#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 1.92 -4.19 1.61 7.64 -1.26 -4.80 113.62 114.54 2da6 n SER 2 Ca 0.00 0.38 -0.41 0.00 1.01 0.00 0.00 58.87 59.85 2da6 n SER 2 Cb 0.00 -0.86 -0.08 0.00 -1.01 0.00 0.00 64.21 62.26 2da6 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2da6 s SER 3 N -7.10 5.76 1.14 6.43 0.15 -1.26 -5.08 113.70 113.74 2da6 s SER 3 Ca -0.34 -2.39 -0.08 0.00 0.70 0.00 0.00 55.95 53.85 2da6 s SER 3 Cb 0.11 -2.00 0.12 0.00 -1.71 0.00 0.00 66.02 62.54 2da6 s SER 3 CO 0.51 -0.56 0.26 0.61 1.20 0.00 0.00 173.24 175.26 2da6 n GLY 4 N 4.24 -3.78 0.28 9.45 0.00 -1.26 -4.96 105.19 109.15 2da6 n GLY 4 Ca 0.02 -1.24 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 2da6 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2da6 h SER 5 N -2.50 -0.55 -4.04 1.61 0.02 -2.02 -3.46 113.55 102.61 2da6 h SER 5 Ca -0.12 0.02 -0.45 0.00 -0.84 0.00 0.00 61.79 60.40 2da6 h SER 5 Cb 0.41 0.14 0.15 0.00 0.14 0.00 0.00 62.40 63.24 2da6 h SER 5 CO 0.07 -0.19 0.29 -0.44 -1.14 0.00 0.00 176.83 175.42 2da6 s SER 6 N -4.45 2.88 0.88 3.07 0.01 -1.26 -5.05 113.70 109.79 2da6 s SER 6 Ca -0.10 0.73 -0.12 0.00 1.31 0.00 0.00 55.95 57.77 2da6 s SER 6 Cb 0.01 -1.12 0.12 0.00 0.21 0.00 0.00 66.02 65.25 2da6 s SER 6 CO 0.29 -2.92 1.15 -0.83 0.41 0.00 0.00 173.24 171.34 2da6 s GLY 7 N -4.20 1.58 0.08 3.44 0.00 -1.26 -5.04 107.32 101.92 2da6 s GLY 7 Ca 0.68 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.82 2da6 s GLY 7 CO 0.54 -0.03 0.00 -2.13 0.00 0.00 0.00 173.10 171.47 2da6 n ARG 8 N -3.64 0.00 -1.86 2.90 0.63 -1.26 -5.03 116.66 108.39 2da6 n ARG 8 Ca 0.07 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.58 2da6 n ARG 8 Cb 0.60 -0.21 -0.03 0.00 0.45 0.00 0.00 32.46 33.26 2da6 n ARG 8 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2da6 s ASN 9 N -5.33 6.55 -0.98 6.15 -0.87 -1.26 -4.88 114.94 114.32 2da6 s ASN 9 Ca 0.00 2.54 -0.24 0.00 -1.57 0.00 0.00 52.86 53.60 2da6 s ASN 9 Cb 0.00 -2.56 -0.03 0.00 -0.02 0.00 0.00 41.25 38.64 2da6 s ASN 9 CO 0.00 -0.93 1.84 -0.13 -2.57 0.00 0.00 177.10 175.31 2da6 s ARG 10 N 2.92 2.79 -0.04 -0.60 3.00 -1.26 -4.94 118.95 120.82 2da6 s ARG 10 Ca 0.77 -0.63 -0.01 0.00 0.00 0.00 0.00 55.73 55.86 2da6 s ARG 10 Cb -0.41 -5.16 -0.04 0.00 0.00 0.00 0.00 34.95 29.34 2da6 s ARG 10 CO 0.34 -3.20 0.03 0.12 0.00 0.00 0.00 175.30 172.58 2da6 s PHE 11 N 9.04 3.18 -0.04 -0.53 5.36 -1.26 -4.79 117.98 128.94 2da6 s PHE 11 Ca 0.65 0.18 -0.01 0.00 -0.96 0.00 0.00 56.93 56.79 2da6 s PHE 11 Cb -0.04 -1.75 0.03 0.00 -0.34 0.00 0.00 43.02 40.92 2da6 s PHE 11 CO -0.00 0.50 0.06 0.21 -1.46 0.00 0.00 175.22 174.53 2da6 s LYS 12 N -1.29 -0.01 0.80 10.12 2.20 -1.26 -5.09 119.74 125.21 2da6 s LYS 12 Ca 0.17 0.27 -0.13 0.00 -0.36 0.00 0.00 55.97 55.92 2da6 s LYS 12 Cb -0.12 -0.27 0.08 0.00 -1.51 0.00 0.00 37.83 36.02 2da6 s LYS 12 CO 0.07 -0.19 1.21 -1.58 -0.36 0.00 0.00 175.35 174.50 2da6 s TRP 13 N 1.29 1.79 0.12 4.03 0.52 -1.26 -4.94 118.94 120.49 2da6 s TRP 13 Ca -0.07 1.67 0.02 0.00 0.02 0.00 0.00 56.10 57.74 2da6 s TRP 13 Cb -0.13 -3.50 0.02 0.00 -1.15 0.00 0.00 33.47 28.71 2da6 s TRP 13 CO -0.04 -2.89 0.15 0.41 0.02 0.00 0.00 176.95 174.61 2da6 n GLY 14 N 0.53 2.15 0.16 0.98 0.00 -1.26 -4.92 105.19 102.84 2da6 n GLY 14 Ca 0.14 -2.16 -0.13 0.00 0.00 0.00 0.00 46.02 43.87 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 0.48 0.01 1.61 0.13 -2.00 -2.82 132.00 129.41 2da6 h PRO 15 Ca -0.06 -0.26 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2da6 h PRO 15 Cb 0.26 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.40 2da6 h PRO 15 CO 0.09 0.83 -0.01 0.00 -0.23 0.00 0.00 178.00 178.68 2da6 h ALA 16 N 0.65 -0.02 -0.32 -0.56 0.00 -1.96 -3.28 119.26 113.77 2da6 h ALA 16 Ca 0.03 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.60 2da6 h ALA 16 Cb 0.74 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 2da6 h ALA 16 CO 0.05 -0.04 -0.49 0.77 0.00 0.00 0.00 179.25 179.54 2da6 h SER 17 N -0.95 -1.62 -0.64 0.00 0.02 -1.84 -1.96 113.55 106.56 2da6 h SER 17 Ca -0.00 0.21 0.06 0.00 -0.84 0.00 0.00 61.79 61.22 2da6 h SER 17 Cb 0.77 0.66 -0.09 0.00 0.14 0.00 0.00 62.40 63.87 2da6 h SER 17 CO 0.00 -0.37 -0.48 1.56 -1.14 0.00 0.00 176.83 176.41 2da6 h GLN 18 N -0.38 -0.12 -0.89 3.45 4.20 -1.66 0.20 115.11 119.91 2da6 h GLN 18 Ca 0.06 0.01 0.23 0.00 0.06 0.00 0.00 58.65 59.01 2da6 h GLN 18 Cb 0.54 0.03 -0.16 0.00 0.30 0.00 0.00 27.48 28.19 2da6 h GLN 18 CO -0.50 -0.08 0.07 1.96 -0.67 0.00 0.00 178.83 179.62 2da6 h GLN 19 N -0.13 0.08 -0.81 1.46 1.08 -1.48 0.56 115.11 115.87 2da6 h GLN 19 Ca 0.11 -0.00 0.07 0.00 -1.45 0.00 0.00 58.65 57.37 2da6 h GLN 19 Cb 0.40 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.75 2da6 h GLN 19 CO -0.67 0.05 0.49 0.82 -0.95 0.00 0.00 178.83 178.57 2da6 h ILE 20 N 0.08 1.00 -0.79 2.54 2.04 0.11 -1.48 117.51 121.01 2da6 h ILE 20 Ca 0.53 -0.30 0.01 0.00 1.00 0.00 0.00 64.86 66.11 2da6 h ILE 20 Cb 1.06 0.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 2da6 h ILE 20 CO -0.78 0.16 0.52 -0.07 0.00 0.00 0.00 178.15 177.98 2da6 h LEU 21 N 0.88 0.89 -0.10 1.44 3.38 0.89 -2.30 115.31 120.39 2da6 h LEU 21 Ca 0.36 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 2da6 h LEU 21 Cb 0.20 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2da6 h LEU 21 CO -0.19 0.64 0.03 1.88 0.09 0.00 0.00 178.44 180.89 2da6 h TYR 22 N 1.05 0.15 -0.73 1.13 0.05 -0.72 0.12 116.97 118.02 2da6 h TYR 22 Ca 0.30 -0.01 0.15 0.00 0.05 0.00 0.00 58.73 59.22 2da6 h TYR 22 Cb -0.09 -0.04 -0.05 0.00 1.01 0.00 0.00 36.73 37.56 2da6 h TYR 22 CO -0.02 0.29 0.49 1.96 -1.05 0.00 0.00 178.16 179.83 2da6 h GLN 23 N -0.03 0.34 0.18 4.88 1.08 -1.04 0.21 115.11 120.73 2da6 h GLN 23 Ca 0.03 -0.02 -0.25 0.00 -1.45 0.00 0.00 58.65 56.96 2da6 h GLN 23 Cb 0.21 -0.08 0.02 0.00 -0.05 0.00 0.00 27.48 27.58 2da6 h GLN 23 CO -0.00 0.23 -1.15 0.00 -0.95 0.00 0.00 178.83 176.95 2da6 h ALA 24 N 1.65 -0.06 -0.40 3.87 0.00 -1.07 -3.32 119.26 119.94 2da6 h ALA 24 Ca 0.36 -0.83 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 2da6 h ALA 24 Cb 0.89 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 2da6 h ALA 24 CO -0.10 0.57 0.09 -0.92 0.00 0.00 0.00 179.25 178.89 2da6 h TYR 25 N -0.18 0.60 -0.38 0.00 5.03 0.16 -1.54 116.97 120.65 2da6 h TYR 25 Ca -0.21 -0.04 0.02 0.00 2.58 0.00 0.00 58.73 61.07 2da6 h TYR 25 Cb 1.84 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 39.92 2da6 h TYR 25 CO 0.16 0.52 0.25 0.22 -1.32 0.00 0.00 178.16 178.00 2da6 h ASP 26 N 0.57 0.39 0.00 -2.11 3.58 -0.72 -3.00 116.42 115.13 2da6 h ASP 26 Ca 0.13 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.53 2da6 h ASP 26 Cb 0.23 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2da6 h ASP 26 CO -0.00 0.28 -0.24 0.03 -2.88 0.00 0.00 179.24 176.42 2da6 h ARG 27 N 0.46 0.00 -4.98 0.28 3.08 -1.48 -3.47 114.38 108.27 2da6 h ARG 27 Ca 0.15 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.76 2da6 h ARG 27 Cb 0.03 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 29.79 2da6 h ARG 27 CO -0.03 0.91 -0.80 -1.14 -1.07 0.00 0.00 179.97 177.84 2da6 s GLN 28 N -2.20 0.95 0.00 0.04 2.00 -0.65 -5.05 119.66 114.76 2da6 s GLN 28 Ca -0.19 -0.41 -0.17 0.00 -2.00 0.00 0.00 55.36 52.59 2da6 s GLN 28 Cb -0.01 -0.92 -0.34 0.00 0.80 0.00 0.00 33.01 32.54 2da6 s GLN 28 CO 0.61 0.24 0.93 0.87 -0.50 0.00 0.00 175.29 177.44 2da6 h LYS 29 N 5.91 0.47 -3.37 1.67 1.79 -1.86 -3.35 116.57 117.83 2da6 h LYS 29 Ca -0.33 -0.80 -0.67 0.00 -2.18 0.00 0.00 60.65 56.67 2da6 h LYS 29 Cb 1.17 0.30 -0.38 0.00 -1.58 0.00 0.00 32.23 31.74 2da6 h LYS 29 CO 0.49 1.38 -0.40 0.54 -1.08 0.00 0.00 179.45 180.39 2da6 s ASN 30 N -7.41 5.13 0.23 0.86 2.20 -1.26 -4.96 114.94 109.73 2da6 s ASN 30 Ca -0.11 -3.30 -0.30 0.00 -0.94 0.00 0.00 52.86 48.21 2da6 s ASN 30 Cb 0.03 -1.78 -0.09 0.00 -2.00 0.00 0.00 41.25 37.42 2da6 s ASN 30 CO 0.91 -0.24 1.28 -2.16 -2.94 0.00 0.00 177.10 173.96 2da6 s PRO 31 N -0.71 4.41 0.66 3.55 0.04 -1.26 -5.04 135.00 136.65 2da6 s PRO 31 Ca 0.21 2.05 0.02 0.00 0.04 0.00 0.00 61.00 63.32 2da6 s PRO 31 Cb -0.15 -3.18 0.10 0.00 0.04 0.00 0.00 34.50 31.31 2da6 s PRO 31 CO -0.07 -0.19 0.91 -1.12 0.04 0.00 0.00 177.00 176.56 2da6 s SER 32 N 0.09 4.68 0.13 6.66 0.01 -1.26 -4.44 113.70 119.56 2da6 s SER 32 Ca 0.54 -0.41 -0.20 0.00 1.31 0.00 0.00 55.95 57.20 2da6 s SER 32 Cb -0.36 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 65.76 2da6 s SER 32 CO 0.41 -1.62 1.10 1.17 0.41 0.00 0.00 173.24 174.71 2da6 n LYS 33 N -2.61 -0.28 0.16 12.44 0.00 -1.26 0.69 118.16 127.31 2da6 n LYS 33 Ca 0.14 1.08 -0.15 0.00 0.00 0.00 0.00 58.31 59.38 2da6 n LYS 33 Cb 0.61 -1.59 -0.08 0.00 0.00 0.00 0.00 35.03 33.96 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 -0.72 0.17 1.64 4.39 -1.99 0.32 114.58 118.40 2da6 h GLU 34 Ca 0.15 0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 2da6 h GLU 34 Cb 0.33 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2da6 h GLU 34 CO -0.68 -0.48 -0.22 0.93 -1.16 0.00 0.00 179.01 177.40 2da6 h GLU 35 N -0.74 -0.39 -0.76 2.33 5.08 -1.09 -1.31 114.58 117.69 2da6 h GLU 35 Ca -0.03 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 2da6 h GLU 35 Cb 0.70 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 29.90 2da6 h GLU 35 CO -0.16 -0.26 -0.30 0.00 -1.00 0.00 0.00 179.01 177.28 2da6 h ARG 36 N -0.41 -0.07 -0.38 2.33 3.08 0.28 0.32 114.38 119.54 2da6 h ARG 36 Ca -0.02 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.11 2da6 h ARG 36 Cb 0.36 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.34 2da6 h ARG 36 CO -0.05 -0.05 -0.24 0.93 -1.07 0.00 0.00 179.97 179.49 2da6 h GLU 37 N -0.07 -0.17 0.00 0.04 4.39 -0.14 0.40 114.58 119.02 2da6 h GLU 37 Ca 0.31 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.02 2da6 h GLU 37 Cb 0.58 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2da6 h GLU 37 CO -0.81 -0.11 0.59 0.00 -1.16 0.00 0.00 179.01 177.52 2da6 h ALA 38 N 1.00 1.57 0.00 3.43 0.00 0.26 1.27 119.26 126.79 2da6 h ALA 38 Ca 0.18 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.87 2da6 h ALA 38 Cb 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 2da6 h ALA 38 CO -0.48 -0.57 -1.84 1.28 0.00 0.00 0.00 179.25 177.63 2da6 n LEU 39 N -2.64 0.47 -0.11 0.00 4.77 0.13 -2.92 117.00 116.70 2da6 n LEU 39 Ca -0.01 0.21 -0.13 0.00 -0.03 0.00 0.00 56.01 56.05 2da6 n LEU 39 Cb 0.62 0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.88 2da6 n LEU 39 CO 0.07 0.26 0.56 0.58 -1.33 0.00 0.00 177.39 177.54 2da6 h VAL 40 N 0.00 1.28 0.10 4.08 2.07 0.22 -1.97 116.25 122.04 2da6 h VAL 40 Ca -0.27 -1.51 -0.17 0.00 0.82 0.00 0.00 66.70 65.57 2da6 h VAL 40 Cb 1.76 1.47 0.01 0.00 -1.52 0.00 0.00 31.29 33.00 2da6 h VAL 40 CO 0.04 0.49 -0.82 1.05 0.02 0.00 0.00 177.57 178.35 2da6 h GLU 41 N 0.62 0.21 -0.38 1.57 4.11 -1.58 -3.06 114.58 116.06 2da6 h GLU 41 Ca 0.05 -0.36 0.06 0.00 0.07 0.00 0.00 59.36 59.18 2da6 h GLU 41 Cb 0.92 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.25 2da6 h GLU 41 CO 0.08 1.17 0.07 1.49 0.07 0.00 0.00 179.01 181.90 2da6 h GLU 42 N -0.51 0.19 0.45 1.06 4.57 -1.62 0.27 114.58 118.99 2da6 h GLU 42 Ca -0.16 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 57.98 2da6 h GLU 42 Cb 1.53 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 30.08 2da6 h GLU 42 CO 0.08 0.13 -0.22 0.00 -1.18 0.00 0.00 179.01 177.82 2da6 h ASN 44 N -0.64 0.28 0.45 0.00 2.35 -1.48 0.15 115.58 116.70 2da6 h ASN 44 Ca -0.06 0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 2da6 h ASN 44 Cb 0.46 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.88 2da6 h ASN 44 CO 0.10 -0.01 -0.22 -0.09 -1.65 0.00 0.00 177.43 175.56 2da6 h ARG 45 N 0.21 -0.59 -0.96 0.81 2.43 -0.72 -2.92 114.38 112.64 2da6 h ARG 45 Ca 0.67 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.95 2da6 h ARG 45 Cb 2.05 0.13 -0.07 0.00 -0.42 0.00 0.00 29.97 31.67 2da6 h ARG 45 CO -0.26 -0.29 0.62 0.00 -1.51 0.00 0.00 179.97 178.53 2da6 h ALA 46 N -0.74 1.47 -0.95 2.80 0.00 0.43 -1.53 119.26 120.74 2da6 h ALA 46 Ca -0.06 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.93 2da6 h ALA 46 Cb 0.57 -0.28 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 2da6 h ALA 46 CO 0.10 0.37 0.59 0.93 0.00 0.00 0.00 179.25 181.24 2da6 h GLU 47 N 1.09 0.94 -0.37 0.00 5.08 -0.79 0.25 114.58 120.79 2da6 h GLU 47 Ca 0.42 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.59 2da6 h GLU 47 Cb 0.23 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2da6 h GLU 47 CO -0.17 0.62 -0.31 0.00 -1.00 0.00 0.00 179.01 178.15 2da6 h LEU 49 N 0.67 -0.15 -0.30 0.00 3.38 -0.80 1.69 115.31 119.80 2da6 h LEU 49 Ca 0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2da6 h LEU 49 Cb 0.90 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2da6 h LEU 49 CO 0.08 0.01 0.12 0.06 0.09 0.00 0.00 178.44 178.80 2da6 h GLN 50 N -0.30 0.44 0.00 1.13 3.07 -1.02 -1.72 115.11 116.71 2da6 h GLN 50 Ca -0.02 -0.08 0.00 0.00 0.09 0.00 0.00 58.65 58.65 2da6 h GLN 50 Cb 0.24 -0.07 0.00 0.00 0.08 0.00 0.00 27.48 27.72 2da6 h GLN 50 CO 0.03 0.45 0.00 0.54 0.09 0.00 0.00 178.83 179.94 2da6 n ARG 51 N -4.75 0.77 0.00 0.06 1.74 -0.35 -4.84 116.66 109.30 2da6 n ARG 51 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 2da6 n ARG 51 Cb 0.13 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 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 0.42 2.83 3.32 -0.13 0.00 -0.08 -5.00 105.19 106.55 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 -0.62 0.00 0.00 0.00 173.32 172.70 2da6 n VAL 53 N -0.91 0.00 -3.80 1.61 0.31 0.56 -4.78 118.33 111.32 2da6 n VAL 53 Ca 0.00 -0.28 -0.37 0.00 -0.01 0.00 0.00 64.34 63.69 2da6 n VAL 53 Cb 0.00 -0.92 -0.06 0.00 -0.91 0.00 0.00 33.84 31.96 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 -2.53 6.48 0.00 4.52 0.15 -1.26 -3.24 113.70 117.82 2da6 s SER 54 Ca 0.65 0.56 0.15 0.00 0.70 0.00 0.00 55.95 58.00 2da6 s SER 54 Cb -0.18 -2.10 0.74 0.00 -1.71 0.00 0.00 66.02 62.77 2da6 s SER 54 CO 0.61 0.36 1.41 -0.81 1.20 0.00 0.00 173.24 176.01 2da6 n PRO 55 N 1.76 0.20 0.00 5.44 -0.04 -1.26 -1.94 135.00 139.16 2da6 n PRO 55 Ca -0.17 0.15 0.11 0.00 -0.04 0.00 0.00 63.50 63.55 2da6 n PRO 55 Cb 0.54 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.43 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 -1.30 0.68 -0.78 3.54 7.64 -1.26 -4.17 113.62 117.97 2da6 n SER 56 Ca 0.07 -0.57 0.04 0.00 1.01 0.00 0.00 58.87 59.42 2da6 n SER 56 Cb 0.12 1.10 0.21 0.00 -1.01 0.00 0.00 64.21 64.63 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 -1.75 2.06 -0.30 1.43 4.76 -0.82 -4.74 118.16 118.79 2da6 n LYS 57 Ca 0.02 -2.96 0.13 0.00 -2.87 0.00 0.00 58.31 52.63 2da6 n LYS 57 Cb 0.40 -1.74 0.30 0.00 -1.84 0.00 0.00 35.03 32.15 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 1.06 1.40 -1.05 7.82 0.00 -1.71 0.21 119.26 126.99 2da6 h ALA 58 Ca 0.08 0.16 0.31 0.00 0.00 0.00 0.00 54.91 55.45 2da6 h ALA 58 Cb 1.38 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 2da6 h ALA 58 CO 0.21 -0.33 1.13 1.12 0.00 0.00 0.00 179.25 181.38 2da6 h HIS 59 N 0.40 0.00 -0.30 0.00 2.07 -1.93 1.51 115.15 116.91 2da6 h HIS 59 Ca 0.55 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.98 2da6 h HIS 59 Cb 1.02 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.95 2da6 h HIS 59 CO -0.14 0.00 0.11 0.41 -3.07 0.00 0.00 177.93 175.24 2da6 n GLY 60 N -1.71 2.47 0.15 6.13 0.00 0.75 -3.95 105.19 109.04 2da6 n GLY 60 Ca 0.23 -0.40 0.06 0.00 0.00 0.00 0.00 46.02 45.92 2da6 n GLY 60 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2da6 h LEU 61 N 1.35 0.00 0.00 0.99 3.38 0.20 -3.50 115.31 117.73 2da6 h LEU 61 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2da6 h LEU 61 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 2da6 h LEU 61 CO 0.30 0.29 0.00 0.61 0.09 0.00 0.00 178.44 179.73 2da6 n GLY 62 N 1.21 1.31 0.12 0.83 0.00 -1.25 -3.45 105.19 103.95 2da6 n GLY 62 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 0.17 1.61 0.02 -1.95 -3.15 113.55 110.25 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 0.62 0.00 0.59 -1.14 0.00 0.00 176.83 176.90 2da6 n ASN 64 N -3.24 0.00 -4.76 3.07 3.02 -1.22 -4.62 115.26 107.51 2da6 n ASN 64 Ca 0.01 -0.18 -0.41 0.00 -0.03 0.00 0.00 54.58 53.97 2da6 n ASN 64 Cb 0.79 -0.16 -0.02 0.00 -0.61 0.00 0.00 39.78 39.78 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 -2.33 4.38 0.09 3.41 2.96 -1.19 -4.92 118.68 121.08 2da6 s LEU 65 Ca 0.19 2.75 -0.10 0.00 -0.22 0.00 0.00 54.13 56.75 2da6 s LEU 65 Cb 0.11 -3.64 -0.06 0.00 0.50 0.00 0.00 46.19 43.10 2da6 s LEU 65 CO 0.22 -0.70 0.42 -0.69 -1.32 0.00 0.00 176.35 174.27 2da6 s VAL 66 N -0.47 5.07 0.02 1.68 1.01 -1.26 -5.00 120.40 121.45 2da6 s VAL 66 Ca 0.56 0.49 -0.07 0.00 0.00 0.00 0.00 61.98 62.96 2da6 s VAL 66 Cb -0.42 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.30 2da6 s VAL 66 CO 0.49 0.28 0.13 0.42 0.00 0.00 0.00 175.10 176.42 2da6 s THR 67 N -1.41 0.11 0.35 3.92 -4.23 -1.26 -4.91 115.64 108.20 2da6 s THR 67 Ca 0.34 -0.88 0.29 0.00 -1.18 0.00 0.00 61.69 60.25 2da6 s THR 67 Cb -0.14 -0.69 0.43 0.00 1.34 0.00 0.00 72.50 73.44 2da6 s THR 67 CO 0.18 -0.49 1.11 1.21 -0.54 0.00 0.00 174.62 176.09 2da6 n GLU 68 N 1.05 -0.01 0.09 3.99 2.13 -1.26 0.15 120.64 126.78 2da6 n GLU 68 Ca -0.21 0.84 -0.11 0.00 0.66 0.00 0.00 57.16 58.34 2da6 n GLU 68 Cb 0.57 -1.76 -0.08 0.00 0.27 0.00 0.00 31.44 30.44 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 0.77 -0.84 6.31 2.07 -1.98 -2.05 116.25 120.53 2da6 h VAL 69 Ca 0.64 -0.94 0.18 0.00 0.82 0.00 0.00 66.70 67.41 2da6 h VAL 69 Cb 2.31 1.23 -0.15 0.00 -1.52 0.00 0.00 31.29 33.15 2da6 h VAL 69 CO -0.19 0.18 -0.11 0.03 0.02 0.00 0.00 177.57 177.50 2da6 h ARG 70 N -0.83 0.03 -0.40 1.57 2.47 0.94 0.43 114.38 118.58 2da6 h ARG 70 Ca -0.03 -0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.56 2da6 h ARG 70 Cb 0.51 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 2da6 h ARG 70 CO 0.05 0.02 -0.25 0.28 0.56 0.00 0.00 179.97 180.63 2da6 h VAL 71 N 0.03 1.27 -0.96 2.04 2.07 -1.55 -1.98 116.25 117.18 2da6 h VAL 71 Ca 0.44 -1.38 0.02 0.00 0.82 0.00 0.00 66.70 66.59 2da6 h VAL 71 Cb 0.74 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.69 2da6 h VAL 71 CO -0.81 0.46 0.63 0.22 0.02 0.00 0.00 177.57 178.09 2da6 h TYR 72 N 0.71 1.19 0.10 1.57 5.03 0.50 -1.58 116.97 124.49 2da6 h TYR 72 Ca 0.09 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.42 2da6 h TYR 72 Cb 0.78 -0.40 0.00 0.00 1.55 0.00 0.00 36.73 38.66 2da6 h TYR 72 CO 0.04 0.72 -0.05 -0.91 -1.32 0.00 0.00 178.16 176.65 2da6 h ASN 73 N 1.26 -0.12 -0.96 -2.11 2.35 -0.80 -1.86 115.58 113.35 2da6 h ASN 73 Ca 0.36 -0.46 0.22 0.00 -0.55 0.00 0.00 56.30 55.88 2da6 h ASN 73 Cb -0.08 0.03 -0.12 0.00 0.05 0.00 0.00 38.32 38.20 2da6 h ASN 73 CO -0.09 0.47 0.52 -0.25 -1.65 0.00 0.00 177.43 176.43 2da6 h TRP 74 N -0.78 0.89 -0.14 1.19 7.01 -1.23 0.14 115.95 123.04 2da6 h TRP 74 Ca -0.01 0.04 -0.21 0.00 2.11 0.00 0.00 58.89 60.81 2da6 h TRP 74 Cb 0.57 -0.24 0.01 0.00 -2.10 0.00 0.00 29.16 27.39 2da6 h TRP 74 CO 0.11 0.06 -0.76 0.74 -2.79 0.00 0.00 178.44 175.80 2da6 h PHE 75 N 0.55 0.92 -0.81 2.65 -1.00 -1.33 -2.72 116.94 115.20 2da6 h PHE 75 Ca 0.59 -0.41 -0.01 0.00 2.81 0.00 0.00 57.97 60.96 2da6 h PHE 75 Cb 1.08 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 40.46 2da6 h PHE 75 CO -0.05 1.22 0.48 0.00 -1.61 0.00 0.00 178.31 178.35 2da6 h ALA 76 N 0.67 1.32 -0.05 2.45 0.00 0.07 -1.79 119.26 121.93 2da6 h ALA 76 Ca -0.04 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 2da6 h ALA 76 Cb 1.37 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2da6 h ALA 76 CO 0.15 0.58 -0.65 -0.97 0.00 0.00 0.00 179.25 178.36 2da6 h ASN 77 N 1.12 0.25 0.88 0.00 -1.24 -1.01 -0.01 115.58 115.57 2da6 h ASN 77 Ca 0.29 -0.15 -0.05 0.00 0.71 0.00 0.00 56.30 57.10 2da6 h ASN 77 Cb -0.03 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 2da6 h ASN 77 CO -0.05 0.82 -0.22 0.03 -1.29 0.00 0.00 177.43 176.72 2da6 h ARG 78 N 0.15 0.00 0.00 6.67 2.47 -1.07 -2.07 114.38 120.53 2da6 h ARG 78 Ca -0.01 0.00 -0.18 0.00 -1.26 0.00 0.00 59.98 58.53 2da6 h ARG 78 Cb 1.17 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.45 2da6 h ARG 78 CO 0.10 0.22 -1.89 0.54 0.56 0.00 0.00 179.97 179.50 2da6 n ARG 79 N -3.41 0.65 0.14 0.04 1.74 -0.73 -3.82 116.66 111.27 2da6 n ARG 79 Ca -0.00 0.02 0.02 0.00 -0.77 0.00 0.00 57.85 57.12 2da6 n ARG 79 Cb 0.42 -1.63 0.09 0.00 -1.02 0.00 0.00 32.46 30.32 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 0.06 5.56 2.10 -0.87 -2.94 116.57 120.48 2da6 h LYS 80 Ca -0.24 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.24 2da6 h LYS 80 Cb 1.61 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.96 2da6 h LYS 80 CO 0.03 0.54 -0.72 1.05 -2.00 0.00 0.00 179.45 178.34 2da6 h GLU 81 N 0.00 0.38 -0.64 0.07 4.11 -1.54 -1.79 114.58 115.17 2da6 h GLU 81 Ca -0.01 -0.49 -0.02 0.00 0.07 0.00 0.00 59.36 58.91 2da6 h GLU 81 Cb 1.31 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.69 2da6 h GLU 81 CO 0.07 1.17 0.30 1.05 0.07 0.00 0.00 179.01 181.68 2da6 h GLU 82 N -0.19 0.92 0.00 1.06 4.11 -1.66 -2.22 114.58 116.60 2da6 h GLU 82 Ca -0.11 -0.14 0.00 0.00 0.07 0.00 0.00 59.36 59.18 2da6 h GLU 82 Cb 1.48 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2da6 h GLU 82 CO 0.14 0.74 0.00 0.00 0.07 0.00 0.00 179.01 179.96 2da6 h ALA 83 N 1.13 1.00 0.14 1.06 0.00 -1.61 -3.35 119.26 117.63 2da6 h ALA 83 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2da6 h ALA 83 Cb 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2da6 h ALA 83 CO -0.03 0.00 -0.15 0.35 0.00 0.00 0.00 179.25 179.42 2da6 h PHE 84 N 0.00 -0.43 -0.72 0.00 3.04 -0.67 0.45 116.94 118.61 2da6 h PHE 84 Ca 0.00 0.00 0.21 0.00 3.98 0.00 0.00 57.97 62.16 2da6 h PHE 84 Cb 0.82 0.17 -0.03 0.00 2.56 0.00 0.00 35.95 39.48 2da6 h PHE 84 CO 0.00 -0.20 1.06 0.00 -2.02 0.00 0.00 178.31 177.15 2da6 h ARG 85 N -0.29 0.00 0.12 1.11 3.08 -1.69 1.12 114.38 117.82 2da6 h ARG 85 Ca -0.02 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.68 2da6 h ARG 85 Cb 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2da6 h ARG 85 CO -0.03 0.00 -1.93 1.04 -1.07 0.00 0.00 179.97 177.99 2da6 n GLN 86 N -3.13 0.75 -0.09 0.04 6.02 -0.43 -3.92 117.38 116.61 2da6 n GLN 86 Ca 0.16 0.29 -0.01 0.00 -0.01 0.00 0.00 57.00 57.43 2da6 n GLN 86 Cb 1.28 -1.72 0.26 0.00 1.02 0.00 0.00 30.24 31.09 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 -0.03 0.73 0.00 -1.09 3.11 0.58 -0.62 116.57 119.25 2da6 h LYS 87 Ca -0.42 -0.12 0.00 0.00 -2.81 0.00 0.00 60.65 57.31 2da6 h LYS 87 Cb 1.97 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 33.08 2da6 h LYS 87 CO 0.06 0.63 0.00 1.47 -2.81 0.00 0.00 179.45 178.80 2da6 n LEU 88 N -4.32 0.00 -0.10 5.20 -0.00 -0.09 -3.01 117.00 114.68 2da6 n LEU 88 Ca 0.04 0.06 -0.11 0.00 -0.00 0.00 0.00 56.01 56.00 2da6 n LEU 88 Cb 0.18 -0.06 -0.13 0.00 -0.00 0.00 0.00 43.42 43.41 2da6 n LEU 88 CO 0.38 -0.01 -1.13 0.00 -0.00 0.00 0.00 177.39 176.64 2da6 n ALA 89 N -1.06 1.55 -0.15 1.47 0.00 -0.29 -4.30 120.51 117.73 2da6 n ALA 89 Ca 0.18 -1.12 -0.07 0.00 0.00 0.00 0.00 53.44 52.44 2da6 n ALA 89 Cb 0.11 -0.10 0.10 0.00 0.00 0.00 0.00 19.45 19.56 2da6 n ALA 89 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2da6 h MET 90 N 0.00 0.91 -0.04 0.00 2.86 -1.33 -3.08 114.93 114.24 2da6 h MET 90 Ca -0.49 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 56.88 2da6 h MET 90 Cb 2.01 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 33.58 2da6 h MET 90 CO -0.00 0.91 0.03 -0.44 1.06 0.00 0.00 176.91 178.47 2da6 h ASP 91 N 0.84 0.05 -4.37 1.22 5.19 -1.78 -3.48 116.42 114.10 2da6 h ASP 91 Ca 0.15 -0.01 -0.18 0.00 -0.62 0.00 0.00 57.03 56.37 2da6 h ASP 91 Cb 0.52 -0.01 0.11 0.00 0.18 0.00 0.00 39.33 40.13 2da6 h ASP 91 CO 0.03 0.04 -0.50 0.00 -3.12 0.00 0.00 179.24 175.69 2da6 n ALA 92 N -2.11 -1.48 -0.07 3.45 0.00 -1.17 -4.99 120.51 114.15 2da6 n ALA 92 Ca -0.06 0.02 -0.15 0.00 0.00 0.00 0.00 53.44 53.25 2da6 n ALA 92 Cb 0.03 -2.71 -0.05 0.00 0.00 0.00 0.00 19.45 16.72 2da6 n ALA 92 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2da6 n TYR 93 N -2.74 0.00 -4.08 0.00 4.11 -1.26 -5.04 117.16 108.15 2da6 n TYR 93 Ca -0.11 0.00 -0.28 0.00 -0.00 0.00 0.00 57.90 57.50 2da6 n TYR 93 Cb 0.59 -0.52 -0.06 0.00 -0.00 0.00 0.00 39.34 39.35 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 -6.35 5.41 -0.18 9.48 0.15 -1.26 -5.11 113.70 115.83 2da6 s SER 94 Ca -0.21 -0.10 -0.05 0.00 0.70 0.00 0.00 55.95 56.28 2da6 s SER 94 Cb 0.07 -1.40 0.09 0.00 -1.71 0.00 0.00 66.02 63.07 2da6 s SER 94 CO 0.28 0.13 0.33 -0.44 1.20 0.00 0.00 173.24 174.74 2da6 s SER 95 N -2.69 0.25 0.52 5.45 0.01 -1.26 -5.05 113.70 110.92 2da6 s SER 95 Ca 0.29 0.56 0.08 0.00 1.31 0.00 0.00 55.95 58.19 2da6 s SER 95 Cb -0.11 0.95 0.06 0.00 0.21 0.00 0.00 66.02 67.13 2da6 s SER 95 CO 0.22 -0.26 0.72 0.54 0.41 0.00 0.00 173.24 174.87 2da6 s ASN 96 N 2.50 5.28 -0.24 2.44 4.22 -1.26 -5.02 114.94 122.86 2da6 s ASN 96 Ca 0.03 -0.62 -0.28 0.00 -2.14 0.00 0.00 52.86 49.85 2da6 s ASN 96 Cb -0.13 -0.14 -0.04 0.00 1.28 0.00 0.00 41.25 42.22 2da6 s ASN 96 CO -0.12 -1.14 1.97 -0.94 -2.04 0.00 0.00 177.10 174.83 2da6 s SER 97 N -4.54 5.81 0.00 3.54 1.04 -1.26 -4.77 113.70 113.52 2da6 s SER 97 Ca 0.59 1.69 0.00 0.00 0.48 0.00 0.00 55.95 58.71 2da6 s SER 97 Cb -0.08 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.52 2da6 s SER 97 CO 0.37 -1.71 0.00 0.61 0.98 0.00 0.00 173.24 173.49 2da6 n GLY 98 N 5.41 -0.50 3.69 7.32 0.00 -1.26 -5.15 105.19 114.70 2da6 n GLY 98 Ca 0.25 -0.99 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 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 -1.76 0.72 0.10 1.61 0.04 -1.26 -5.04 135.00 129.42 2da6 s PRO 99 Ca 0.00 0.63 0.00 0.00 0.04 0.00 0.00 61.00 61.67 2da6 s PRO 99 Cb 0.00 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.78 2da6 s PRO 99 CO 0.00 -2.56 0.00 0.45 0.04 0.00 0.00 177.00 174.93 2da6 n SER 100 N -4.07 0.91 -4.52 6.66 2.88 -1.26 -4.97 113.62 109.25 2da6 n SER 100 Ca 0.06 0.15 -0.60 0.00 -1.33 0.00 0.00 58.87 57.15 2da6 n SER 100 Cb 0.56 -0.25 -0.08 0.00 -0.75 0.00 0.00 64.21 63.69 2da6 n SER 100 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2da6 n SER 101 N -3.40 0.21 0.00 -3.46 3.41 -1.26 -5.17 113.62 103.96 2da6 n SER 101 Ca 0.00 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.77 2da6 n SER 101 Cb 0.00 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 2da6 n SER 101 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49