01 -0.81 -0.11 0.00 -1.36 0.00 0.00 31.31 29.03 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 0.11 -1.84 -0.67 3.58 -1.99 -3.23 116.42 112.38 2dao h ASP 13 Ca 0.60 -0.74 0.55 0.00 0.42 0.00 0.00 57.03 57.86 2dao h ASP 13 Cb 2.00 -0.03 -0.09 0.00 1.72 0.00 0.00 39.33 42.93 2dao h ASP 13 CO -0.28 0.83 1.31 0.00 -2.88 0.00 0.00 179.24 178.22 2dao n TYR 14 N -4.64 0.10 0.28 0.28 9.36 0.63 -0.31 117.16 122.87 2dao n TYR 14 Ca -0.09 0.10 -0.17 0.00 3.32 0.00 0.00 57.90 61.06 2dao n TYR 14 Cb 0.42 -0.57 -0.09 0.00 -0.63 0.00 0.00 39.34 38.47 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 -0.72 2.97 2.07 -1.54 -3.05 116.25 115.98 2dao h VAL 15 Ca 0.91 0.00 0.07 0.00 0.82 0.00 0.00 66.70 68.50 2dao h VAL 15 Cb 3.55 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 33.22 2dao h VAL 15 CO -0.07 0.00 -0.56 0.22 0.02 0.00 0.00 177.57 177.18 2dao h TYR 16 N -0.93 -1.75 -1.08 1.57 3.20 -0.86 0.45 116.97 117.58 2dao h TYR 16 Ca -0.06 0.11 0.39 0.00 3.14 0.00 0.00 58.73 62.31 2dao h TYR 16 Cb 0.80 0.86 -0.13 0.00 1.54 0.00 0.00 36.73 39.80 2dao h TYR 16 CO -0.21 -0.43 0.66 1.04 -1.64 0.00 0.00 178.16 177.58 2dao n GLN 17 N -5.32 -0.04 -0.02 1.82 6.02 -1.16 0.23 117.38 118.90 2dao n GLN 17 Ca -0.00 1.11 -0.08 0.00 -0.01 0.00 0.00 57.00 58.01 2dao n GLN 17 Cb 0.31 -2.12 -0.07 0.00 1.02 0.00 0.00 30.24 29.38 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 -0.06 -0.21 1.08 3.38 -0.08 -3.35 115.31 116.07 2dao h LEU 18 Ca 0.74 -0.46 0.05 0.00 0.09 0.00 0.00 57.88 58.30 2dao h LEU 18 Cb 2.27 0.02 -0.07 0.00 0.09 0.00 0.00 40.66 42.96 2dao h LEU 18 CO -0.48 0.64 -0.41 -0.07 0.09 0.00 0.00 178.44 178.21 2dao h LEU 19 N -0.96 -1.30 -0.73 1.67 -0.00 0.70 -1.32 115.31 113.37 2dao h LEU 19 Ca -0.01 0.18 0.20 0.00 -0.00 0.00 0.00 57.88 58.25 2dao h LEU 19 Cb 0.52 0.54 -0.14 0.00 -0.00 0.00 0.00 40.66 41.59 2dao h LEU 19 CO 0.01 -0.40 -0.00 -0.24 -0.00 0.00 0.00 178.44 177.81 2dao n SER 20 N -5.43 -0.10 -4.76 -0.43 2.88 0.23 -4.01 113.62 102.01 2dao n SER 20 Ca -0.03 1.24 -0.37 0.00 -1.33 0.00 0.00 58.87 58.38 2dao n SER 20 Cb 0.35 -0.45 -0.06 0.00 -0.75 0.00 0.00 64.21 63.30 2dao n SER 20 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2dao s ASP 21 N -5.02 6.64 -0.33 -3.46 1.11 -0.50 -4.97 116.67 110.15 2dao s ASP 21 Ca -0.10 0.76 0.01 0.00 0.18 0.00 0.00 52.55 53.41 2dao s ASP 21 Cb 0.21 -2.24 0.35 0.00 1.07 0.00 0.00 42.92 42.31 2dao s ASP 21 CO 0.57 0.14 1.75 -1.20 1.18 0.00 0.00 175.17 177.60 2dao n SER 22 N 3.05 4.82 -0.07 0.27 7.64 -1.26 -4.12 113.62 123.95 2dao n SER 22 Ca -0.11 -3.08 -0.16 0.00 1.01 0.00 0.00 58.87 56.53 2dao n SER 22 Cb 0.52 -0.84 -0.14 0.00 -1.01 0.00 0.00 64.21 62.74 2dao n SER 22 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2dao n ARG 23 N -0.28 0.69 -0.37 1.43 1.74 -1.26 -4.18 116.66 114.43 2dao n ARG 23 Ca 0.37 0.18 0.06 0.00 -0.77 0.00 0.00 57.85 57.68 2dao n ARG 23 Cb 0.96 -1.62 0.21 0.00 -1.02 0.00 0.00 32.46 30.99 2dao n ARG 23 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2dao n TYR 24 N -3.19 0.90 -0.23 -1.55 4.02 -1.26 -4.60 117.16 111.25 2dao n TYR 24 Ca -0.34 -0.36 -0.06 0.00 -0.01 0.00 0.00 57.90 57.13 2dao n TYR 24 Cb 1.05 -0.17 -0.05 0.00 -0.02 0.00 0.00 39.34 40.15 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 0.57 -0.24 -0.33 -0.72 2.13 -1.23 0.23 120.64 121.06 2dao n GLU 25 Ca 0.15 0.94 0.21 0.00 0.66 0.00 0.00 57.16 59.13 2dao n GLU 25 Cb 0.58 -1.39 0.42 0.00 0.27 0.00 0.00 31.44 31.33 2dao n GLU 25 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 2dao h ASN 26 N 0.00 0.40 -0.05 4.31 2.35 -1.93 0.67 115.58 121.33 2dao h ASN 26 Ca 0.09 0.19 -0.05 0.00 -0.55 0.00 0.00 56.30 55.97 2dao h ASN 26 Cb 0.22 0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2dao h ASN 26 CO -0.51 -0.13 -0.18 -0.26 -1.65 0.00 0.00 177.43 174.70 2dao h PHE 27 N 0.31 0.27 -2.19 1.19 0.04 0.25 -3.39 116.94 113.43 2dao h PHE 27 Ca 0.69 -0.12 -0.06 0.00 2.80 0.00 0.00 57.97 61.28 2dao h PHE 27 Cb 1.51 -0.04 -0.21 0.00 2.20 0.00 0.00 35.95 39.40 2dao h PHE 27 CO -0.07 0.81 0.05 -1.50 -0.60 0.00 0.00 178.31 177.00 2dao s ILE 28 N -3.66 0.00 0.26 -0.55 2.07 0.87 -1.55 121.20 118.64 2dao s ILE 28 Ca -0.15 -0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.04 2dao s ILE 28 Cb 0.02 -0.90 -0.02 0.00 0.13 0.00 0.00 42.46 41.70 2dao s ILE 28 CO 0.74 -0.01 0.31 0.00 -1.91 0.00 0.00 174.94 174.07 2dao s ARG 29 N 0.11 1.51 -0.30 3.50 1.70 -1.24 -3.49 118.95 120.74 2dao s ARG 29 Ca -0.02 -1.61 -0.25 0.00 -0.47 0.00 0.00 55.73 53.38 2dao s ARG 29 Cb -0.04 0.37 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 2dao s ARG 29 CO 0.02 -0.57 0.88 -1.58 -1.08 0.00 0.00 175.30 172.96 2dao s TRP 30 N -3.80 3.20 -0.05 5.89 0.52 -1.26 -3.29 118.94 120.15 2dao s TRP 30 Ca 0.33 0.97 -0.14 0.00 0.02 0.00 0.00 56.10 57.28 2dao s TRP 30 Cb 0.03 -3.33 -0.08 0.00 -1.15 0.00 0.00 33.47 28.94 2dao s TRP 30 CO 0.15 -0.60 0.56 0.93 0.02 0.00 0.00 176.95 178.01 2dao h GLU 31 N 8.04 -0.40 -2.69 4.98 4.39 -0.53 -3.43 114.58 124.95 2dao h GLU 31 Ca -0.23 0.03 -0.60 0.00 0.34 0.00 0.00 59.36 58.90 2dao h GLU 31 Cb 1.08 0.09 -0.39 0.00 -0.10 0.00 0.00 28.75 29.43 2dao h GLU 31 CO 0.93 -0.22 -0.83 -0.51 -1.16 0.00 0.00 179.01 177.22 2dao s ASP 32 N -5.10 2.89 0.54 1.42 1.11 -0.68 -4.97 116.67 111.88 2dao s ASP 32 Ca -0.07 -2.76 0.37 0.00 0.18 0.00 0.00 52.55 50.26 2dao s ASP 32 Cb 0.01 -0.72 1.54 0.00 1.07 0.00 0.00 42.92 44.81 2dao s ASP 32 CO 0.23 -0.23 1.79 0.11 1.18 0.00 0.00 175.17 178.25 2dao h LYS 33 N 6.34 0.02 -0.65 8.23 1.79 -1.83 0.24 116.57 130.71 2dao h LYS 33 Ca 0.11 -0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.72 2dao h LYS 33 Cb 0.92 -0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 31.45 2dao h LYS 33 CO 0.41 0.01 -0.05 0.93 -1.08 0.00 0.00 179.45 179.67 2dao h GLU 34 N 0.02 0.07 -0.24 3.15 5.08 -1.95 -1.51 114.58 119.20 2dao h GLU 34 Ca 0.59 -0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.83 2dao h GLU 34 Cb 2.33 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 31.49 2dao h GLU 34 CO -0.03 0.05 -0.18 0.43 -1.00 0.00 0.00 179.01 178.28 2dao n SER 35 N -5.34 2.34 -4.13 1.42 7.64 -0.00 -4.96 113.62 110.58 2dao n SER 35 Ca 0.09 -3.75 -0.29 0.00 1.01 0.00 0.00 58.87 55.94 2dao n SER 35 Cb 0.37 -0.60 -0.05 0.00 -1.01 0.00 0.00 64.21 62.92 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 -1.10 -2.32 -3.47 1.43 5.02 -0.57 -4.27 118.16 112.88 2dao n LYS 36 Ca 0.28 0.28 -0.38 0.00 -2.02 0.00 0.00 58.31 56.47 2dao n LYS 36 Cb 0.92 -4.21 -0.08 0.00 -0.02 0.00 0.00 35.03 31.64 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 -4.06 5.25 0.29 -0.18 1.01 -0.76 -2.61 121.20 120.14 2dao s ILE 37 Ca 0.07 0.56 0.12 0.00 0.00 0.00 0.00 60.65 61.40 2dao s ILE 37 Cb -0.04 -3.66 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 2dao s ILE 37 CO 0.94 0.28 -0.19 0.72 0.00 0.00 0.00 174.94 176.69 2dao s PHE 38 N 1.21 2.31 -0.14 3.97 -0.71 -0.58 0.24 117.98 124.29 2dao s PHE 38 Ca 0.16 -0.34 -0.05 0.00 -1.04 0.00 0.00 56.93 55.66 2dao s PHE 38 Cb -0.14 -1.03 0.07 0.00 -1.21 0.00 0.00 43.02 40.71 2dao s PHE 38 CO 0.07 0.71 0.28 0.50 -1.34 0.00 0.00 175.22 175.43 2dao s ARG 39 N -3.52 0.17 -0.74 1.99 3.52 -1.21 -0.61 118.95 118.55 2dao s ARG 39 Ca 0.30 0.77 -0.26 0.00 -0.13 0.00 0.00 55.73 56.41 2dao s ARG 39 Cb -0.04 -0.02 -0.07 0.00 -1.56 0.00 0.00 34.95 33.25 2dao s ARG 39 CO 0.15 -0.29 2.14 0.42 -0.81 0.00 0.00 175.30 176.91 2dao s ILE 40 N 2.44 3.23 0.25 4.11 1.01 -0.77 -3.92 121.20 127.55 2dao s ILE 40 Ca 0.01 -0.09 -0.13 0.00 0.00 0.00 0.00 60.65 60.44 2dao s ILE 40 Cb -0.12 -3.54 0.33 0.00 0.01 0.00 0.00 42.46 39.13 2dao s ILE 40 CO -0.09 -0.52 1.56 0.58 0.00 0.00 0.00 174.94 176.48 2dao h VAL 41 N 7.38 0.04 -3.15 2.92 2.07 -1.53 -3.37 116.25 120.62 2dao h VAL 41 Ca -0.06 0.00 -0.42 0.00 0.82 0.00 0.00 66.70 67.04 2dao h VAL 41 Cb 1.08 0.04 -0.40 0.00 -1.52 0.00 0.00 31.29 30.49 2dao h VAL 41 CO 1.14 0.00 -0.74 -1.81 0.02 0.00 0.00 177.57 176.18 2dao s ASP 42 N -5.29 1.85 0.27 0.57 1.01 -1.10 -5.02 116.67 108.95 2dao s ASP 42 Ca -0.14 -0.33 0.04 0.00 0.71 0.00 0.00 52.55 52.83 2dao s ASP 42 Cb 0.23 -0.19 0.36 0.00 1.01 0.00 0.00 42.92 44.33 2dao s ASP 42 CO 0.74 -0.31 1.65 1.55 0.21 0.00 0.00 175.17 179.01 2dao h PRO 43 N 8.43 0.30 -0.33 8.23 0.13 -1.88 -0.81 132.00 146.07 2dao h PRO 43 Ca -0.14 -0.16 -0.04 0.00 -0.87 0.00 0.00 66.00 64.80 2dao h PRO 43 Cb 1.14 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2dao h PRO 43 CO 0.23 0.70 0.07 -0.97 -0.23 0.00 0.00 178.00 177.80 2dao h ASN 44 N 0.25 0.52 1.81 1.44 -1.24 -1.96 0.18 115.58 116.58 2dao h ASN 44 Ca 0.02 -0.24 0.00 0.00 0.71 0.00 0.00 56.30 56.78 2dao h ASN 44 Cb 0.90 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.81 2dao h ASN 44 CO 0.07 0.63 -0.17 1.23 -1.29 0.00 0.00 177.43 177.91 2dao h GLY 45 N 0.38 0.00 0.00 1.57 0.00 -1.96 -3.30 103.07 99.76 2dao h GLY 45 Ca 0.10 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 2dao h GLY 45 CO 0.00 0.00 -0.25 -2.00 0.00 0.00 0.00 176.54 174.30 2dao h LEU 46 N 0.00 0.00 -0.91 3.11 7.12 -0.97 -3.37 115.31 120.29 2dao h LEU 46 Ca 0.00 -0.19 0.25 0.00 0.13 0.00 0.00 57.88 58.07 2dao h LEU 46 Cb 0.99 0.00 -0.16 0.00 -0.53 0.00 0.00 40.66 40.96 2dao h LEU 46 CO 0.00 0.73 0.10 0.00 -0.13 0.00 0.00 178.44 179.13 2dao h ALA 47 N -0.81 1.15 -0.62 1.25 0.00 -0.79 -0.18 119.26 119.26 2dao h ALA 47 Ca -0.03 0.29 0.08 0.00 0.00 0.00 0.00 54.91 55.25 2dao h ALA 47 Cb 0.40 0.47 -0.10 0.00 0.00 0.00 0.00 17.79 18.56 2dao h ALA 47 CO -0.02 -0.52 -0.50 0.00 0.00 0.00 0.00 179.25 178.21 2dao h ARG 48 N 0.08 -0.22 -0.69 0.00 3.08 -1.72 0.73 114.38 115.64 2dao h ARG 48 Ca 0.56 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.70 2dao h ARG 48 Cb 1.13 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.18 2dao h ARG 48 CO -0.79 -0.15 0.45 -0.07 -1.07 0.00 0.00 179.97 178.34 2dao h LEU 49 N -0.23 0.56 -0.66 3.04 3.38 -1.19 1.39 115.31 121.60 2dao h LEU 49 Ca 0.15 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.98 2dao h LEU 49 Cb 0.55 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2dao h LEU 49 CO -0.72 0.35 -0.60 -0.25 0.09 0.00 0.00 178.44 177.32 2dao h TRP 50 N 0.63 0.31 0.00 1.13 2.91 0.10 -2.98 115.95 118.05 2dao h TRP 50 Ca 0.31 -0.12 0.00 0.00 1.13 0.00 0.00 58.89 60.21 2dao h TRP 50 Cb 0.37 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 28.97 2dao h TRP 50 CO -0.00 0.78 -1.00 0.41 -1.03 0.00 0.00 178.44 177.60 2dao n GLY 51 N 0.25 -1.18 0.13 2.65 0.00 0.21 -3.59 105.19 103.66 2dao n GLY 51 Ca -0.02 -0.43 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 2dao n GLY 51 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2dao h ASN 52 N 0.00 -0.20 0.64 1.61 -1.24 0.19 0.68 115.58 117.25 2dao h ASN 52 Ca 0.00 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.02 2dao h ASN 52 Cb 0.69 0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.79 2dao h ASN 52 CO 0.00 0.24 0.00 0.00 -1.29 0.00 0.00 177.43 176.38 2dao n HIS 53 N -4.80 0.62 1.35 0.67 1.44 -1.13 -1.83 115.22 111.54 2dao n HIS 53 Ca -0.03 0.25 0.09 0.00 -2.01 0.00 0.00 57.72 56.01 2dao n HIS 53 Cb 0.09 -0.90 0.34 0.00 0.12 0.00 0.00 29.99 29.65 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 -2.07 1.57 -2.62 -1.40 4.76 -1.24 -4.89 118.16 112.26 2dao n LYS 54 Ca 0.02 -0.86 -0.21 0.00 -2.87 0.00 0.00 58.31 54.39 2dao n LYS 54 Cb 0.21 -1.33 0.01 0.00 -1.84 0.00 0.00 35.03 32.07 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 0.11 -5.99 -4.82 4.39 3.02 -0.76 -4.99 115.26 106.22 2dao n ASN 55 Ca 0.14 -0.12 -0.25 0.00 -0.03 0.00 0.00 54.58 54.32 2dao n ASN 55 Cb 0.25 -4.93 -0.05 0.00 -0.61 0.00 0.00 39.78 34.45 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 -5.28 2.94 -0.08 3.52 1.81 0.23 -5.05 118.95 117.04 2dao s ARG 56 Ca 0.11 -0.90 0.02 0.00 -1.72 0.00 0.00 55.73 53.23 2dao s ARG 56 Cb -0.05 -2.64 -0.02 0.00 -0.45 0.00 0.00 34.95 31.78 2dao s ARG 56 CO 0.14 0.46 -0.12 0.99 -0.68 0.00 0.00 175.30 176.09 2dao s THR 57 N -1.86 3.23 -1.44 0.02 2.01 -1.26 -4.49 115.64 111.85 2dao s THR 57 Ca 0.32 -0.64 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 2dao s THR 57 Cb -0.09 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.13 2dao s THR 57 CO 0.24 0.57 0.50 0.59 -0.69 0.00 0.00 174.62 175.83 2dao n ASN 58 N 2.71 -0.92 -4.65 3.53 3.02 -1.26 -4.83 115.26 112.86 2dao n ASN 58 Ca -0.18 -0.99 -0.42 0.00 -0.03 0.00 0.00 54.58 52.96 2dao n ASN 58 Cb 0.52 -3.11 -0.03 0.00 -0.61 0.00 0.00 39.78 36.56 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 -6.57 4.06 -0.06 3.52 -2.45 -1.26 -4.98 119.30 111.55 2dao s MET 59 Ca 0.12 2.37 -0.01 0.00 -1.25 0.00 0.00 55.69 56.92 2dao s MET 59 Cb -0.07 -4.11 -0.03 0.00 1.25 0.00 0.00 34.83 31.87 2dao s MET 59 CO 0.89 -1.02 0.02 -0.08 1.05 0.00 0.00 175.02 175.88 2dao s THR 60 N 4.63 4.43 0.61 10.11 -1.32 -1.26 -4.56 115.64 128.28 2dao s THR 60 Ca 0.83 -0.29 0.41 0.00 -1.21 0.00 0.00 61.69 61.42 2dao s THR 60 Cb -0.38 -2.91 0.42 0.00 -1.51 0.00 0.00 72.50 68.13 2dao s THR 60 CO 0.36 0.54 2.32 0.22 -2.21 0.00 0.00 174.62 175.85 2dao h TYR 61 N 4.87 0.00 -0.93 9.09 3.20 -1.94 -1.98 116.97 129.29 2dao h TYR 61 Ca -0.51 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.42 2dao h TYR 61 Cb 1.19 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 39.40 2dao h TYR 61 CO 0.64 0.00 0.60 0.93 -1.64 0.00 0.00 178.16 178.70 2dao h GLU 62 N 0.00 1.05 0.00 1.82 5.08 -1.99 -1.21 114.58 119.33 2dao h GLU 62 Ca -0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2dao h GLU 62 Cb 0.04 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.05 2dao h GLU 62 CO 0.00 0.70 -0.84 1.63 -1.00 0.00 0.00 179.01 179.50 2dao n LYS 63 N -4.48 0.14 0.02 2.33 5.02 -0.77 -4.37 118.16 116.05 2dao n LYS 63 Ca 0.14 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.42 2dao n LYS 63 Cb 0.18 -1.55 -0.01 0.00 -0.02 0.00 0.00 35.03 33.63 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 -0.08 -1.25 1.97 4.05 -0.98 -3.29 114.93 115.35 2dao h MET 64 Ca 0.00 0.01 0.36 0.00 -0.28 0.00 0.00 59.70 59.79 2dao h MET 64 Cb 0.62 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 31.38 2dao h MET 64 CO 0.00 -0.05 1.22 0.45 0.23 0.00 0.00 176.91 178.76 2dao n SER 65 N -3.03 0.00 -0.31 1.39 2.88 -0.60 -1.58 113.62 112.36 2dao n SER 65 Ca -0.01 0.79 -0.06 0.00 -1.33 0.00 0.00 58.87 58.26 2dao n SER 65 Cb 0.03 -0.31 -0.04 0.00 -0.75 0.00 0.00 64.21 63.14 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 -3.34 -0.28 0.02 -1.46 1.74 -1.24 -1.30 116.66 110.79 2dao n ARG 66 Ca 0.28 1.15 -0.01 0.00 -0.77 0.00 0.00 57.85 58.49 2dao n ARG 66 Cb 1.60 -1.69 -0.01 0.00 -1.02 0.00 0.00 32.46 31.34 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 0.58 -0.73 -0.67 7.54 0.00 -1.54 -2.26 119.26 122.18 2dao h ALA 67 Ca 0.16 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.27 2dao h ALA 67 Cb 0.35 0.34 -0.12 0.00 0.00 0.00 0.00 17.79 18.36 2dao h ALA 67 CO -0.72 -0.73 0.10 1.28 0.00 0.00 0.00 179.25 179.18 2dao n LEU 68 N -2.55 0.00 0.28 0.00 7.99 -0.51 0.03 117.00 122.24 2dao n LEU 68 Ca -0.01 1.14 -0.11 0.00 -0.01 0.00 0.00 56.01 57.01 2dao n LEU 68 Cb 0.03 -0.45 -0.06 0.00 -0.11 0.00 0.00 43.42 42.84 2dao n LEU 68 CO 0.02 -1.18 0.52 -0.09 -1.51 0.00 0.00 177.39 175.15 2dao h ARG 69 N 0.00 -0.70 -1.48 3.23 9.65 -0.74 -1.19 114.38 123.15 2dao h ARG 69 Ca 0.45 0.05 0.46 0.00 -1.10 0.00 0.00 59.98 59.84 2dao h ARG 69 Cb 1.01 0.16 -0.11 0.00 -1.39 0.00 0.00 29.97 29.65 2dao h ARG 69 CO -0.60 -0.47 1.01 0.45 2.80 0.00 0.00 179.97 183.16 2dao h HIS 70 N -0.73 0.33 -0.01 2.20 3.86 0.16 1.69 115.15 122.64 2dao h HIS 70 Ca -0.07 0.01 -0.20 0.00 -1.16 0.00 0.00 60.37 58.95 2dao h HIS 70 Cb 0.57 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 2dao h HIS 70 CO 0.07 -0.12 -0.86 1.88 0.86 0.00 0.00 177.93 179.76 2dao h TYR 71 N 0.06 0.44 -1.00 2.45 0.05 -0.93 -3.23 116.97 114.80 2dao h TYR 71 Ca 0.82 -0.23 0.26 0.00 0.05 0.00 0.00 58.73 59.64 2dao h TYR 71 Cb 2.86 -0.05 -0.13 0.00 1.01 0.00 0.00 36.73 40.41 2dao h TYR 71 CO -0.00 1.02 0.58 1.88 -1.05 0.00 0.00 178.16 180.59 2dao h TYR 72 N 0.18 0.98 -0.35 4.88 0.05 0.38 0.24 116.97 123.33 2dao h TYR 72 Ca -0.05 0.04 -0.15 0.00 0.05 0.00 0.00 58.73 58.62 2dao h TYR 72 Cb 1.47 -0.27 -0.00 0.00 1.01 0.00 0.00 36.73 38.93 2dao h TYR 72 CO 0.04 0.00 -0.37 0.87 -1.05 0.00 0.00 178.16 177.65 2dao h LYS 73 N 0.51 0.86 0.00 4.88 6.56 -1.57 -2.65 116.57 125.17 2dao h LYS 73 Ca 0.66 -0.46 0.00 0.00 -1.06 0.00 0.00 60.65 59.79 2dao h LYS 73 Cb 1.32 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 33.00 2dao h LYS 73 CO -0.51 1.11 0.00 1.28 -2.06 0.00 0.00 179.45 179.27 2dao n LEU 74 N -4.12 0.00 -2.15 2.94 4.77 0.78 -4.83 117.00 114.40 2dao n LEU 74 Ca -0.03 0.26 -0.11 0.00 -0.03 0.00 0.00 56.01 56.11 2dao n LEU 74 Cb 0.53 -0.26 0.04 0.00 -2.33 0.00 0.00 43.42 41.40 2dao n LEU 74 CO 0.48 -0.19 0.10 -3.20 -1.33 0.00 0.00 177.39 173.24 2dao n ASN 75 N -1.26 -3.28 -0.04 -1.43 2.85 -0.82 -4.95 115.26 106.33 2dao n ASN 75 Ca 0.04 -0.29 -0.03 0.00 -0.11 0.00 0.00 54.58 54.19 2dao n ASN 75 Cb 0.06 -2.83 -0.06 0.00 1.24 0.00 0.00 39.78 38.19 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 -3.27 0.49 -3.88 -1.44 5.41 -1.11 -3.90 119.36 111.66 2dao n ILE 76 Ca -0.06 -0.33 -0.11 0.00 1.00 0.00 0.00 62.75 63.25 2dao n ILE 76 Cb 0.55 -0.65 -0.12 0.00 -0.71 0.00 0.00 39.64 38.71 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 -2.25 0.04 -0.15 1.39 1.01 -1.26 -2.74 121.20 117.26 2dao s ILE 77 Ca -0.04 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.25 2dao s ILE 77 Cb 0.03 -0.24 0.03 0.00 0.01 0.00 0.00 42.46 42.29 2dao s ILE 77 CO 0.33 -0.20 -0.10 -0.60 0.00 0.00 0.00 174.94 174.37 2dao s ARG 78 N -0.62 1.91 -0.67 2.79 6.06 0.02 -4.13 118.95 124.32 2dao s ARG 78 Ca -0.07 -0.50 -0.22 0.00 -2.50 0.00 0.00 55.73 52.44 2dao s ARG 78 Cb -0.04 -1.98 0.08 0.00 0.06 0.00 0.00 34.95 33.07 2dao s ARG 78 CO 0.00 -0.30 0.95 0.21 -2.50 0.00 0.00 175.30 173.66 2dao s LYS 79 N 1.56 3.13 0.18 5.12 2.20 -1.26 -0.48 119.74 130.20 2dao s LYS 79 Ca 0.04 -0.94 -0.33 0.00 -0.36 0.00 0.00 55.97 54.37 2dao s LYS 79 Cb -0.14 -4.28 -0.14 0.00 -1.51 0.00 0.00 37.83 31.77 2dao s LYS 79 CO -0.09 -1.79 1.44 0.39 -0.36 0.00 0.00 175.35 174.95 2dao n GLU 80 N 7.49 1.90 -2.02 4.03 1.02 -0.90 -4.94 120.64 127.22 2dao n GLU 80 Ca -0.03 0.68 -0.34 0.00 -0.02 0.00 0.00 57.16 57.45 2dao n GLU 80 Cb 0.45 -2.37 0.02 0.00 -0.02 0.00 0.00 31.44 29.53 2dao n GLU 80 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2dao s PRO 81 N 0.22 3.10 0.00 3.49 0.04 -1.26 -3.80 135.00 136.78 2dao s PRO 81 Ca 0.75 1.51 0.00 0.00 0.04 0.00 0.00 61.00 63.30 2dao s PRO 81 Cb -0.71 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 31.85 2dao s PRO 81 CO 0.45 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.86 2dao n GLY 82 N -0.16 1.15 3.34 0.56 0.00 -1.26 -4.92 105.19 103.90 2dao n GLY 82 Ca 0.11 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 2dao n GLY 82 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2dao n GLN 83 N 0.00 -0.35 -3.49 1.61 -0.06 -1.25 -4.94 117.38 108.90 2dao n GLN 83 Ca 0.00 -0.07 -0.38 0.00 -2.00 0.00 0.00 57.00 54.56 2dao n GLN 83 Cb 0.00 -1.70 -0.09 0.00 -4.06 0.00 0.00 30.24 24.39 2dao n GLN 83 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2dao s ARG 84 N -3.36 4.11 -1.44 3.69 0.52 -1.26 -4.45 118.95 116.76 2dao s ARG 84 Ca 0.54 -0.01 -0.05 0.00 -0.52 0.00 0.00 55.73 55.70 2dao s ARG 84 Cb -0.20 -3.56 0.05 0.00 0.52 0.00 0.00 34.95 31.77 2dao s ARG 84 CO 0.70 -0.04 0.12 1.28 0.02 0.00 0.00 175.30 177.38 2dao n LEU 85 N 4.53 -0.83 -4.61 2.53 7.99 -1.26 -4.70 117.00 120.64 2dao n LEU 85 Ca -0.11 -1.13 -0.39 0.00 -0.01 0.00 0.00 56.01 54.37 2dao n LEU 85 Cb 0.51 -1.42 -0.09 0.00 -0.11 0.00 0.00 43.42 42.31 2dao n LEU 85 CO 0.38 0.35 -0.00 -0.22 -1.51 0.00 0.00 177.39 176.38 2dao s LEU 86 N -6.83 4.05 0.12 2.23 1.98 -1.26 -1.84 118.68 117.12 2dao s LEU 86 Ca 0.16 0.22 0.09 0.00 -2.89 0.00 0.00 54.13 51.72 2dao s LEU 86 Cb -0.09 -2.34 -0.04 0.00 0.66 0.00 0.00 46.19 44.38 2dao s LEU 86 CO 0.90 -0.13 -0.23 -0.36 -1.89 0.00 0.00 176.35 174.63 2dao s PHE 87 N 1.88 2.00 -0.16 5.38 0.08 0.22 -2.11 117.98 125.26 2dao s PHE 87 Ca 0.13 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 56.77 2dao s PHE 87 Cb -0.16 -1.09 0.04 0.00 -0.57 0.00 0.00 43.02 41.25 2dao s PHE 87 CO 0.10 0.27 -0.04 0.50 -0.10 0.00 0.00 175.22 175.94 2dao s ARG 88 N -1.99 1.29 -1.25 0.44 3.52 0.37 -1.52 118.95 119.80 2dao s ARG 88 Ca 0.10 -0.47 -0.18 0.00 -0.13 0.00 0.00 55.73 55.05 2dao s ARG 88 Cb -0.10 -1.95 -0.01 0.00 -1.56 0.00 0.00 34.95 31.33 2dao s ARG 88 CO 0.05 -0.45 1.99 1.19 -0.81 0.00 0.00 175.30 177.27 2dao n PHE 89 N 4.91 3.45 0.00 5.12 3.72 -1.07 -0.80 117.46 132.79 2dao n PHE 89 Ca -0.11 -2.52 0.00 0.00 -0.05 0.00 0.00 57.45 54.76 2dao n PHE 89 Cb 0.48 -2.43 0.00 0.00 -0.94 0.00 0.00 39.48 36.59 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 7.22 0.00 -1.09 -1.08 2.81 -1.11 -4.67 117.12 119.20 2dao n MET 90 Ca 0.50 0.66 -0.31 0.00 -1.81 0.00 0.00 57.70 56.73 2dao n MET 90 Cb 0.42 -1.44 0.12 0.00 -0.71 0.00 0.00 33.22 31.61 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 -2.78 1.79 0.21 0.03 2.47 -1.23 -5.00 119.74 115.23 2dao s LYS 91 Ca 0.00 1.23 -0.26 0.00 -1.56 0.00 0.00 55.97 55.39 2dao s LYS 91 Cb 0.00 -1.84 -0.08 0.00 -1.46 0.00 0.00 37.83 34.45 2dao s LYS 91 CO 0.00 -1.99 0.83 -0.08 0.16 0.00 0.00 175.35 174.27 2dao s THR 92 N -2.83 4.30 0.29 3.43 -1.32 -1.26 -4.97 115.64 113.28 2dao s THR 92 Ca 0.63 1.76 0.16 0.00 -1.21 0.00 0.00 61.69 63.02 2dao s THR 92 Cb -0.19 -4.14 0.10 0.00 -1.51 0.00 0.00 72.50 66.76 2dao s THR 92 CO 0.57 0.44 1.78 1.55 -2.21 0.00 0.00 174.62 176.74 2dao h PRO 93 N 4.05 0.00 0.00 7.08 0.13 -1.94 -2.66 132.00 138.66 2dao h PRO 93 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2dao h PRO 93 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dao h PRO 93 CO 0.66 0.40 0.00 0.22 -0.23 0.00 0.00 178.00 179.05 2dao h ASP 94 N 0.00 0.00 0.21 1.44 1.82 -2.00 -2.44 116.42 115.46 2dao h ASP 94 Ca -0.00 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.50 2dao h ASP 94 Cb 0.80 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.80 2dao h ASP 94 CO 0.05 0.00 -0.52 -0.08 -1.61 0.00 0.00 179.24 177.09 2dao h GLU 95 N 0.00 0.34 0.06 0.28 4.57 -1.81 -3.29 114.58 114.73 2dao h GLU 95 Ca 0.00 -0.20 -0.28 0.00 -1.18 0.00 0.00 59.36 57.70 2dao h GLU 95 Cb 0.56 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 2dao h GLU 95 CO 0.00 0.77 -1.49 0.82 -1.18 0.00 0.00 179.01 177.93 2dao h ILE 96 N 0.27 0.87 -1.10 2.32 5.03 -1.65 -3.37 117.51 119.88 2dao h ILE 96 Ca 0.01 -2.28 0.40 0.00 -0.12 0.00 0.00 64.86 62.87 2dao h ILE 96 Cb 1.00 2.44 -0.13 0.00 -3.03 0.00 0.00 36.82 37.10 2dao h ILE 96 CO 0.09 0.58 0.68 0.23 -0.68 0.00 0.00 178.15 179.05 2dao n MET 97 N -4.04 -0.04 -4.01 2.37 2.81 -0.93 -3.14 117.12 110.14 2dao n MET 97 Ca -0.30 1.10 -0.31 0.00 -1.81 0.00 0.00 57.70 56.38 2dao n MET 97 Cb 0.84 -2.12 -0.15 0.00 -0.71 0.00 0.00 33.22 31.07 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 -4.39 4.62 0.00 7.83 0.15 -1.24 -5.07 113.70 115.60 2dao s SER 98 Ca -0.07 -1.91 0.00 0.00 0.70 0.00 0.00 55.95 54.68 2dao s SER 98 Cb 0.27 -1.55 0.00 0.00 -1.71 0.00 0.00 66.02 63.03 2dao s SER 98 CO 0.69 -0.33 0.00 0.61 1.20 0.00 0.00 173.24 175.41 2dao n GLY 99 N 4.34 5.08 1.94 9.45 0.00 -1.19 -4.89 105.19 119.94 2dao n GLY 99 Ca -0.01 -1.04 -0.15 0.00 0.00 0.00 0.00 46.02 44.82 2dao n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dao n ARG 100 N 0.00 1.18 0.33 1.61 1.74 -1.26 -4.98 116.66 115.28 2dao n ARG 100 Ca 0.00 -1.84 0.18 0.00 -0.77 0.00 0.00 57.85 55.42 2dao n ARG 100 Cb 0.00 0.32 0.97 0.00 -1.02 0.00 0.00 32.46 32.72 2dao n ARG 100 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dao h THR 101 N 0.80 0.00 -2.79 0.55 1.03 -2.03 -3.04 112.91 107.42 2dao h THR 101 Ca -0.20 0.00 -0.78 0.00 -0.01 0.00 0.00 66.41 65.42 2dao h THR 101 Cb 0.66 0.79 -0.30 0.00 -1.07 0.00 0.00 68.15 68.23 2dao h THR 101 CO 0.31 0.00 0.63 0.47 -0.01 0.00 0.00 175.52 176.93 2dao n ASP 102 N -2.93 6.18 -3.36 0.00 8.00 -1.26 -4.99 116.55 118.19 2dao n ASP 102 Ca -0.02 -3.44 -0.16 0.00 0.71 0.00 0.00 54.79 51.87 2dao n ASP 102 Cb 0.25 -1.19 -0.03 0.00 -0.02 0.00 0.00 41.12 40.12 2dao n ASP 102 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dao n ARG 103 N 1.16 1.37 -2.72 -1.24 5.12 -1.15 -5.06 116.66 114.13 2dao n ARG 103 Ca 0.28 -1.87 -0.42 0.00 -1.93 0.00 0.00 57.85 53.90 2dao n ARG 103 Cb 0.34 0.49 -0.02 0.00 -1.16 0.00 0.00 32.46 32.11 2dao n ARG 103 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2dao s LEU 104 N 0.00 4.21 0.13 0.55 1.02 -1.26 -4.53 118.68 118.80 2dao s LEU 104 Ca 0.00 -1.88 0.00 0.00 0.02 0.00 0.00 54.13 52.27 2dao s LEU 104 Cb -0.00 -2.50 0.00 0.00 0.02 0.00 0.00 46.19 43.71 2dao s LEU 104 CO 0.00 -1.26 0.00 -1.84 0.02 0.00 0.00 176.35 173.28 2dao n GLU 105 N 7.75 0.00 -0.00 1.70 0.28 -1.26 -4.78 120.64 124.33 2dao n GLU 105 Ca 0.32 0.00 0.19 0.00 -0.16 0.00 0.00 57.16 57.51 2dao n GLU 105 Cb 0.49 -0.20 0.41 0.00 1.43 0.00 0.00 31.44 33.57 2dao n GLU 105 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2dao h HIS 106 N 0.00 0.00 -0.26 -1.84 3.86 -1.99 1.78 115.15 116.70 2dao h HIS 106 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 2dao h HIS 106 Cb 0.16 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.60 2dao h HIS 106 CO 0.00 0.00 0.07 1.28 0.86 0.00 0.00 177.93 180.14 2dao n LEU 107 N -3.11 3.26 0.10 2.43 4.32 -1.26 -3.52 117.00 119.21 2dao n LEU 107 Ca 0.14 -1.67 -0.20 0.00 -0.02 0.00 0.00 56.01 54.26 2dao n LEU 107 Cb 1.19 -0.59 -0.15 0.00 -1.62 0.00 0.00 43.42 42.26 2dao n LEU 107 CO 0.18 0.48 -0.30 1.05 -1.22 0.00 0.00 177.39 177.58 2dao h GLU 108 N 1.19 0.37 0.00 3.23 9.09 0.24 -3.40 114.58 125.29 2dao h GLU 108 Ca 0.07 -0.63 -0.07 0.00 0.05 0.00 0.00 59.36 58.78 2dao h GLU 108 Cb 1.25 0.23 -0.01 0.00 -1.65 0.00 0.00 28.75 28.57 2dao h GLU 108 CO 0.25 1.27 -1.27 0.45 0.05 0.00 0.00 179.01 179.76 2dao n SER 109 N -3.57 3.96 -0.29 3.06 2.88 -1.25 -4.62 113.62 113.78 2dao n SER 109 Ca -0.17 -0.01 0.33 0.00 -1.33 0.00 0.00 58.87 57.70 2dao n SER 109 Cb 1.06 0.46 0.58 0.00 -0.75 0.00 0.00 64.21 65.56 2dao n SER 109 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 2dao h GLN 110 N 0.00 0.00 -0.01 -1.46 4.15 -1.79 0.85 115.11 116.86 2dao h GLN 110 Ca -0.11 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.26 2dao h GLN 110 Cb 1.23 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.92 2dao h GLN 110 CO 0.00 0.00 -0.20 0.93 -1.93 0.00 0.00 178.83 177.63 2dao h GLU 111 N 0.00 0.15 0.00 1.69 3.07 -1.82 -3.41 114.58 114.26 2dao h GLU 111 Ca 0.56 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 59.27 2dao h GLU 111 Cb 2.86 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 30.81 2dao h GLU 111 CO -0.01 0.88 -0.02 1.37 -1.40 0.00 0.00 179.01 179.83 2dao h LEU 112 N -0.52 0.00 -8.21 1.33 -0.00 0.31 -3.42 115.31 104.79 2dao h LEU 112 Ca -0.02 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.68 2dao h LEU 112 Cb 0.94 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.57 2dao h LEU 112 CO 0.04 0.17 0.47 -0.55 -0.00 0.00 0.00 178.44 178.57 2dao s SER 113 N -3.86 4.53 0.00 0.17 0.15 0.66 -4.81 113.70 110.54 2dao s SER 113 Ca -0.01 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.04 2dao s SER 113 Cb 0.00 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 2dao s SER 113 CO 0.01 -3.39 0.00 0.61 1.20 0.00 0.00 173.24 171.67 2dao n GLY 114 N 6.63 5.48 3.77 9.45 0.00 -1.26 -4.51 105.19 124.75 2dao n GLY 114 Ca 0.43 -1.38 -0.33 0.00 0.00 0.00 0.00 46.02 44.75 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 1.50 2.70 -0.11 1.61 0.04 -1.26 -5.02 135.00 134.46 2dao s PRO 115 Ca 0.00 1.35 -0.20 0.00 0.04 0.00 0.00 61.00 62.18 2dao s PRO 115 Cb 0.00 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2dao s PRO 115 CO 0.00 -1.32 0.56 -1.12 0.04 0.00 0.00 177.00 175.16 2dao s SER 116 N -2.74 6.78 -1.55 6.66 0.01 -1.26 -4.23 113.70 117.37 2dao s SER 116 Ca 0.66 0.94 -0.13 0.00 1.31 0.00 0.00 55.95 58.73 2dao s SER 116 Cb -0.20 -2.33 0.13 0.00 0.21 0.00 0.00 66.02 63.83 2dao s SER 116 CO 0.44 -0.06 0.32 -1.54 0.41 0.00 0.00 173.24 172.81 2dao n SER 117 N 3.80 -0.62 -0.74 2.44 3.41 -1.26 -5.34 113.62 115.31 2dao n SER 117 Ca -0.05 -1.11 0.13 0.00 -0.26 0.00 0.00 58.87 57.58 2dao n SER 117 Cb 0.51 -1.41 0.30 0.00 -0.26 0.00 0.00 64.21 63.35 2dao n SER 117 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49