#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da6 h SER 2 N 0.00 0.00 -3.90 1.61 4.64 -2.10 -3.39 113.55 110.41 2da6 h SER 2 Ca 0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 2da6 h SER 2 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2da6 h SER 2 CO 0.00 0.00 0.38 -0.55 -0.87 0.00 0.00 176.83 175.79 2da6 s SER 3 N -4.59 7.14 0.01 4.97 0.15 -1.26 -5.06 113.70 115.06 2da6 s SER 3 Ca -0.04 1.96 -0.02 0.00 0.70 0.00 0.00 55.95 58.55 2da6 s SER 3 Cb 0.20 -2.59 -0.01 0.00 -1.71 0.00 0.00 66.02 61.91 2da6 s SER 3 CO 0.68 -0.21 0.02 -0.83 1.20 0.00 0.00 173.24 174.10 2da6 s GLY 4 N -1.51 0.12 0.34 9.45 0.00 -1.26 -5.17 107.32 109.30 2da6 s GLY 4 Ca 0.52 -0.29 0.09 0.00 0.00 0.00 0.00 44.72 45.04 2da6 s GLY 4 CO 0.27 -0.35 0.05 -0.56 0.00 0.00 0.00 173.10 172.51 2da6 s SER 5 N -0.98 4.32 -0.56 1.64 0.01 -1.26 -5.09 113.70 111.78 2da6 s SER 5 Ca -0.11 -0.94 -0.22 0.00 1.31 0.00 0.00 55.95 55.99 2da6 s SER 5 Cb -0.07 -0.58 0.05 0.00 0.21 0.00 0.00 66.02 65.63 2da6 s SER 5 CO -0.00 -0.27 0.86 -0.94 0.41 0.00 0.00 173.24 173.30 2da6 s SER 6 N -3.76 6.28 0.00 2.44 1.04 -1.26 -4.14 113.70 114.30 2da6 s SER 6 Ca 0.36 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 56.16 2da6 s SER 6 Cb -0.00 -2.39 0.00 0.00 0.10 0.00 0.00 66.02 63.72 2da6 s SER 6 CO 0.20 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.86 2da6 n GLY 7 N 5.17 0.12 0.34 7.32 0.00 -1.26 -5.00 105.19 111.89 2da6 n GLY 7 Ca -0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2da6 n GLY 7 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2da6 n ARG 8 N 0.00 0.34 -1.36 1.61 1.85 -1.26 -4.98 116.66 112.87 2da6 n ARG 8 Ca 0.00 0.12 -0.60 0.00 -1.00 0.00 0.00 57.85 56.37 2da6 n ARG 8 Cb 0.00 -1.15 -0.11 0.00 -1.05 0.00 0.00 32.46 30.15 2da6 n ARG 8 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2da6 n ASN 9 N -3.37 1.01 -4.36 2.89 4.13 -1.26 -4.84 115.26 109.45 2da6 n ASN 9 Ca -0.28 0.74 -0.46 0.00 1.68 0.00 0.00 54.58 56.26 2da6 n ASN 9 Cb 0.74 -0.94 -0.01 0.00 -1.54 0.00 0.00 39.78 38.02 2da6 n ASN 9 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 2da6 s ARG 10 N 5.52 3.78 -0.07 3.52 6.06 -1.26 -5.02 118.95 131.48 2da6 s ARG 10 Ca 1.16 -2.53 -0.32 0.00 -2.50 0.00 0.00 55.73 51.54 2da6 s ARG 10 Cb -1.42 -4.59 -0.10 0.00 0.06 0.00 0.00 34.95 28.90 2da6 s ARG 10 CO 0.67 -1.40 1.96 0.34 -2.50 0.00 0.00 175.30 174.37 2da6 n PHE 11 N 4.24 2.34 -3.64 5.12 7.35 -1.26 -4.95 117.46 126.66 2da6 n PHE 11 Ca 0.20 -0.14 -0.36 0.00 -0.76 0.00 0.00 57.45 56.38 2da6 n PHE 11 Cb 0.45 -2.72 -0.07 0.00 0.35 0.00 0.00 39.48 37.50 2da6 n PHE 11 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 2da6 s LYS 12 N 4.50 4.09 0.81 -4.13 2.47 -1.26 -5.08 119.74 121.15 2da6 s LYS 12 Ca 0.93 -0.00 -0.11 0.00 -1.56 0.00 0.00 55.97 55.23 2da6 s LYS 12 Cb -0.58 -3.37 0.08 0.00 -1.46 0.00 0.00 37.83 32.50 2da6 s LYS 12 CO 0.47 0.37 1.11 -1.58 0.16 0.00 0.00 175.35 175.88 2da6 s TRP 13 N 0.10 2.30 0.26 4.03 0.52 -1.26 -5.02 118.94 119.88 2da6 s TRP 13 Ca 0.14 1.62 0.03 0.00 0.02 0.00 0.00 56.10 57.91 2da6 s TRP 13 Cb -0.13 -3.14 0.05 0.00 -1.15 0.00 0.00 33.47 29.10 2da6 s TRP 13 CO 0.03 -2.09 0.36 0.41 0.02 0.00 0.00 176.95 175.68 2da6 n GLY 14 N -0.77 1.52 0.16 0.98 0.00 -1.26 -4.92 105.19 100.90 2da6 n GLY 14 Ca 0.10 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 43.88 2da6 n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2da6 h PRO 15 N 0.00 0.46 0.01 1.61 0.13 -2.00 -2.87 132.00 129.34 2da6 h PRO 15 Ca -0.12 -0.24 -0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2da6 h PRO 15 Cb 0.52 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2da6 h PRO 15 CO 0.16 0.82 -0.01 0.00 -0.23 0.00 0.00 178.00 178.74 2da6 h ALA 16 N 0.64 -0.02 -0.61 -0.56 0.00 -1.96 -3.28 119.26 113.47 2da6 h ALA 16 Ca 0.03 -0.30 0.08 0.00 0.00 0.00 0.00 54.91 54.72 2da6 h ALA 16 Cb 0.73 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.42 2da6 h ALA 16 CO 0.05 -0.02 -0.50 0.77 0.00 0.00 0.00 179.25 179.55 2da6 h SER 17 N -0.99 -1.72 -0.52 0.00 0.02 -1.85 -1.10 113.55 107.40 2da6 h SER 17 Ca -0.00 0.26 0.08 0.00 -0.84 0.00 0.00 61.79 61.29 2da6 h SER 17 Cb 0.61 0.76 -0.10 0.00 0.14 0.00 0.00 62.40 63.81 2da6 h SER 17 CO 0.00 -0.34 -0.46 1.56 -1.14 0.00 0.00 176.83 176.45 2da6 h GLN 18 N -0.23 -0.27 -0.83 3.45 4.20 -1.67 0.97 115.11 120.73 2da6 h GLN 18 Ca 0.15 0.02 0.20 0.00 0.06 0.00 0.00 58.65 59.08 2da6 h GLN 18 Cb 0.55 0.06 -0.13 0.00 0.30 0.00 0.00 27.48 28.26 2da6 h GLN 18 CO -0.72 -0.18 0.22 1.96 -0.67 0.00 0.00 178.83 179.45 2da6 h GLN 19 N -0.28 0.24 -0.99 1.46 1.08 -1.29 0.30 115.11 115.64 2da6 h GLN 19 Ca 0.15 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.38 2da6 h GLN 19 Cb 0.57 -0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 27.89 2da6 h GLN 19 CO -0.65 0.16 0.64 0.82 -0.95 0.00 0.00 178.83 178.85 2da6 h ILE 20 N 0.25 1.15 -0.86 2.54 2.04 -0.03 -1.50 117.51 121.09 2da6 h ILE 20 Ca 0.50 -0.42 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2da6 h ILE 20 Cb 0.95 -0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.80 2da6 h ILE 20 CO -0.59 0.22 0.47 -0.07 0.00 0.00 0.00 178.15 178.18 2da6 h LEU 21 N 1.22 1.06 -0.10 1.44 3.38 0.36 -2.07 115.31 120.62 2da6 h LEU 21 Ca 0.40 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 2da6 h LEU 21 Cb 0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 2da6 h LEU 21 CO -0.14 0.85 -0.02 1.88 0.09 0.00 0.00 178.44 181.11 2da6 h TYR 22 N 1.20 0.21 -0.57 1.13 0.05 -0.76 0.55 116.97 118.78 2da6 h TYR 22 Ca 0.30 -0.04 0.09 0.00 0.05 0.00 0.00 58.73 59.13 2da6 h TYR 22 Cb 0.02 -0.05 -0.03 0.00 1.01 0.00 0.00 36.73 37.68 2da6 h TYR 22 CO 0.01 0.48 0.38 1.96 -1.05 0.00 0.00 178.16 179.95 2da6 h GLN 23 N -0.13 0.37 0.18 4.88 1.08 -1.10 0.20 115.11 120.59 2da6 h GLN 23 Ca 0.03 -0.02 -0.23 0.00 -1.45 0.00 0.00 58.65 56.97 2da6 h GLN 23 Cb 0.41 -0.08 0.03 0.00 -0.05 0.00 0.00 27.48 27.79 2da6 h GLN 23 CO 0.01 0.25 -1.02 0.00 -0.95 0.00 0.00 178.83 177.11 2da6 h ALA 24 N 1.71 -0.11 -0.37 3.87 0.00 -1.21 -3.30 119.26 119.86 2da6 h ALA 24 Ca 0.26 -0.75 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2da6 h ALA 24 Cb 0.52 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2da6 h ALA 24 CO -0.07 0.48 0.00 -0.92 0.00 0.00 0.00 179.25 178.74 2da6 h TYR 25 N -0.22 0.60 -1.01 0.00 5.03 -0.23 -1.78 116.97 119.36 2da6 h TYR 25 Ca -0.18 -0.06 0.05 0.00 2.58 0.00 0.00 58.73 61.12 2da6 h TYR 25 Cb 1.80 -0.17 -0.06 0.00 1.55 0.00 0.00 36.73 39.85 2da6 h TYR 25 CO 0.18 0.58 0.66 0.22 -1.32 0.00 0.00 178.16 178.47 2da6 h ASP 26 N 0.55 1.08 0.00 -2.11 3.58 -0.72 -2.93 116.42 115.86 2da6 h ASP 26 Ca 0.12 -0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 2da6 h ASP 26 Cb 0.35 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2da6 h ASP 26 CO 0.01 0.72 -0.09 0.03 -2.88 0.00 0.00 179.24 177.03 2da6 h ARG 27 N 1.24 0.06 -5.23 0.28 3.08 -1.54 -3.46 114.38 108.80 2da6 h ARG 27 Ca 0.41 -0.07 -0.44 0.00 0.07 0.00 0.00 59.98 59.96 2da6 h ARG 27 Cb 0.07 0.02 -0.26 0.00 0.08 0.00 0.00 29.97 29.88 2da6 h ARG 27 CO -0.15 0.85 -0.79 -1.14 -1.07 0.00 0.00 179.97 177.67 2da6 s GLN 28 N -3.04 0.95 -0.07 0.04 2.00 -0.70 -5.04 119.66 113.79 2da6 s GLN 28 Ca -0.17 -0.66 0.01 0.00 -2.00 0.00 0.00 55.36 52.54 2da6 s GLN 28 Cb -0.00 -0.94 -0.25 0.00 0.80 0.00 0.00 33.01 32.61 2da6 s GLN 28 CO 0.70 0.24 0.57 0.87 -0.50 0.00 0.00 175.29 177.17 2da6 h LYS 29 N 5.20 0.17 -3.30 1.67 1.79 -1.86 -3.34 116.57 116.91 2da6 h LYS 29 Ca -0.36 -0.29 -0.65 0.00 -2.18 0.00 0.00 60.65 57.16 2da6 h LYS 29 Cb 1.18 0.11 -0.39 0.00 -1.58 0.00 0.00 32.23 31.54 2da6 h LYS 29 CO 0.45 0.95 -0.47 0.54 -1.08 0.00 0.00 179.45 179.84 2da6 s ASN 30 N -6.70 4.94 0.13 0.86 2.20 -1.26 -4.99 114.94 110.12 2da6 s ASN 30 Ca -0.14 -3.41 -0.31 0.00 -0.94 0.00 0.00 52.86 48.07 2da6 s ASN 30 Cb 0.07 -1.72 -0.08 0.00 -2.00 0.00 0.00 41.25 37.52 2da6 s ASN 30 CO 0.81 -0.19 1.35 -2.16 -2.94 0.00 0.00 177.10 173.96 2da6 s PRO 31 N -0.85 4.35 0.76 3.55 0.04 -1.26 -5.03 135.00 136.55 2da6 s PRO 31 Ca 0.22 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.28 2da6 s PRO 31 Cb -0.14 -3.24 0.15 0.00 0.04 0.00 0.00 34.50 31.31 2da6 s PRO 31 CO -0.09 -0.37 1.05 0.43 0.04 0.00 0.00 177.00 178.06 2da6 n SER 32 N 3.60 1.32 -0.33 6.66 7.64 -1.26 -4.41 113.62 126.84 2da6 n SER 32 Ca 0.10 -2.14 0.10 0.00 1.01 0.00 0.00 58.87 57.95 2da6 n SER 32 Cb 0.43 -0.69 0.21 0.00 -1.01 0.00 0.00 64.21 63.16 2da6 n SER 32 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2da6 n LYS 33 N -2.96 -0.08 0.33 1.43 3.00 -1.26 -0.14 118.16 118.48 2da6 n LYS 33 Ca 0.17 1.41 -0.13 0.00 -0.00 0.00 0.00 58.31 59.76 2da6 n LYS 33 Cb 0.61 -2.19 -0.06 0.00 0.00 0.00 0.00 35.03 33.39 2da6 n LYS 33 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2da6 h GLU 34 N 0.00 -0.82 0.00 1.64 4.39 -1.98 -0.99 114.58 116.82 2da6 h GLU 34 Ca 0.51 0.06 0.00 0.00 0.34 0.00 0.00 59.36 60.27 2da6 h GLU 34 Cb 0.96 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 2da6 h GLU 34 CO -0.90 -0.55 -0.06 0.93 -1.16 0.00 0.00 179.01 177.27 2da6 h GLU 35 N -0.99 -0.07 -0.91 2.33 5.08 -1.39 -0.59 114.58 118.04 2da6 h GLU 35 Ca -0.09 0.01 0.26 0.00 -1.00 0.00 0.00 59.36 58.53 2da6 h GLU 35 Cb 0.65 0.02 -0.15 0.00 0.50 0.00 0.00 28.75 29.77 2da6 h GLU 35 CO 0.14 -0.05 0.21 0.00 -1.00 0.00 0.00 179.01 178.31 2da6 h ARG 36 N -0.08 0.14 -0.33 2.33 3.08 -0.66 0.26 114.38 119.12 2da6 h ARG 36 Ca 0.00 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.10 2da6 h ARG 36 Cb 0.08 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 2da6 h ARG 36 CO -0.04 0.09 0.04 0.93 -1.07 0.00 0.00 179.97 179.92 2da6 h GLU 37 N 0.15 0.14 0.00 0.04 4.39 -0.46 0.73 114.58 119.56 2da6 h GLU 37 Ca 0.58 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.27 2da6 h GLU 37 Cb 1.22 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 2da6 h GLU 37 CO -0.72 0.09 0.35 0.00 -1.16 0.00 0.00 179.01 177.57 2da6 h ALA 38 N 1.27 1.34 0.00 3.43 0.00 0.11 0.50 119.26 125.90 2da6 h ALA 38 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2da6 h ALA 38 Cb 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2da6 h ALA 38 CO -0.24 -0.34 -1.80 1.28 0.00 0.00 0.00 179.25 178.16 2da6 n LEU 39 N -2.77 0.43 -0.10 0.00 4.77 0.17 -2.92 117.00 116.58 2da6 n LEU 39 Ca -0.02 0.19 -0.13 0.00 -0.03 0.00 0.00 56.01 56.02 2da6 n LEU 39 Cb 0.39 0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.63 2da6 n LEU 39 CO 0.12 0.20 0.52 0.58 -1.33 0.00 0.00 177.39 177.48 2da6 h VAL 40 N 0.00 1.27 0.11 4.08 2.07 0.83 -1.95 116.25 122.66 2da6 h VAL 40 Ca -0.23 -1.61 -0.23 0.00 0.82 0.00 0.00 66.70 65.45 2da6 h VAL 40 Cb 1.63 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.86 2da6 h VAL 40 CO 0.03 0.53 -1.15 1.05 0.02 0.00 0.00 177.57 178.06 2da6 h GLU 41 N 0.73 0.23 -0.39 1.57 4.11 -1.59 -3.15 114.58 116.09 2da6 h GLU 41 Ca 0.05 -0.40 0.05 0.00 0.07 0.00 0.00 59.36 59.12 2da6 h GLU 41 Cb 1.03 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.39 2da6 h GLU 41 CO 0.10 1.19 0.14 1.49 0.07 0.00 0.00 179.01 182.00 2da6 h GLU 42 N -0.40 0.28 0.39 1.06 4.57 -1.62 0.21 114.58 119.08 2da6 h GLU 42 Ca -0.24 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 57.90 2da6 h GLU 42 Cb 1.66 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 30.19 2da6 h GLU 42 CO 0.07 0.19 -0.19 0.00 -1.18 0.00 0.00 179.01 177.90 2da6 h ASN 44 N -0.54 0.31 0.43 0.00 2.35 -1.52 0.18 115.58 116.79 2da6 h ASN 44 Ca -0.05 0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 2da6 h ASN 44 Cb 0.40 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.81 2da6 h ASN 44 CO 0.09 0.01 -0.21 -0.09 -1.65 0.00 0.00 177.43 175.58 2da6 h ARG 45 N 0.25 -0.56 -0.94 0.81 2.43 -0.73 -2.82 114.38 112.81 2da6 h ARG 45 Ca 0.65 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.91 2da6 h ARG 45 Cb 1.92 0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 31.54 2da6 h ARG 45 CO -0.27 -0.25 0.60 0.00 -1.51 0.00 0.00 179.97 178.54 2da6 h ALA 46 N -0.64 1.28 -0.71 2.80 0.00 0.51 -2.02 119.26 120.47 2da6 h ALA 46 Ca -0.06 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.92 2da6 h ALA 46 Cb 0.56 -0.29 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2da6 h ALA 46 CO 0.10 0.40 0.35 0.93 0.00 0.00 0.00 179.25 181.03 2da6 h GLU 47 N 1.11 0.58 -0.70 0.00 5.08 -0.74 -0.83 114.58 119.08 2da6 h GLU 47 Ca 0.40 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.65 2da6 h GLU 47 Cb 0.12 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2da6 h GLU 47 CO -0.16 0.38 0.16 0.00 -1.00 0.00 0.00 179.01 178.39 2da6 h LEU 49 N 1.07 -1.03 -0.77 0.00 3.38 -0.84 1.93 115.31 119.05 2da6 h LEU 49 Ca 0.22 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.31 2da6 h LEU 49 Cb 0.39 0.27 -0.07 0.00 0.09 0.00 0.00 40.66 41.33 2da6 h LEU 49 CO 0.00 -0.70 0.42 0.06 0.09 0.00 0.00 178.44 178.31 2da6 h GLN 50 N -1.29 0.69 0.00 1.13 3.07 -1.22 0.30 115.11 117.80 2da6 h GLN 50 Ca -0.12 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.57 2da6 h GLN 50 Cb 0.93 -0.16 0.00 0.00 0.08 0.00 0.00 27.48 28.34 2da6 h GLN 50 CO 0.20 0.46 0.00 0.54 0.09 0.00 0.00 178.83 180.12 2da6 n ARG 51 N -4.79 0.87 0.00 0.06 1.74 -0.36 -4.85 116.66 109.33 2da6 n ARG 51 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2da6 n ARG 51 Cb 0.26 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 2da6 n ARG 51 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2da6 n GLY 52 N 0.54 2.81 3.38 -0.13 0.00 0.11 -4.99 105.19 106.90 2da6 n GLY 52 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 2da6 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2da6 s VAL 53 N -0.76 1.70 -0.04 1.61 1.01 0.64 -4.79 120.40 119.77 2da6 s VAL 53 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 2da6 s VAL 53 Cb 0.00 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.32 2da6 s VAL 53 CO 0.00 0.00 0.27 -0.55 0.00 0.00 0.00 175.10 174.82 2da6 s SER 54 N -2.62 6.57 0.00 3.32 0.15 -1.26 -3.16 113.70 116.70 2da6 s SER 54 Ca 0.69 0.68 0.15 0.00 0.70 0.00 0.00 55.95 58.17 2da6 s SER 54 Cb -0.22 -2.14 0.88 0.00 -1.71 0.00 0.00 66.02 62.83 2da6 s SER 54 CO 0.63 0.34 1.36 -0.81 1.20 0.00 0.00 173.24 175.95 2da6 n PRO 55 N 1.68 0.42 -0.02 5.44 -0.04 -1.26 -2.05 135.00 139.17 2da6 n PRO 55 Ca -0.15 0.04 0.09 0.00 -0.04 0.00 0.00 63.50 63.43 2da6 n PRO 55 Cb 0.53 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.33 2da6 n PRO 55 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2da6 n SER 56 N -1.07 0.16 -2.13 3.54 7.64 -1.26 -4.37 113.62 116.14 2da6 n SER 56 Ca 0.10 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.70 2da6 n SER 56 Cb 0.07 1.89 0.07 0.00 -1.01 0.00 0.00 64.21 65.23 2da6 n SER 56 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2da6 n LYS 57 N -2.27 2.94 0.18 1.43 4.76 -0.87 -4.67 118.16 119.66 2da6 n LYS 57 Ca -0.06 -3.59 0.05 0.00 -2.87 0.00 0.00 58.31 51.84 2da6 n LYS 57 Cb 0.60 -2.25 0.48 0.00 -1.84 0.00 0.00 35.03 32.02 2da6 n LYS 57 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2da6 h ALA 58 N 1.95 1.67 -0.64 7.82 0.00 -1.76 -2.46 119.26 125.84 2da6 h ALA 58 Ca 0.50 -0.15 0.18 0.00 0.00 0.00 0.00 54.91 55.44 2da6 h ALA 58 Cb 1.23 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2da6 h ALA 58 CO 1.19 0.24 0.80 1.12 0.00 0.00 0.00 179.25 182.60 2da6 h HIS 59 N 0.10 0.00 -0.11 0.00 2.07 -1.94 0.74 115.15 116.01 2da6 h HIS 59 Ca 0.02 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 57.39 2da6 h HIS 59 Cb 0.28 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.25 2da6 h HIS 59 CO 0.00 0.00 -0.59 0.78 -3.07 0.00 0.00 177.93 175.05 2da6 h GLY 60 N 0.00 0.41 -1.27 6.13 0.00 -1.84 -3.19 103.07 103.31 2da6 h GLY 60 Ca 0.30 -0.50 0.43 0.00 0.00 0.00 0.00 47.33 47.56 2da6 h GLY 60 CO -0.00 0.45 0.83 1.04 0.00 0.00 0.00 176.54 178.85 2da6 n LEU 61 N -3.91 0.16 0.00 3.11 4.77 0.26 -4.69 117.00 116.70 2da6 n LEU 61 Ca -0.03 1.18 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 2da6 n LEU 61 Cb 0.62 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2da6 n LEU 61 CO 0.46 -1.27 0.00 0.61 -1.33 0.00 0.00 177.39 175.86 2da6 n GLY 62 N -1.49 1.32 0.24 -0.72 0.00 -1.21 -0.68 105.19 102.66 2da6 n GLY 62 Ca 0.36 0.49 0.07 0.00 0.00 0.00 0.00 46.02 46.94 2da6 n GLY 62 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2da6 h SER 63 N 0.00 0.00 -0.42 1.61 0.02 -1.95 -0.27 113.55 112.54 2da6 h SER 63 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2da6 h SER 63 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2da6 h SER 63 CO 0.00 0.10 0.00 0.59 -1.14 0.00 0.00 176.83 176.38 2da6 n ASN 64 N -4.34 2.48 -4.73 3.07 3.02 0.15 -4.78 115.26 110.13 2da6 n ASN 64 Ca -0.03 -2.06 -0.41 0.00 -0.03 0.00 0.00 54.58 52.05 2da6 n ASN 64 Cb 0.18 -0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 38.98 2da6 n ASN 64 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2da6 s LEU 65 N -1.07 4.41 0.41 3.41 2.96 -0.11 -4.91 118.68 123.78 2da6 s LEU 65 Ca 0.29 1.52 -0.09 0.00 -0.22 0.00 0.00 54.13 55.62 2da6 s LEU 65 Cb 0.16 -3.35 -0.06 0.00 0.50 0.00 0.00 46.19 43.44 2da6 s LEU 65 CO 0.18 -0.09 0.76 -0.69 -1.32 0.00 0.00 176.35 175.19 2da6 s VAL 66 N 0.38 4.82 0.03 1.68 1.01 -1.26 -4.94 120.40 122.11 2da6 s VAL 66 Ca 0.43 0.53 -0.21 0.00 0.00 0.00 0.00 61.98 62.73 2da6 s VAL 66 Cb -0.21 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.47 2da6 s VAL 66 CO 0.25 -0.55 0.49 0.42 0.00 0.00 0.00 175.10 175.70 2da6 s THR 67 N -2.40 0.04 0.26 3.92 -4.23 -1.26 -4.97 115.64 107.00 2da6 s THR 67 Ca 0.50 -0.30 0.13 0.00 -1.18 0.00 0.00 61.69 60.84 2da6 s THR 67 Cb -0.10 -0.94 0.26 0.00 1.34 0.00 0.00 72.50 73.06 2da6 s THR 67 CO 0.33 -0.17 1.14 1.21 -0.54 0.00 0.00 174.62 176.59 2da6 n GLU 68 N 0.57 -0.05 0.13 3.99 2.13 -1.26 0.13 120.64 126.29 2da6 n GLU 68 Ca -0.19 1.01 -0.13 0.00 0.66 0.00 0.00 57.16 58.50 2da6 n GLU 68 Cb 0.59 -1.78 -0.08 0.00 0.27 0.00 0.00 31.44 30.45 2da6 n GLU 68 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2da6 h VAL 69 N 0.00 0.81 -0.79 6.31 2.07 -1.98 -1.55 116.25 121.11 2da6 h VAL 69 Ca 0.59 -0.52 0.14 0.00 0.82 0.00 0.00 66.70 67.72 2da6 h VAL 69 Cb 1.51 1.10 -0.14 0.00 -1.52 0.00 0.00 31.29 32.24 2da6 h VAL 69 CO -0.57 0.11 -0.32 0.03 0.02 0.00 0.00 177.57 176.84 2da6 h ARG 70 N -0.61 -0.06 -0.46 1.57 2.47 0.71 0.17 114.38 118.16 2da6 h ARG 70 Ca -0.03 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.65 2da6 h ARG 70 Cb 0.44 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.76 2da6 h ARG 70 CO 0.06 -0.04 0.12 0.28 0.56 0.00 0.00 179.97 180.94 2da6 h VAL 71 N -0.06 1.24 -0.59 2.04 2.07 -1.47 -2.44 116.25 117.03 2da6 h VAL 71 Ca 0.32 -0.82 0.11 0.00 0.82 0.00 0.00 66.70 67.13 2da6 h VAL 71 Cb 0.58 0.88 -0.08 0.00 -1.52 0.00 0.00 31.29 31.15 2da6 h VAL 71 CO -0.83 0.29 0.14 0.22 0.02 0.00 0.00 177.57 177.41 2da6 h TYR 72 N 0.62 0.23 0.33 1.57 5.03 0.31 -0.94 116.97 124.12 2da6 h TYR 72 Ca 0.15 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.47 2da6 h TYR 72 Cb 0.32 -0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.59 2da6 h TYR 72 CO 0.02 -0.01 -0.16 -0.91 -1.32 0.00 0.00 178.16 175.79 2da6 h ASN 73 N 0.28 -0.37 -0.71 -2.11 2.35 -0.85 -0.43 115.58 113.74 2da6 h ASN 73 Ca 0.31 -0.09 0.16 0.00 -0.55 0.00 0.00 56.30 56.12 2da6 h ASN 73 Cb 0.44 0.10 -0.12 0.00 0.05 0.00 0.00 38.32 38.79 2da6 h ASN 73 CO -0.38 -0.13 0.03 -0.25 -1.65 0.00 0.00 177.43 175.05 2da6 h TRP 74 N -0.61 -0.00 -0.44 1.19 7.01 -0.95 0.52 115.95 122.67 2da6 h TRP 74 Ca -0.04 0.05 -0.08 0.00 2.11 0.00 0.00 58.89 60.93 2da6 h TRP 74 Cb 0.44 0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.60 2da6 h TRP 74 CO -0.01 -0.19 -0.03 0.74 -2.79 0.00 0.00 178.44 176.16 2da6 h PHE 75 N 0.13 0.87 -0.59 2.65 -1.00 -1.09 -2.34 116.94 115.57 2da6 h PHE 75 Ca 0.38 -0.16 0.06 0.00 2.81 0.00 0.00 57.97 61.06 2da6 h PHE 75 Cb 0.66 -0.22 -0.06 0.00 3.61 0.00 0.00 35.95 39.94 2da6 h PHE 75 CO -0.38 0.86 0.29 0.00 -1.61 0.00 0.00 178.31 177.46 2da6 h ALA 76 N 0.89 0.77 -0.48 2.45 0.00 0.76 0.01 119.26 123.67 2da6 h ALA 76 Ca 0.12 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2da6 h ALA 76 Cb 0.53 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2da6 h ALA 76 CO 0.03 -0.08 -0.03 -0.97 0.00 0.00 0.00 179.25 178.20 2da6 h ASN 77 N 0.53 0.79 -0.04 0.00 -0.73 -0.90 0.16 115.58 115.40 2da6 h ASN 77 Ca 0.27 -0.21 -0.09 0.00 1.87 0.00 0.00 56.30 58.14 2da6 h ASN 77 Cb 0.22 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.59 2da6 h ASN 77 CO -0.21 0.87 -0.26 0.03 -0.37 0.00 0.00 177.43 177.50 2da6 h ARG 78 N 0.75 0.46 0.00 6.67 2.47 -0.77 -0.67 114.38 123.30 2da6 h ARG 78 Ca 0.14 -0.17 -0.08 0.00 -1.26 0.00 0.00 59.98 58.61 2da6 h ARG 78 Cb 0.50 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.78 2da6 h ARG 78 CO 0.03 0.68 -0.73 0.00 0.56 0.00 0.00 179.97 180.51 2da6 h ARG 79 N 0.41 0.00 0.07 0.04 3.08 -0.70 -3.09 114.38 114.18 2da6 h ARG 79 Ca 0.06 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.86 2da6 h ARG 79 Cb 0.67 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 2da6 h ARG 79 CO 0.05 0.24 -1.15 0.87 -1.07 0.00 0.00 179.97 178.91 2da6 h LYS 80 N 0.00 0.15 -0.07 0.04 1.57 -0.40 -3.01 116.57 114.85 2da6 h LYS 80 Ca -0.04 -0.26 -0.18 0.00 -1.87 0.00 0.00 60.65 58.30 2da6 h LYS 80 Cb 1.28 0.10 0.01 0.00 0.08 0.00 0.00 32.23 33.69 2da6 h LYS 80 CO 0.03 1.11 -0.66 1.05 -0.57 0.00 0.00 179.45 180.42 2da6 h GLU 81 N 0.04 0.57 -0.82 3.15 4.11 -1.22 -1.74 114.58 118.68 2da6 h GLU 81 Ca -0.09 -0.52 -0.04 0.00 0.07 0.00 0.00 59.36 58.79 2da6 h GLU 81 Cb 1.89 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 31.23 2da6 h GLU 81 CO 0.17 1.15 0.37 1.05 0.07 0.00 0.00 179.01 181.81 2da6 h GLU 82 N 0.18 1.19 0.00 1.06 4.11 -1.64 -2.06 114.58 117.41 2da6 h GLU 82 Ca -0.06 -0.19 0.00 0.00 0.07 0.00 0.00 59.36 59.18 2da6 h GLU 82 Cb 1.32 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2da6 h GLU 82 CO 0.13 0.93 0.00 0.00 0.07 0.00 0.00 179.01 180.14 2da6 h ALA 83 N 1.23 1.00 0.17 1.06 0.00 -1.57 -3.36 119.26 117.79 2da6 h ALA 83 Ca 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2da6 h ALA 83 Cb 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2da6 h ALA 83 CO -0.03 0.00 -0.19 0.35 0.00 0.00 0.00 179.25 179.38 2da6 h PHE 84 N 0.00 -0.52 -0.70 0.00 3.04 -0.56 0.49 116.94 118.69 2da6 h PHE 84 Ca 0.00 0.01 0.20 0.00 3.98 0.00 0.00 57.97 62.16 2da6 h PHE 84 Cb 0.85 0.20 -0.03 0.00 2.56 0.00 0.00 35.95 39.54 2da6 h PHE 84 CO 0.00 -0.24 0.96 0.00 -2.02 0.00 0.00 178.31 177.01 2da6 h ARG 85 N -0.36 0.00 0.10 1.11 3.08 -1.70 1.11 114.38 117.73 2da6 h ARG 85 Ca -0.02 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.69 2da6 h ARG 85 Cb 0.31 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2da6 h ARG 85 CO -0.03 0.00 -1.87 1.96 -1.07 0.00 0.00 179.97 178.95 2da6 h GLN 86 N 0.00 0.22 0.18 0.04 1.08 -1.39 -3.34 115.11 111.90 2da6 h GLN 86 Ca 0.33 -0.37 -0.01 0.00 -1.45 0.00 0.00 58.65 57.15 2da6 h GLN 86 Cb 2.25 0.14 0.00 0.00 -0.05 0.00 0.00 27.48 29.82 2da6 h GLN 86 CO -0.00 1.06 -0.09 -0.22 -0.95 0.00 0.00 178.83 178.63 2da6 h LYS 87 N 0.06 -0.23 0.00 1.46 3.64 0.61 -1.88 116.57 120.23 2da6 h LYS 87 Ca -0.37 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.02 2da6 h LYS 87 Cb 2.04 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.91 2da6 h LYS 87 CO 0.10 -0.06 0.06 1.37 -2.27 0.00 0.00 179.45 178.65 2da6 h LEU 88 N -0.36 0.00 0.16 5.20 8.10 -1.44 -0.48 115.31 126.49 2da6 h LEU 88 Ca -0.02 0.00 -0.33 0.00 0.11 0.00 0.00 57.88 57.64 2da6 h LEU 88 Cb 0.28 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.50 2da6 h LEU 88 CO 0.04 0.00 -1.62 0.00 -4.11 0.00 0.00 178.44 172.75 2da6 h ALA 89 N 1.84 0.20 -0.65 0.17 0.00 -1.47 -3.35 119.26 116.00 2da6 h ALA 89 Ca 0.00 -1.11 -0.06 0.00 0.00 0.00 0.00 54.91 53.75 2da6 h ALA 89 Cb 0.12 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 2da6 h ALA 89 CO 0.00 1.06 0.19 0.52 0.00 0.00 0.00 179.25 181.02 2da6 h MET 90 N 0.09 1.02 -7.23 0.00 2.86 -0.64 -3.44 114.93 107.59 2da6 h MET 90 Ca -0.29 -0.23 -0.42 0.00 -2.06 0.00 0.00 59.70 56.70 2da6 h MET 90 Cb 2.06 -0.14 0.20 0.00 0.06 0.00 0.00 31.60 33.78 2da6 h MET 90 CO 0.18 0.90 0.05 -0.51 1.06 0.00 0.00 176.91 178.59 2da6 s ASP 91 N -6.30 0.87 0.77 1.22 1.01 -1.09 -5.02 116.67 108.12 2da6 s ASP 91 Ca -0.12 1.09 -0.11 0.00 0.71 0.00 0.00 52.55 54.11 2da6 s ASP 91 Cb 0.14 -1.66 0.06 0.00 1.01 0.00 0.00 42.92 42.47 2da6 s ASP 91 CO 0.82 -4.21 1.14 0.00 0.21 0.00 0.00 175.17 173.13 2da6 s ALA 92 N -2.66 2.77 0.16 5.23 0.00 -1.26 -4.97 121.76 121.04 2da6 s ALA 92 Ca 0.68 -0.56 -0.34 0.00 0.00 0.00 0.00 51.96 51.74 2da6 s ALA 92 Cb -0.18 -2.96 -0.15 0.00 0.00 0.00 0.00 23.12 19.84 2da6 s ALA 92 CO 0.60 -1.46 1.40 2.48 0.00 0.00 0.00 175.76 178.77 2da6 n TYR 93 N -3.18 1.87 -3.64 0.00 4.11 -1.26 -4.95 117.16 110.11 2da6 n TYR 93 Ca 0.08 0.48 -0.38 0.00 -0.00 0.00 0.00 57.90 58.08 2da6 n TYR 93 Cb 0.60 -2.42 -0.11 0.00 -0.00 0.00 0.00 39.34 37.40 2da6 n TYR 93 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 2da6 s SER 94 N 0.48 5.71 0.43 9.48 0.15 -1.26 -5.07 113.70 123.63 2da6 s SER 94 Ca 0.77 -0.15 -0.26 0.00 0.70 0.00 0.00 55.95 57.01 2da6 s SER 94 Cb -0.78 -2.05 -0.09 0.00 -1.71 0.00 0.00 66.02 61.40 2da6 s SER 94 CO 0.46 -0.07 1.41 -0.55 1.20 0.00 0.00 173.24 175.68 2da6 s SER 95 N 1.70 6.01 0.57 5.45 0.15 -1.26 -4.95 113.70 121.37 2da6 s SER 95 Ca 0.07 2.88 -0.20 0.00 0.70 0.00 0.00 55.95 59.40 2da6 s SER 95 Cb -0.16 -2.65 -0.04 0.00 -1.71 0.00 0.00 66.02 61.46 2da6 s SER 95 CO 0.08 -1.08 1.26 0.20 1.20 0.00 0.00 173.24 174.90 2da6 s ASN 96 N -0.52 5.21 0.18 5.45 0.01 -1.26 -5.04 114.94 118.98 2da6 s ASN 96 Ca 0.59 2.53 0.11 0.00 -0.71 0.00 0.00 52.86 55.38 2da6 s ASN 96 Cb -0.43 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 38.57 2da6 s ASN 96 CO 0.55 -1.59 -0.20 -0.44 -1.51 0.00 0.00 177.10 173.92 2da6 s SER 97 N -1.35 3.69 -0.47 -1.22 0.01 -1.26 -5.08 113.70 108.02 2da6 s SER 97 Ca 0.75 -0.76 0.08 0.00 1.31 0.00 0.00 55.95 57.33 2da6 s SER 97 Cb -0.34 -0.40 0.31 0.00 0.21 0.00 0.00 66.02 65.79 2da6 s SER 97 CO 0.39 0.12 0.73 0.61 0.41 0.00 0.00 173.24 175.50 2da6 n GLY 98 N 0.26 4.08 3.68 3.44 0.00 -1.26 -5.09 105.19 110.29 2da6 n GLY 98 Ca -0.12 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.38 2da6 n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2da6 s PRO 99 N -2.36 4.24 0.25 1.61 0.04 -1.26 -4.97 135.00 132.56 2da6 s PRO 99 Ca 0.41 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 63.16 2da6 s PRO 99 Cb 0.25 -3.71 -0.11 0.00 0.04 0.00 0.00 34.50 30.98 2da6 s PRO 99 CO -0.09 -0.68 1.56 -1.54 0.04 0.00 0.00 177.00 176.30 2da6 s SER 100 N 2.32 6.48 0.34 6.66 1.04 -1.26 -5.00 113.70 124.27 2da6 s SER 100 Ca 0.66 2.82 -0.04 0.00 0.48 0.00 0.00 55.95 59.87 2da6 s SER 100 Cb -0.31 -2.62 -0.05 0.00 0.10 0.00 0.00 66.02 63.14 2da6 s SER 100 CO 0.26 -0.85 0.59 -0.44 0.98 0.00 0.00 173.24 173.78 2da6 s SER 101 N 0.62 6.38 0.00 7.02 0.01 -1.26 -5.35 113.70 121.13 2da6 s SER 101 Ca 0.64 0.69 0.00 0.00 1.31 0.00 0.00 55.95 58.59 2da6 s SER 101 Cb -0.46 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2da6 s SER 101 CO 0.43 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.40