#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da6 n SER 2 N 0.00 -5.06 -3.94 1.61 2.88 -1.26 -2.14 113.62 105.72 2da6 n SER 2 Ca 0.00 0.37 -0.30 0.00 -1.33 0.00 0.00 58.87 57.61 2da6 n SER 2 Cb 0.00 -0.80 0.02 0.00 -0.75 0.00 0.00 64.21 62.68 2da6 n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2da6 n SER 3 N 3.06 -4.26 -4.94 -3.46 2.88 -1.26 -4.97 113.62 100.68 2da6 n SER 3 Ca 0.02 -0.82 -0.19 0.00 -1.33 0.00 0.00 58.87 56.55 2da6 n SER 3 Cb 0.52 -3.74 -0.01 0.00 -0.75 0.00 0.00 64.21 60.24 2da6 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2da6 s GLY 4 N -3.41 2.05 0.66 0.46 0.00 -0.91 -5.11 107.32 101.06 2da6 s GLY 4 Ca 0.61 -1.79 -0.11 0.00 0.00 0.00 0.00 44.72 43.43 2da6 s GLY 4 CO 0.84 -1.62 1.05 -0.56 0.00 0.00 0.00 173.10 172.81 2da6 s SER 5 N -4.25 5.74 -0.15 1.64 0.01 -1.26 -5.03 113.70 110.39 2da6 s SER 5 Ca 0.51 1.55 -0.12 0.00 1.31 0.00 0.00 55.95 59.20 2da6 s SER 5 Cb -0.06 -2.49 -0.08 0.00 0.21 0.00 0.00 66.02 63.61 2da6 s SER 5 CO 0.30 -1.20 -0.04 0.28 0.41 0.00 0.00 173.24 172.99 2da6 h SER 6 N -0.49 0.00 0.00 2.44 0.02 -2.02 -3.50 113.55 110.00 2da6 h SER 6 Ca -0.44 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 2da6 h SER 6 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2da6 h SER 6 CO 0.59 0.93 0.00 0.61 -1.14 0.00 0.00 176.83 177.82 2da6 n GLY 7 N 1.58 -1.16 3.71 -3.77 0.00 -1.26 -5.14 105.19 99.15 2da6 n GLY 7 Ca -0.13 0.43 -0.40 0.00 0.00 0.00 0.00 46.02 45.92 2da6 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2da6 n ARG 8 N 0.00 1.75 0.04 1.61 3.00 -1.26 -4.95 116.66 116.85 2da6 n ARG 8 Ca 0.00 0.63 0.00 0.00 -0.01 0.00 0.00 57.85 58.47 2da6 n ARG 8 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 32.46 30.03 2da6 n ARG 8 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2da6 n ASN 9 N -0.28 0.51 -0.26 0.55 2.85 -1.26 -4.82 115.26 112.55 2da6 n ASN 9 Ca 0.08 0.11 0.06 0.00 -0.11 0.00 0.00 54.58 54.72 2da6 n ASN 9 Cb 0.42 -0.12 0.19 0.00 1.24 0.00 0.00 39.78 41.51 2da6 n ASN 9 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2da6 h ARG 10 N 0.00 0.40 -1.40 1.20 3.08 -2.00 -3.45 114.38 112.21 2da6 h ARG 10 Ca 0.00 -0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.25 2da6 h ARG 10 Cb 0.00 -0.09 -0.22 0.00 0.08 0.00 0.00 29.97 29.74 2da6 h ARG 10 CO 0.00 0.26 0.80 -0.59 -1.07 0.00 0.00 179.97 179.37 2da6 s PHE 11 N -6.02 -0.15 -0.23 3.04 -0.71 -1.26 -5.00 117.98 107.65 2da6 s PHE 11 Ca -0.12 0.17 -0.06 0.00 -1.04 0.00 0.00 56.93 55.87 2da6 s PHE 11 Cb 0.21 0.50 -0.02 0.00 -1.21 0.00 0.00 43.02 42.50 2da6 s PHE 11 CO 0.76 -0.19 0.03 0.21 -1.34 0.00 0.00 175.22 174.69 2da6 s LYS 12 N -1.87 3.57 0.98 1.99 2.20 -1.26 -4.85 119.74 120.50 2da6 s LYS 12 Ca 0.07 -0.52 -0.12 0.00 -0.36 0.00 0.00 55.97 55.04 2da6 s LYS 12 Cb -0.01 -3.20 0.10 0.00 -1.51 0.00 0.00 37.83 33.21 2da6 s LYS 12 CO -0.05 -0.16 0.67 0.91 -0.36 0.00 0.00 175.35 176.36 2da6 n TRP 13 N 4.79 -0.65 -2.21 4.03 7.02 -1.26 -5.02 117.44 124.15 2da6 n TRP 13 Ca -0.17 0.25 -0.10 0.00 -1.02 0.00 0.00 57.50 56.46 2da6 n TRP 13 Cb 0.51 -1.83 0.06 0.00 -2.42 0.00 0.00 31.31 27.63 2da6 n TRP 13 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2da6 n GLY 14 N 1.09 0.35 0.18 6.99 0.00 -1.26 -4.89 105.19 107.65 2da6 n GLY 14 Ca 0.08 -1.93 -0.02 0.00 0.00 0.00 0.00 46.02 44.15 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 0.16 0.00 1.61 0.13 -2.01 -3.12 132.00 128.78 2da6 h PRO 15 Ca -0.14 -0.09 -0.04 0.00 -0.87 0.00 0.00 66.00 64.86 2da6 h PRO 15 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 2da6 h PRO 15 CO 0.14 0.61 -0.66 0.00 -0.23 0.00 0.00 178.00 177.86 2da6 n ALA 16 N -2.46 0.51 -0.34 -0.56 0.00 -1.26 -4.16 120.51 112.24 2da6 n ALA 16 Ca -0.02 -0.44 -0.09 0.00 0.00 0.00 0.00 53.44 52.90 2da6 n ALA 16 Cb 0.51 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.80 2da6 n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2da6 n SER 17 N -4.58 -0.87 -0.37 0.00 3.41 -1.26 -0.70 113.62 109.25 2da6 n SER 17 Ca -0.12 1.54 -0.11 0.00 -0.26 0.00 0.00 58.87 59.92 2da6 n SER 17 Cb 0.34 -0.23 -0.09 0.00 -0.26 0.00 0.00 64.21 63.97 2da6 n SER 17 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2da6 h GLN 18 N 0.00 -0.06 -0.82 4.33 4.20 -1.77 0.32 115.11 121.31 2da6 h GLN 18 Ca 0.13 0.00 0.20 0.00 0.06 0.00 0.00 58.65 59.05 2da6 h GLN 18 Cb 0.34 0.01 -0.14 0.00 0.30 0.00 0.00 27.48 27.99 2da6 h GLN 18 CO -0.77 -0.04 0.05 1.96 -0.67 0.00 0.00 178.83 179.36 2da6 h GLN 19 N -0.06 0.11 -0.95 1.46 4.20 -1.07 0.44 115.11 119.23 2da6 h GLN 19 Ca 0.15 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 58.95 2da6 h GLN 19 Cb 0.45 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.13 2da6 h GLN 19 CO -0.89 0.07 0.59 0.82 -0.67 0.00 0.00 178.83 178.76 2da6 h ILE 20 N 0.11 1.00 -0.82 2.54 2.04 0.16 -1.11 117.51 121.43 2da6 h ILE 20 Ca 0.47 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.95 2da6 h ILE 20 Cb 0.88 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 2da6 h ILE 20 CO -0.71 0.19 0.41 -0.07 0.00 0.00 0.00 178.15 177.96 2da6 h LEU 21 N 1.02 1.06 -0.22 1.44 3.38 0.59 -2.15 115.31 120.42 2da6 h LEU 21 Ca 0.44 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.25 2da6 h LEU 21 Cb 0.30 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2da6 h LEU 21 CO -0.21 0.88 -0.02 1.88 0.09 0.00 0.00 178.44 181.06 2da6 h TYR 22 N 1.16 0.44 -0.61 1.13 0.05 -0.60 0.19 116.97 118.73 2da6 h TYR 22 Ca 0.28 -0.08 0.06 0.00 0.05 0.00 0.00 58.73 59.04 2da6 h TYR 22 Cb 0.09 -0.11 -0.04 0.00 1.01 0.00 0.00 36.73 37.68 2da6 h TYR 22 CO 0.01 0.60 0.40 1.96 -1.05 0.00 0.00 178.16 180.09 2da6 h GLN 23 N 0.16 0.61 0.15 4.88 1.08 -1.04 0.45 115.11 121.39 2da6 h GLN 23 Ca 0.06 -0.04 -0.21 0.00 -1.45 0.00 0.00 58.65 57.01 2da6 h GLN 23 Cb 0.44 -0.14 0.02 0.00 -0.05 0.00 0.00 27.48 27.76 2da6 h GLN 23 CO 0.01 0.40 -0.93 0.00 -0.95 0.00 0.00 178.83 177.36 2da6 h ALA 24 N 1.66 -0.08 -0.10 3.87 0.00 -1.21 -3.29 119.26 120.12 2da6 h ALA 24 Ca 0.26 -0.74 -0.07 0.00 0.00 0.00 0.00 54.91 54.35 2da6 h ALA 24 Cb 0.23 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2da6 h ALA 24 CO -0.08 0.44 -0.26 -0.92 0.00 0.00 0.00 179.25 178.43 2da6 h TYR 25 N -0.31 0.20 0.00 0.00 5.03 -0.22 -0.41 116.97 121.26 2da6 h TYR 25 Ca -0.17 -0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.07 2da6 h TYR 25 Cb 1.71 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.93 2da6 h TYR 25 CO 0.19 0.44 -0.18 0.22 -1.32 0.00 0.00 178.16 177.50 2da6 h ASP 26 N 0.16 0.00 0.06 -2.11 3.58 -0.21 -3.11 116.42 114.79 2da6 h ASP 26 Ca 0.03 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.18 2da6 h ASP 26 Cb 0.56 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 2da6 h ASP 26 CO 0.04 0.18 -1.63 0.54 -2.88 0.00 0.00 179.24 175.49 2da6 n ARG 27 N -4.31 0.66 -4.06 0.28 1.74 -0.92 -4.89 116.66 105.16 2da6 n ARG 27 Ca -0.02 0.42 -0.25 0.00 -0.77 0.00 0.00 57.85 57.23 2da6 n ARG 27 Cb 0.24 -1.73 -0.17 0.00 -1.02 0.00 0.00 32.46 29.78 2da6 n ARG 27 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2da6 s GLN 28 N -2.46 1.38 0.17 5.56 2.00 -0.21 -5.02 119.66 121.09 2da6 s GLN 28 Ca -0.26 -0.23 -0.00 0.00 -2.00 0.00 0.00 55.36 52.87 2da6 s GLN 28 Cb 0.06 -1.40 0.03 0.00 0.80 0.00 0.00 33.01 32.50 2da6 s GLN 28 CO 0.68 -0.19 1.40 0.87 -0.50 0.00 0.00 175.29 177.55 2da6 h LYS 29 N 7.84 0.33 -3.25 1.67 1.79 -1.84 -3.35 116.57 119.77 2da6 h LYS 29 Ca -0.30 -0.31 -0.64 0.00 -2.18 0.00 0.00 60.65 57.23 2da6 h LYS 29 Cb 1.14 0.07 -0.40 0.00 -1.58 0.00 0.00 32.23 31.46 2da6 h LYS 29 CO 0.41 0.97 -0.52 -0.80 -1.08 0.00 0.00 179.45 178.43 2da6 s ASN 30 N -6.98 4.81 0.22 0.86 0.01 -1.26 -5.00 114.94 107.61 2da6 s ASN 30 Ca -0.05 -3.47 -0.30 0.00 -0.71 0.00 0.00 52.86 48.33 2da6 s ASN 30 Cb 0.10 -1.69 -0.09 0.00 0.41 0.00 0.00 41.25 39.98 2da6 s ASN 30 CO 0.84 -0.17 1.29 -2.16 -1.51 0.00 0.00 177.10 175.38 2da6 s PRO 31 N -0.93 4.41 0.51 -0.60 0.04 -1.26 -5.04 135.00 132.12 2da6 s PRO 31 Ca 0.22 2.05 0.05 0.00 0.04 0.00 0.00 61.00 63.36 2da6 s PRO 31 Cb -0.14 -3.18 0.09 0.00 0.04 0.00 0.00 34.50 31.32 2da6 s PRO 31 CO -0.09 -0.20 0.70 0.43 0.04 0.00 0.00 177.00 177.88 2da6 n SER 32 N 2.22 1.52 -0.29 6.66 7.64 -1.26 -4.48 113.62 125.63 2da6 n SER 32 Ca 0.04 -2.15 0.12 0.00 1.01 0.00 0.00 58.87 57.90 2da6 n SER 32 Cb 0.43 -0.40 0.24 0.00 -1.01 0.00 0.00 64.21 63.47 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 -2.17 -0.07 0.06 1.43 3.00 -1.26 -0.06 118.16 119.10 2da6 n LYS 33 Ca 0.13 1.27 -0.03 0.00 -0.00 0.00 0.00 58.31 59.69 2da6 n LYS 33 Cb 0.48 -2.01 -0.01 0.00 0.00 0.00 0.00 35.03 33.49 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 -0.17 -0.47 1.64 5.08 -1.98 -1.01 114.58 117.67 2da6 h GLU 34 Ca 0.51 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.93 2da6 h GLU 34 Cb 1.04 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.26 2da6 h GLU 34 CO -0.80 -0.11 -0.38 0.93 -1.00 0.00 0.00 179.01 177.65 2da6 h GLU 35 N -0.25 -0.13 -0.56 2.33 4.39 -1.58 0.23 114.58 119.02 2da6 h GLU 35 Ca -0.02 0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.80 2da6 h GLU 35 Cb 0.13 0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 28.72 2da6 h GLU 35 CO 0.03 -0.08 0.04 0.00 -1.16 0.00 0.00 179.01 177.83 2da6 h ARG 36 N -0.13 0.15 -0.60 2.33 3.08 -0.61 -1.27 114.38 117.33 2da6 h ARG 36 Ca 0.08 -0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.24 2da6 h ARG 36 Cb 0.33 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.25 2da6 h ARG 36 CO -0.51 0.10 -0.00 0.93 -1.07 0.00 0.00 179.97 179.41 2da6 h GLU 37 N 0.16 0.11 0.00 0.04 4.39 0.39 0.60 114.58 120.27 2da6 h GLU 37 Ca 0.29 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.98 2da6 h GLU 37 Cb 0.44 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2da6 h GLU 37 CO -0.44 0.07 0.26 0.00 -1.16 0.00 0.00 179.01 177.74 2da6 h ALA 38 N 1.55 1.25 0.00 3.43 0.00 0.14 0.42 119.26 126.06 2da6 h ALA 38 Ca 0.31 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 2da6 h ALA 38 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2da6 h ALA 38 CO -0.52 -0.25 -1.46 1.28 0.00 0.00 0.00 179.25 178.29 2da6 n LEU 39 N -2.91 0.53 0.05 0.00 4.77 0.20 -2.49 117.00 117.15 2da6 n LEU 39 Ca -0.02 0.21 -0.16 0.00 -0.03 0.00 0.00 56.01 56.01 2da6 n LEU 39 Cb 0.31 0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.34 2da6 n LEU 39 CO 0.15 -0.04 0.15 0.58 -1.33 0.00 0.00 177.39 176.90 2da6 h VAL 40 N 0.00 1.35 0.07 4.08 2.07 0.71 -2.96 116.25 121.56 2da6 h VAL 40 Ca -0.05 -2.34 -0.30 0.00 0.82 0.00 0.00 66.70 64.83 2da6 h VAL 40 Cb 1.15 2.37 -0.02 0.00 -1.52 0.00 0.00 31.29 33.26 2da6 h VAL 40 CO 0.01 0.71 -1.64 -1.84 0.02 0.00 0.00 177.57 174.82 2da6 n GLU 41 N -3.80 0.67 -0.16 1.57 0.28 -0.89 -3.54 120.64 114.77 2da6 n GLU 41 Ca -0.08 0.42 -0.02 0.00 -0.16 0.00 0.00 57.16 57.32 2da6 n GLU 41 Cb 0.84 -1.73 0.07 0.00 1.43 0.00 0.00 31.44 32.06 2da6 n GLU 41 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 2da6 h GLU 42 N -0.45 0.18 0.22 3.44 4.57 -1.63 0.56 114.58 121.47 2da6 h GLU 42 Ca -0.39 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 57.77 2da6 h GLU 42 Cb 1.68 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 30.24 2da6 h GLU 42 CO -0.06 0.12 -0.11 0.00 -1.18 0.00 0.00 179.01 177.79 2da6 h ASN 44 N -0.33 0.06 0.35 0.00 2.35 -1.58 0.20 115.58 116.63 2da6 h ASN 44 Ca -0.03 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 2da6 h ASN 44 Cb 0.23 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2da6 h ASN 44 CO 0.05 -0.02 -0.17 -0.09 -1.65 0.00 0.00 177.43 175.55 2da6 h ARG 45 N 0.03 -0.46 -0.62 0.81 2.43 -0.69 -3.09 114.38 112.80 2da6 h ARG 45 Ca 0.73 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 60.01 2da6 h ARG 45 Cb 2.81 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 32.40 2da6 h ARG 45 CO -0.08 -0.26 0.30 0.00 -1.51 0.00 0.00 179.97 178.42 2da6 h ALA 46 N -1.04 0.81 -0.82 2.80 0.00 0.65 -1.72 119.26 119.94 2da6 h ALA 46 Ca -0.05 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.08 2da6 h ALA 46 Cb 0.40 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.05 2da6 h ALA 46 CO 0.08 -0.08 0.34 0.93 0.00 0.00 0.00 179.25 180.52 2da6 h GLU 47 N 0.54 0.43 -0.51 0.00 5.08 -0.81 0.60 114.58 119.91 2da6 h GLU 47 Ca 0.29 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.50 2da6 h GLU 47 Cb 0.26 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2da6 h GLU 47 CO -0.23 0.28 -0.16 0.00 -1.00 0.00 0.00 179.01 177.91 2da6 h LEU 49 N 0.89 -1.00 -0.58 0.00 3.38 -0.36 1.95 115.31 119.58 2da6 h LEU 49 Ca 0.13 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.21 2da6 h LEU 49 Cb 0.74 0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.68 2da6 h LEU 49 CO 0.06 -0.68 0.23 0.06 0.09 0.00 0.00 178.44 178.20 2da6 h GLN 50 N -1.24 0.41 0.00 1.13 3.07 -1.11 0.32 115.11 117.69 2da6 h GLN 50 Ca -0.12 -0.02 0.00 0.00 0.09 0.00 0.00 58.65 58.60 2da6 h GLN 50 Cb 0.90 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.37 2da6 h GLN 50 CO 0.20 0.27 0.00 0.54 0.09 0.00 0.00 178.83 179.93 2da6 n ARG 51 N -4.98 0.76 0.00 0.06 1.74 -0.61 -4.84 116.66 108.80 2da6 n ARG 51 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2da6 n ARG 51 Cb 0.24 -1.35 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 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 0.45 2.80 3.34 -0.13 0.00 0.11 -5.00 105.19 106.77 2da6 n GLY 52 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2da6 n GLY 52 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2da6 n VAL 53 N -0.80 0.00 -3.69 1.61 0.31 0.64 -4.77 118.33 111.63 2da6 n VAL 53 Ca 0.00 -0.34 -0.37 0.00 -0.01 0.00 0.00 64.34 63.62 2da6 n VAL 53 Cb 0.00 -0.88 -0.06 0.00 -0.91 0.00 0.00 33.84 31.99 2da6 n VAL 53 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2da6 s SER 54 N -2.36 6.60 0.00 4.52 0.15 -1.26 -3.22 113.70 118.13 2da6 s SER 54 Ca 0.64 0.71 0.15 0.00 0.70 0.00 0.00 55.95 58.15 2da6 s SER 54 Cb -0.19 -2.16 0.84 0.00 -1.71 0.00 0.00 66.02 62.80 2da6 s SER 54 CO 0.62 0.34 1.37 -0.81 1.20 0.00 0.00 173.24 175.97 2da6 n PRO 55 N 1.73 0.35 -0.00 5.44 -0.04 -1.26 -1.89 135.00 139.32 2da6 n PRO 55 Ca -0.16 0.07 0.09 0.00 -0.04 0.00 0.00 63.50 63.47 2da6 n PRO 55 Cb 0.53 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.14 0.79 -1.47 3.54 7.64 -1.26 -4.34 113.62 117.37 2da6 n SER 56 Ca 0.09 -0.69 -0.12 0.00 1.01 0.00 0.00 58.87 59.16 2da6 n SER 56 Cb 0.09 1.25 0.13 0.00 -1.01 0.00 0.00 64.21 64.67 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 -1.66 2.44 0.14 1.43 4.76 -0.79 -4.73 118.16 119.75 2da6 n LYS 57 Ca 0.02 -3.53 0.11 0.00 -2.87 0.00 0.00 58.31 52.04 2da6 n LYS 57 Cb 0.36 -1.98 0.61 0.00 -1.84 0.00 0.00 35.03 32.18 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 1.47 2.08 -0.80 7.82 0.00 -1.75 -1.87 119.26 126.21 2da6 h ALA 58 Ca 0.28 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.41 2da6 h ALA 58 Cb 1.43 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 2da6 h ALA 58 CO 0.58 -0.13 0.90 1.12 0.00 0.00 0.00 179.25 181.72 2da6 h HIS 59 N 0.11 0.00 -0.16 0.00 2.07 -1.93 0.81 115.15 116.04 2da6 h HIS 59 Ca 0.10 0.00 -0.17 0.00 -2.85 0.00 0.00 60.37 57.45 2da6 h HIS 59 Cb 0.28 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.25 2da6 h HIS 59 CO -0.00 0.00 -0.60 0.78 -3.07 0.00 0.00 177.93 175.04 2da6 h GLY 60 N 0.00 0.60 -1.36 6.13 0.00 -1.74 -3.18 103.07 103.52 2da6 h GLY 60 Ca 0.38 -0.74 0.45 0.00 0.00 0.00 0.00 47.33 47.42 2da6 h GLY 60 CO -0.00 0.66 0.89 1.04 0.00 0.00 0.00 176.54 179.13 2da6 n LEU 61 N -3.93 0.16 0.00 3.11 4.77 0.28 -4.67 117.00 116.72 2da6 n LEU 61 Ca -0.04 1.22 0.00 0.00 -0.03 0.00 0.00 56.01 57.16 2da6 n LEU 61 Cb 0.63 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 2da6 n LEU 61 CO 0.48 -1.31 0.00 0.61 -1.33 0.00 0.00 177.39 175.84 2da6 n GLY 62 N -1.54 0.98 0.30 -0.72 0.00 -1.21 -0.42 105.19 102.59 2da6 n GLY 62 Ca 0.38 0.62 0.00 0.00 0.00 0.00 0.00 46.02 47.01 2da6 n GLY 62 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2da6 h SER 63 N 0.00 0.64 -0.28 1.61 4.64 -1.94 -0.96 113.55 117.26 2da6 h SER 63 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2da6 h SER 63 Cb 0.00 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.93 2da6 h SER 63 CO 0.00 0.58 0.00 0.59 -0.87 0.00 0.00 176.83 177.13 2da6 n ASN 64 N -4.35 2.31 -4.83 4.97 3.02 0.44 -4.78 115.26 112.03 2da6 n ASN 64 Ca 0.04 -2.19 -0.33 0.00 -0.03 0.00 0.00 54.58 52.07 2da6 n ASN 64 Cb 0.15 -0.39 -0.06 0.00 -0.61 0.00 0.00 39.78 38.88 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 3.90 0.01 3.41 2.96 -0.37 -4.90 118.68 122.63 2da6 s LEU 65 Ca 0.22 1.54 0.03 0.00 -0.22 0.00 0.00 54.13 55.70 2da6 s LEU 65 Cb 0.14 -4.40 -0.04 0.00 0.50 0.00 0.00 46.19 42.40 2da6 s LEU 65 CO 0.10 -0.37 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.04 2da6 s VAL 66 N -2.23 3.89 0.02 1.68 1.01 -1.26 -4.96 120.40 118.55 2da6 s VAL 66 Ca 0.59 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 2da6 s VAL 66 Cb -0.10 -2.73 0.00 0.00 0.00 0.00 0.00 36.38 33.55 2da6 s VAL 66 CO 0.18 0.35 0.15 0.42 0.00 0.00 0.00 175.10 176.20 2da6 s THR 67 N -1.08 0.10 0.28 3.92 -4.23 -1.26 -4.93 115.64 108.44 2da6 s THR 67 Ca 0.19 -0.81 0.18 0.00 -1.18 0.00 0.00 61.69 60.07 2da6 s THR 67 Cb -0.11 -0.64 0.29 0.00 1.34 0.00 0.00 72.50 73.37 2da6 s THR 67 CO 0.10 -0.44 1.10 1.21 -0.54 0.00 0.00 174.62 176.04 2da6 n GLU 68 N 1.13 -0.04 0.16 3.99 4.07 -1.26 0.14 120.64 128.83 2da6 n GLU 68 Ca -0.21 0.93 -0.13 0.00 -0.06 0.00 0.00 57.16 57.68 2da6 n GLU 68 Cb 0.57 -1.73 -0.08 0.00 -0.06 0.00 0.00 31.44 30.14 2da6 n GLU 68 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 2da6 h VAL 69 N 0.00 0.68 -0.96 6.31 2.07 -1.98 -1.80 116.25 120.56 2da6 h VAL 69 Ca 0.60 -0.58 0.21 0.00 0.82 0.00 0.00 66.70 67.75 2da6 h VAL 69 Cb 1.73 0.97 -0.18 0.00 -1.52 0.00 0.00 31.29 32.29 2da6 h VAL 69 CO -0.45 0.11 -0.19 0.03 0.02 0.00 0.00 177.57 177.09 2da6 h ARG 70 N -0.75 0.00 -0.34 1.57 2.47 0.77 0.47 114.38 118.57 2da6 h ARG 70 Ca -0.04 -0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.58 2da6 h ARG 70 Cb 0.50 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 2da6 h ARG 70 CO 0.07 0.00 -0.18 0.28 0.56 0.00 0.00 179.97 180.71 2da6 h VAL 71 N 0.00 1.29 -1.00 2.04 2.07 -1.49 -2.14 116.25 117.01 2da6 h VAL 71 Ca 0.49 -1.30 0.13 0.00 0.82 0.00 0.00 66.70 66.84 2da6 h VAL 71 Cb 0.80 1.40 -0.09 0.00 -1.52 0.00 0.00 31.29 31.88 2da6 h VAL 71 CO -0.97 0.42 0.63 0.22 0.02 0.00 0.00 177.57 177.89 2da6 h TYR 72 N 0.49 1.13 0.34 1.57 5.03 0.74 -1.65 116.97 124.63 2da6 h TYR 72 Ca 0.07 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.40 2da6 h TYR 72 Cb 0.72 -0.36 0.00 0.00 1.55 0.00 0.00 36.73 38.64 2da6 h TYR 72 CO 0.06 0.41 -0.16 -0.91 -1.32 0.00 0.00 178.16 176.24 2da6 h ASN 73 N 0.95 -0.38 -0.98 -2.11 2.35 -0.86 -2.73 115.58 111.82 2da6 h ASN 73 Ca 0.51 -0.05 0.34 0.00 -0.55 0.00 0.00 56.30 56.55 2da6 h ASN 73 Cb 0.57 0.10 -0.17 0.00 0.05 0.00 0.00 38.32 38.86 2da6 h ASN 73 CO -0.29 0.07 0.36 -0.25 -1.65 0.00 0.00 177.43 175.68 2da6 h TRP 74 N -1.09 0.53 -0.32 1.19 7.01 -1.17 1.23 115.95 123.34 2da6 h TRP 74 Ca -0.05 0.05 -0.13 0.00 2.11 0.00 0.00 58.89 60.87 2da6 h TRP 74 Cb 0.41 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.39 2da6 h TRP 74 CO 0.01 -0.39 -0.34 0.74 -2.79 0.00 0.00 178.44 175.67 2da6 h PHE 75 N 0.07 0.83 -0.47 2.65 -1.00 -1.36 -2.71 116.94 114.95 2da6 h PHE 75 Ca 0.73 -0.22 0.04 0.00 2.81 0.00 0.00 57.97 61.32 2da6 h PHE 75 Cb 1.75 -0.18 -0.04 0.00 3.61 0.00 0.00 35.95 41.08 2da6 h PHE 75 CO -0.18 0.95 0.23 0.00 -1.61 0.00 0.00 178.31 177.70 2da6 h ALA 76 N 1.03 0.59 -0.61 2.45 0.00 0.18 -2.36 119.26 120.55 2da6 h ALA 76 Ca 0.06 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 2da6 h ALA 76 Cb 0.86 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2da6 h ALA 76 CO 0.08 -0.12 0.08 -0.97 0.00 0.00 0.00 179.25 178.32 2da6 h ASN 77 N 0.46 0.98 -0.25 0.00 -0.73 -1.31 -0.01 115.58 114.73 2da6 h ASN 77 Ca 0.21 -0.27 0.07 0.00 1.87 0.00 0.00 56.30 58.18 2da6 h ASN 77 Cb 0.12 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.43 2da6 h ASN 77 CO -0.15 1.01 0.27 0.03 -0.37 0.00 0.00 177.43 178.22 2da6 h ARG 78 N 0.93 0.00 0.00 6.67 2.47 -1.10 0.25 114.38 123.59 2da6 h ARG 78 Ca 0.18 0.00 -0.33 0.00 -1.26 0.00 0.00 59.98 58.57 2da6 h ARG 78 Cb 0.45 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.71 2da6 h ARG 78 CO 0.02 0.00 -2.16 0.54 0.56 0.00 0.00 179.97 178.92 2da6 n ARG 79 N -3.80 0.67 0.16 0.04 1.74 -0.92 -3.65 116.66 110.90 2da6 n ARG 79 Ca 0.03 0.08 0.03 0.00 -0.77 0.00 0.00 57.85 57.22 2da6 n ARG 79 Cb 0.41 -1.60 0.21 0.00 -1.02 0.00 0.00 32.46 30.46 2da6 n ARG 79 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 2da6 h LYS 80 N 0.00 0.00 0.10 5.56 2.10 0.45 -2.78 116.57 122.00 2da6 h LYS 80 Ca -0.45 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.07 2da6 h LYS 80 Cb 2.14 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 33.48 2da6 h LYS 80 CO 0.04 0.50 -0.56 1.05 -2.00 0.00 0.00 179.45 178.49 2da6 h GLU 81 N 0.00 0.20 0.00 0.07 4.11 -0.75 -2.35 114.58 115.86 2da6 h GLU 81 Ca -0.00 -0.35 -0.01 0.00 0.07 0.00 0.00 59.36 59.07 2da6 h GLU 81 Cb 1.09 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 2da6 h GLU 81 CO 0.06 1.17 -0.07 1.05 0.07 0.00 0.00 179.01 181.29 2da6 h GLU 82 N -0.58 0.00 0.00 1.06 4.11 -1.63 -0.84 114.58 116.71 2da6 h GLU 82 Ca -0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.33 2da6 h GLU 82 Cb 1.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.69 2da6 h GLU 82 CO 0.10 0.07 -0.76 0.00 0.07 0.00 0.00 179.01 178.49 2da6 n ALA 83 N -2.42 3.26 0.16 1.06 0.00 -1.05 -4.39 120.51 117.14 2da6 n ALA 83 Ca -0.03 -0.33 -0.08 0.00 0.00 0.00 0.00 53.44 53.00 2da6 n ALA 83 Cb 0.15 -1.08 -0.04 0.00 0.00 0.00 0.00 19.45 18.48 2da6 n ALA 83 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2da6 h PHE 84 N 0.00 -0.56 -0.62 0.00 3.04 -0.57 0.75 116.94 118.98 2da6 h PHE 84 Ca 0.00 -0.00 0.18 0.00 3.98 0.00 0.00 57.97 62.13 2da6 h PHE 84 Cb 0.68 0.20 -0.02 0.00 2.56 0.00 0.00 35.95 39.37 2da6 h PHE 84 CO 0.00 -0.30 1.00 0.00 -2.02 0.00 0.00 178.31 177.00 2da6 h ARG 85 N -0.47 0.00 0.00 1.11 3.08 -1.77 1.95 114.38 118.28 2da6 h ARG 85 Ca -0.04 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.69 2da6 h ARG 85 Cb 0.39 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.38 2da6 h ARG 85 CO 0.02 0.00 -2.11 1.04 -1.07 0.00 0.00 179.97 177.86 2da6 n GLN 86 N -3.09 0.67 0.06 0.04 6.02 -0.67 -4.16 117.38 116.24 2da6 n GLN 86 Ca 0.13 0.10 -0.10 0.00 -0.01 0.00 0.00 57.00 57.13 2da6 n GLN 86 Cb 1.20 -1.63 0.02 0.00 1.02 0.00 0.00 30.24 30.86 2da6 n GLN 86 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 2da6 h LYS 87 N 0.00 0.38 0.00 -1.09 3.11 0.95 -2.89 116.57 117.03 2da6 h LYS 87 Ca -0.43 -0.32 0.00 0.00 -2.81 0.00 0.00 60.65 57.09 2da6 h LYS 87 Cb 2.10 0.07 0.00 0.00 -1.00 0.00 0.00 32.23 33.41 2da6 h LYS 87 CO 0.05 0.97 0.00 1.47 -2.81 0.00 0.00 179.45 179.13 2da6 n LEU 88 N -3.82 0.00 -0.39 5.20 -0.00 0.41 -2.05 117.00 116.35 2da6 n LEU 88 Ca -0.04 0.36 0.11 0.00 -0.00 0.00 0.00 56.01 56.44 2da6 n LEU 88 Cb 0.72 -0.36 0.09 0.00 -0.00 0.00 0.00 43.42 43.87 2da6 n LEU 88 CO 0.48 -0.13 0.37 0.00 -0.00 0.00 0.00 177.39 178.12 2da6 n ALA 89 N -1.36 3.52 1.05 1.47 0.00 -1.09 -4.00 120.51 120.11 2da6 n ALA 89 Ca 0.08 -0.57 0.12 0.00 0.00 0.00 0.00 53.44 53.06 2da6 n ALA 89 Cb 0.18 -0.89 0.16 0.00 0.00 0.00 0.00 19.45 18.90 2da6 n ALA 89 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2da6 n MET 90 N -0.31 0.31 -0.67 0.00 2.81 -0.87 -3.94 117.12 114.44 2da6 n MET 90 Ca 0.10 -0.21 0.04 0.00 -1.81 0.00 0.00 57.70 55.81 2da6 n MET 90 Cb 0.43 -1.50 0.29 0.00 -0.71 0.00 0.00 33.22 31.73 2da6 n MET 90 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2da6 n ASP 91 N -1.16 4.43 -4.17 7.83 2.03 -1.25 -4.84 116.55 119.41 2da6 n ASP 91 Ca 0.07 -2.71 -0.33 0.00 0.52 0.00 0.00 54.79 52.35 2da6 n ASP 91 Cb 0.35 -0.64 -0.16 0.00 -0.72 0.00 0.00 41.12 39.94 2da6 n ASP 91 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2da6 s ALA 92 N -2.30 2.29 0.85 -1.67 0.00 -1.25 -5.12 121.76 114.55 2da6 s ALA 92 Ca 0.40 -1.11 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 2da6 s ALA 92 Cb 0.31 -1.05 0.10 0.00 0.00 0.00 0.00 23.12 22.47 2da6 s ALA 92 CO 0.11 -0.09 1.09 0.71 0.00 0.00 0.00 175.76 177.59 2da6 s TYR 93 N 0.90 2.56 -0.55 0.00 1.51 -1.26 -4.97 117.35 115.54 2da6 s TYR 93 Ca -0.05 1.23 0.01 0.00 -1.01 0.00 0.00 57.07 57.25 2da6 s TYR 93 Cb -0.15 -3.14 0.47 0.00 -0.11 0.00 0.00 41.96 39.03 2da6 s TYR 93 CO -0.04 -2.09 1.81 0.43 -1.11 0.00 0.00 175.55 174.55 2da6 n SER 94 N -3.67 6.55 -3.66 2.29 7.64 -1.26 -4.76 113.62 116.75 2da6 n SER 94 Ca 0.07 -3.77 -0.23 0.00 1.01 0.00 0.00 58.87 55.95 2da6 n SER 94 Cb 0.56 -0.80 -0.17 0.00 -1.01 0.00 0.00 64.21 62.78 2da6 n SER 94 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2da6 s SER 95 N -2.24 1.83 -0.65 6.43 0.15 -1.26 -4.84 113.70 113.12 2da6 s SER 95 Ca 0.60 -0.30 -0.04 0.00 0.70 0.00 0.00 55.95 56.91 2da6 s SER 95 Cb 0.48 -0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 2da6 s SER 95 CO 0.01 -0.29 0.57 -3.20 1.20 0.00 0.00 173.24 171.52 2da6 n ASN 96 N 5.26 -3.86 -0.06 5.45 5.15 -1.26 -4.95 115.26 120.98 2da6 n ASN 96 Ca -0.06 -0.27 -0.11 0.00 -0.60 0.00 0.00 54.58 53.54 2da6 n ASN 96 Cb 0.49 -2.71 -0.05 0.00 -0.53 0.00 0.00 39.78 36.98 2da6 n ASN 96 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 2da6 h SER 97 N -1.27 0.32 0.00 1.20 4.64 -1.88 -3.37 113.55 113.19 2da6 h SER 97 Ca -0.28 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2da6 h SER 97 Cb 1.18 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2da6 h SER 97 CO 0.27 0.51 0.00 0.61 -0.87 0.00 0.00 176.83 177.35 2da6 n GLY 98 N -0.39 -1.04 3.57 -0.77 0.00 -1.26 -3.33 105.19 101.96 2da6 n GLY 98 Ca -0.04 0.22 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.36 2.54 -0.53 1.61 0.04 -1.26 -4.90 135.00 132.14 2da6 s PRO 99 Ca 0.00 -0.61 -0.34 0.00 0.04 0.00 0.00 61.00 60.09 2da6 s PRO 99 Cb 0.00 -5.13 -0.14 0.00 0.04 0.00 0.00 34.50 29.27 2da6 s PRO 99 CO 0.00 -3.60 2.33 0.43 0.04 0.00 0.00 177.00 176.20 2da6 n SER 100 N 14.11 1.59 -4.93 6.66 7.64 -1.21 -4.91 113.62 132.56 2da6 n SER 100 Ca 0.42 0.25 -0.25 0.00 1.01 0.00 0.00 58.87 60.29 2da6 n SER 100 Cb 0.47 -1.19 0.02 0.00 -1.01 0.00 0.00 64.21 62.50 2da6 n SER 100 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2da6 s SER 101 N 8.30 5.71 0.00 6.43 0.01 -1.26 -5.18 113.70 127.71 2da6 s SER 101 Ca 1.15 0.55 0.00 0.00 1.31 0.00 0.00 55.95 58.96 2da6 s SER 101 Cb -0.92 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2da6 s SER 101 CO 0.48 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.83