#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2giw n ASP 2 N 0.00 1.78 0.00 1.61 -0.08 -1.26 -4.86 116.55 113.74 2giw n ASP 2 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2giw n ASP 2 Cb 0.00 1.33 0.00 0.00 2.34 0.00 0.00 41.12 44.79 2giw n ASP 2 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2giw n VAL 3 N -2.18 0.00 -0.01 5.18 0.31 -1.26 -4.43 118.33 115.94 2giw n VAL 3 Ca -0.10 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.11 2giw n VAL 3 Cb 0.58 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.44 2giw n VAL 3 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2giw h GLU 4 N 0.00 0.10 -0.60 5.55 4.39 -1.94 -0.05 114.58 122.03 2giw h GLU 4 Ca 0.00 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2giw h GLU 4 Cb 0.00 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 2giw h GLU 4 CO 0.00 0.31 0.33 0.87 -1.16 0.00 0.00 179.01 179.36 2giw h LYS 5 N -0.12 0.83 -0.38 2.33 1.57 -1.95 -1.36 116.57 117.49 2giw h LYS 5 Ca 0.02 -0.08 0.07 0.00 -1.87 0.00 0.00 60.65 58.79 2giw h LYS 5 Cb 0.25 -0.17 -0.09 0.00 0.08 0.00 0.00 32.23 32.31 2giw h LYS 5 CO 0.00 0.61 -0.40 0.78 -0.57 0.00 0.00 179.45 179.87 2giw h GLY 6 N 0.90 -0.50 1.33 3.86 0.00 -1.54 0.12 103.07 107.25 2giw h GLY 6 Ca 0.21 0.51 -0.06 0.00 0.00 0.00 0.00 47.33 48.00 2giw h GLY 6 CO -0.04 -0.19 0.10 0.07 0.00 0.00 0.00 176.54 176.48 2giw h LYS 7 N -0.32 0.83 -0.10 4.80 2.10 -0.22 0.85 116.57 124.51 2giw h LYS 7 Ca 0.14 -0.18 -0.07 0.00 -2.00 0.00 0.00 60.65 58.54 2giw h LYS 7 Cb 0.58 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 2giw h LYS 7 CO -0.55 0.77 -0.19 -0.22 -2.00 0.00 0.00 179.45 177.25 2giw h LYS 8 N 0.79 0.31 -0.32 0.07 1.63 -0.81 -0.83 116.57 117.41 2giw h LYS 8 Ca 0.17 -0.20 -0.13 0.00 -0.85 0.00 0.00 60.65 59.64 2giw h LYS 8 Cb 0.33 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.98 2giw h LYS 8 CO 0.00 0.79 -0.30 0.82 -3.45 0.00 0.00 179.45 177.31 2giw h ILE 9 N -0.13 1.29 -0.00 2.00 2.04 -0.64 -0.22 117.51 121.85 2giw h ILE 9 Ca 0.00 -1.47 0.01 0.00 1.00 0.00 0.00 64.86 64.41 2giw h ILE 9 Cb 0.77 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 2giw h ILE 9 CO 0.04 0.48 -0.21 0.15 0.00 0.00 0.00 178.15 178.61 2giw h PHE 10 N 0.54 -0.62 -0.83 1.37 3.04 -0.87 -2.54 116.94 117.04 2giw h PHE 10 Ca 0.05 0.02 0.16 0.00 3.98 0.00 0.00 57.97 62.18 2giw h PHE 10 Cb 0.88 0.27 -0.06 0.00 2.56 0.00 0.00 35.95 39.59 2giw h PHE 10 CO 0.07 -0.22 0.54 0.28 -2.02 0.00 0.00 178.31 176.96 2giw h VAL 11 N -0.26 0.79 -0.33 1.41 2.07 -0.87 0.62 116.25 119.69 2giw h VAL 11 Ca 0.00 -0.18 0.09 0.00 0.82 0.00 0.00 66.70 67.44 2giw h VAL 11 Cb 0.28 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 2giw h VAL 11 CO -0.14 0.09 0.24 -0.61 0.02 0.00 0.00 177.57 177.17 2giw h GLN 12 N 0.51 0.01 0.00 1.57 -0.00 -0.63 -3.31 115.11 113.26 2giw h GLN 12 Ca 0.41 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.06 2giw h GLN 12 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.34 2giw h GLN 12 CO -0.16 0.00 0.00 0.36 0.00 0.00 0.00 178.83 179.04 2giw n LYS 13 N -4.44 0.00 -0.07 1.69 0.00 0.24 -4.93 118.16 110.65 2giw n LYS 13 Ca 0.05 -0.16 -0.12 0.00 -0.00 0.00 0.00 58.31 58.08 2giw n LYS 13 Cb 0.41 -0.32 -0.05 0.00 -0.00 0.00 0.00 35.03 35.06 2giw n LYS 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2giw h ALA 15 N -0.27 2.14 -1.07 0.00 0.00 -1.64 0.82 119.26 119.24 2giw h ALA 15 Ca -0.31 -0.01 0.35 0.00 0.00 0.00 0.00 54.91 54.94 2giw h ALA 15 Cb 1.36 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.96 2giw h ALA 15 CO -0.14 -0.25 0.63 0.37 0.00 0.00 0.00 179.25 179.87 2giw h GLN 16 N 0.23 0.24 0.06 0.00 -0.00 -1.85 -1.87 115.11 111.91 2giw h GLN 16 Ca 0.21 -0.01 -0.37 0.00 -0.00 0.00 0.00 58.65 58.48 2giw h GLN 16 Cb 0.55 -0.05 -0.04 0.00 0.00 0.00 0.00 27.48 27.94 2giw h GLN 16 CO -0.04 0.16 -2.13 0.00 0.00 0.00 0.00 178.83 176.82 2giw s HIS 18 N -2.52 3.09 -1.31 0.00 3.76 -0.17 -4.03 115.29 114.11 2giw s HIS 18 Ca -0.29 -3.11 -0.09 0.00 -0.15 0.00 0.00 55.06 51.42 2giw s HIS 18 Cb 0.08 -2.56 -0.10 0.00 1.11 0.00 0.00 32.58 31.12 2giw s HIS 18 CO 0.67 -0.66 3.02 0.25 -0.85 0.00 0.00 174.74 177.17 2giw n THR 19 N 2.65 4.17 -1.57 1.30 -2.24 -1.20 -4.11 114.28 113.28 2giw n THR 19 Ca 0.13 -2.56 -0.42 0.00 -2.27 0.00 0.00 64.05 58.93 2giw n THR 19 Cb 0.34 -2.45 -0.02 0.00 -2.10 0.00 0.00 70.33 66.10 2giw n THR 19 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 2giw n VAL 20 N 3.18 2.86 0.20 2.28 3.14 -1.26 -3.64 118.33 125.10 2giw n VAL 20 Ca 0.71 -2.54 0.00 0.00 -2.96 0.00 0.00 64.34 59.55 2giw n VAL 20 Cb 0.35 -2.49 0.00 0.00 -1.06 0.00 0.00 33.84 30.64 2giw n VAL 20 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2giw n GLU 21 N 6.57 0.00 -0.95 1.45 1.02 -1.26 -4.99 120.64 122.48 2giw n GLU 21 Ca 0.51 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.35 2giw n GLU 21 Cb 0.40 0.00 0.24 0.00 -0.02 0.00 0.00 31.44 32.06 2giw n GLU 21 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2giw s LYS 22 N -2.00 -1.19 0.25 3.49 -2.85 -1.24 -4.88 119.74 111.32 2giw s LYS 22 Ca 0.00 0.13 0.05 0.00 -1.00 0.00 0.00 55.97 55.15 2giw s LYS 22 Cb 0.00 -1.58 0.69 0.00 -2.06 0.00 0.00 37.83 34.88 2giw s LYS 22 CO 0.00 -3.73 1.22 0.41 0.10 0.00 0.00 175.35 173.35 2giw n GLY 23 N -0.48 -0.96 0.00 0.59 0.00 -1.26 -4.81 105.19 98.27 2giw n GLY 23 Ca 0.11 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.86 2giw n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2giw n GLY 24 N -1.35 2.60 3.85 -0.02 0.00 -1.26 -5.11 105.19 103.91 2giw n GLY 24 Ca 0.21 -1.30 -0.04 0.00 0.00 0.00 0.00 46.02 44.88 2giw n GLY 24 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2giw s LYS 25 N -2.04 1.50 0.00 1.61 2.47 -1.26 -5.03 119.74 116.99 2giw s LYS 25 Ca 0.00 -0.95 0.00 0.00 -1.56 0.00 0.00 55.97 53.46 2giw s LYS 25 Cb 0.00 0.43 0.00 0.00 -1.46 0.00 0.00 37.83 36.80 2giw s LYS 25 CO 0.00 -0.70 0.00 0.72 0.16 0.00 0.00 175.35 175.53 2giw n HIS 26 N -0.64 -0.10 -0.80 4.03 8.25 -1.26 -1.46 115.22 123.25 2giw n HIS 26 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2giw n HIS 26 Cb 0.60 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.71 2giw n HIS 26 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2giw n LYS 27 N 0.00 0.00 -1.80 -0.41 5.02 -1.26 -4.74 118.16 114.97 2giw n LYS 27 Ca 0.00 0.36 -0.17 0.00 -2.02 0.00 0.00 58.31 56.48 2giw n LYS 27 Cb 0.00 -0.44 -0.05 0.00 -0.02 0.00 0.00 35.03 34.52 2giw n LYS 27 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2giw n THR 28 N 0.73 -0.30 0.00 -0.18 -1.04 -1.26 -4.83 114.28 107.40 2giw n THR 28 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2giw n THR 28 Cb 0.00 -1.99 0.00 0.00 -1.82 0.00 0.00 70.33 66.52 2giw n THR 28 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2giw n GLY 29 N -0.96 0.91 3.74 3.41 0.00 -1.26 -4.78 105.19 106.26 2giw n GLY 29 Ca -0.18 0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.91 2giw n GLY 29 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2giw s PRO 30 N -0.05 2.83 0.11 1.61 0.02 -1.26 -4.18 135.00 134.07 2giw s PRO 30 Ca 0.00 1.98 -0.31 0.00 0.02 0.00 0.00 61.00 62.69 2giw s PRO 30 Cb 0.00 -1.94 -0.10 0.00 0.02 0.00 0.00 34.50 32.47 2giw s PRO 30 CO 0.00 -1.36 1.86 0.54 -0.33 0.00 0.00 177.00 177.71 2giw s ASN 31 N -1.42 6.43 -0.81 2.53 4.22 -0.53 -4.75 114.94 120.60 2giw s ASN 31 Ca 0.79 2.74 -0.07 0.00 -2.14 0.00 0.00 52.86 54.18 2giw s ASN 31 Cb -0.35 -2.56 -0.15 0.00 1.28 0.00 0.00 41.25 39.48 2giw s ASN 31 CO 0.38 -1.01 2.94 0.18 -2.04 0.00 0.00 177.10 177.54 2giw n LEU 32 N 6.02 6.34 -4.60 3.54 4.77 -1.26 -4.88 117.00 126.93 2giw n LEU 32 Ca 0.18 -3.47 -0.43 0.00 -0.03 0.00 0.00 56.01 52.26 2giw n LEU 32 Cb 0.39 -1.34 -0.02 0.00 -2.33 0.00 0.00 43.42 40.11 2giw n LEU 32 CO 0.66 1.55 1.23 -1.00 -1.33 0.00 0.00 177.39 178.51 2giw s HIS 33 N 1.99 2.39 0.00 -1.77 3.76 -1.26 -4.39 115.29 116.00 2giw s HIS 33 Ca 0.60 0.65 0.00 0.00 -0.15 0.00 0.00 55.06 56.16 2giw s HIS 33 Cb 0.21 -4.33 0.00 0.00 1.11 0.00 0.00 32.58 29.57 2giw s HIS 33 CO -0.03 -1.95 0.00 0.41 -0.85 0.00 0.00 174.74 172.32 2giw n GLY 34 N 5.11 2.55 5.61 -2.22 0.00 -1.26 -4.99 105.19 109.98 2giw n GLY 34 Ca 0.16 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2giw n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2giw n LEU 35 N 0.00 0.00 -4.52 0.99 4.32 -1.26 -4.60 117.00 111.92 2giw n LEU 35 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 56.01 55.60 2giw n LEU 35 Cb 0.00 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 41.72 2giw n LEU 35 CO 0.00 0.00 2.09 0.49 -1.22 0.00 0.00 177.39 178.75 2giw n PHE 36 N 0.00 1.09 -0.07 -1.77 3.72 -0.94 -0.55 117.46 118.94 2giw n PHE 36 Ca 0.00 0.24 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 2giw n PHE 36 Cb 0.00 -2.52 0.00 0.00 -0.94 0.00 0.00 39.48 36.02 2giw n PHE 36 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2giw n GLY 37 N 6.26 0.85 3.35 1.37 0.00 -0.65 -5.02 105.19 111.34 2giw n GLY 37 Ca 0.49 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.15 2giw n GLY 37 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2giw s ARG 38 N -0.93 3.37 -0.57 1.61 0.52 0.29 -5.03 118.95 118.21 2giw s ARG 38 Ca 0.00 -0.64 -0.27 0.00 -0.52 0.00 0.00 55.73 54.30 2giw s ARG 38 Cb 0.00 -3.16 -0.03 0.00 0.52 0.00 0.00 34.95 32.28 2giw s ARG 38 CO 0.00 -0.25 1.95 0.15 0.02 0.00 0.00 175.30 177.17 2giw s LYS 39 N 1.51 2.59 1.28 3.54 1.02 -1.26 -3.66 119.74 124.75 2giw s LYS 39 Ca 0.05 0.82 -0.21 0.00 0.02 0.00 0.00 55.97 56.64 2giw s LYS 39 Cb -0.15 -4.41 0.32 0.00 -0.52 0.00 0.00 37.83 33.07 2giw s LYS 39 CO -0.00 -2.76 0.97 -2.37 -0.92 0.00 0.00 175.35 170.26 2giw n THR 40 N 7.37 0.00 -0.54 2.17 5.66 0.70 -4.50 114.28 125.14 2giw n THR 40 Ca 0.23 -0.29 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 2giw n THR 40 Cb 0.52 -1.12 0.00 0.00 -1.55 0.00 0.00 70.33 68.18 2giw n THR 40 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2giw n GLY 41 N -4.93 0.68 3.14 1.09 0.00 -1.26 -4.16 105.19 99.75 2giw n GLY 41 Ca 0.14 -0.45 0.04 0.00 0.00 0.00 0.00 46.02 45.75 2giw n GLY 41 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2giw s GLN 42 N -0.93 0.47 0.02 1.61 0.74 -1.26 -4.83 119.66 115.48 2giw s GLN 42 Ca 0.00 0.31 0.04 0.00 0.05 0.00 0.00 55.36 55.75 2giw s GLN 42 Cb 0.00 0.17 -0.02 0.00 1.10 0.00 0.00 33.01 34.27 2giw s GLN 42 CO 0.00 -0.84 -0.11 0.00 -0.55 0.00 0.00 175.29 173.79 2giw s ALA 43 N 2.68 0.91 0.59 1.58 0.00 -1.26 -5.07 121.76 121.19 2giw s ALA 43 Ca 0.15 -0.65 -0.17 0.00 0.00 0.00 0.00 51.96 51.29 2giw s ALA 43 Cb -0.06 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.88 2giw s ALA 43 CO -0.22 0.17 1.10 -1.25 0.00 0.00 0.00 175.76 175.56 2giw s PRO 44 N -0.87 3.17 0.00 0.00 0.04 -1.26 -4.02 135.00 132.06 2giw s PRO 44 Ca 0.00 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.47 2giw s PRO 44 Cb -0.07 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2giw s PRO 44 CO 0.01 -0.97 0.00 0.41 0.04 0.00 0.00 177.00 176.49 2giw n GLY 45 N -0.36 1.41 2.79 0.56 0.00 -1.26 -4.64 105.19 103.69 2giw n GLY 45 Ca 0.10 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2giw n GLY 45 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2giw s PHE 46 N 0.00 1.08 -0.24 1.61 5.36 -1.26 -5.01 117.98 119.52 2giw s PHE 46 Ca 0.00 -0.68 0.10 0.00 -0.96 0.00 0.00 56.93 55.39 2giw s PHE 46 Cb 0.00 -1.03 0.44 0.00 -0.34 0.00 0.00 43.02 42.09 2giw s PHE 46 CO 0.00 -0.52 1.21 -2.37 -1.46 0.00 0.00 175.22 172.08 2giw n THR 47 N 5.04 2.31 -4.21 0.12 5.66 -1.26 -4.55 114.28 117.39 2giw n THR 47 Ca -0.09 -3.59 0.00 0.00 -3.05 0.00 0.00 64.05 57.32 2giw n THR 47 Cb 0.48 -0.55 0.00 0.00 -1.55 0.00 0.00 70.33 68.71 2giw n THR 47 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 2giw n TYR 48 N -0.96 -0.81 -2.60 1.09 4.01 -1.26 -3.95 117.16 112.68 2giw n TYR 48 Ca 0.28 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.68 2giw n TYR 48 Cb 0.80 0.05 -0.04 0.00 -0.31 0.00 0.00 39.34 39.84 2giw n TYR 48 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2giw s THR 49 N 0.00 3.91 0.34 -0.72 -4.23 -1.26 -4.80 115.64 108.88 2giw s THR 49 Ca 0.00 1.22 0.16 0.00 -1.18 0.00 0.00 61.69 61.89 2giw s THR 49 Cb 0.00 -3.51 0.35 0.00 1.34 0.00 0.00 72.50 70.69 2giw s THR 49 CO 0.00 -0.23 1.53 -0.67 -0.54 0.00 0.00 174.62 174.71 2giw n ASP 50 N -0.79 0.23 -0.08 3.99 -0.08 -1.26 -0.37 116.55 118.20 2giw n ASP 50 Ca 0.08 1.62 0.00 0.00 -1.51 0.00 0.00 54.79 54.98 2giw n ASP 50 Cb 0.52 -0.74 0.29 0.00 2.34 0.00 0.00 41.12 43.53 2giw n ASP 50 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2giw h ALA 51 N 1.94 1.42 0.14 -1.67 0.00 -1.90 0.35 119.26 119.53 2giw h ALA 51 Ca 0.77 -0.13 -0.35 0.00 0.00 0.00 0.00 54.91 55.19 2giw h ALA 51 Cb 1.96 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 2giw h ALA 51 CO -0.78 0.44 -1.85 -0.97 0.00 0.00 0.00 179.25 176.09 2giw h ASN 52 N 0.70 0.46 -0.55 0.00 -0.00 -1.12 -3.33 115.58 111.75 2giw h ASN 52 Ca 0.17 -0.85 0.10 0.00 -0.00 0.00 0.00 56.30 55.72 2giw h ASN 52 Cb 0.14 -0.15 -0.08 0.00 -0.00 0.00 0.00 38.32 38.24 2giw h ASN 52 CO -0.02 1.74 0.09 0.50 -0.00 0.00 0.00 177.43 179.75 2giw h LYS 53 N 0.08 0.22 0.00 6.67 1.63 -0.48 -0.21 116.57 124.48 2giw h LYS 53 Ca -0.37 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.42 2giw h LYS 53 Cb 2.06 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 33.64 2giw h LYS 53 CO 0.13 0.14 0.00 -1.71 -3.45 0.00 0.00 179.45 174.56 2giw n ASN 54 N -5.14 0.00 -0.04 4.20 5.15 0.12 -4.11 115.26 115.44 2giw n ASN 54 Ca 0.07 0.39 -0.13 0.00 -0.60 0.00 0.00 54.58 54.30 2giw n ASN 54 Cb 0.28 -0.44 -0.08 0.00 -0.53 0.00 0.00 39.78 39.01 2giw n ASN 54 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 2giw h LYS 55 N 0.00 0.25 -5.80 1.20 1.63 -1.13 -3.48 116.57 109.24 2giw h LYS 55 Ca 0.00 -0.15 -0.35 0.00 -0.85 0.00 0.00 60.65 59.30 2giw h LYS 55 Cb 0.21 0.01 0.13 0.00 -0.60 0.00 0.00 32.23 31.99 2giw h LYS 55 CO 0.00 0.72 -0.81 0.41 -3.45 0.00 0.00 179.45 176.32 2giw n GLY 56 N 0.35 -0.47 3.92 5.01 0.00 -1.26 -5.04 105.19 107.71 2giw n GLY 56 Ca -0.07 0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 2giw n GLY 56 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2giw s ILE 57 N -3.47 1.55 -0.19 -0.61 -4.36 -1.26 -4.89 121.20 107.96 2giw s ILE 57 Ca 0.08 -1.47 0.16 0.00 -0.26 0.00 0.00 60.65 59.15 2giw s ILE 57 Cb -0.01 -2.02 0.52 0.00 1.25 0.00 0.00 42.46 42.20 2giw s ILE 57 CO 0.76 0.00 1.43 0.41 0.24 0.00 0.00 174.94 177.78 2giw n THR 58 N -1.83 2.32 -3.89 8.37 -1.04 -1.26 -0.21 114.28 116.74 2giw n THR 58 Ca -0.01 -1.99 -0.21 0.00 -2.04 0.00 0.00 64.05 59.80 2giw n THR 58 Cb 0.64 -0.27 0.01 0.00 -1.82 0.00 0.00 70.33 68.90 2giw n THR 58 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2giw n TRP 59 N -0.61 -0.60 -2.54 -1.42 7.02 -1.24 -1.64 117.44 116.41 2giw n TRP 59 Ca 0.23 0.02 -0.22 0.00 -1.02 0.00 0.00 57.50 56.51 2giw n TRP 59 Cb 0.91 -1.21 0.05 0.00 -2.42 0.00 0.00 31.31 28.64 2giw n TRP 59 CO 0.00 0.00 0.00 -1.59 -2.02 0.00 0.00 177.69 174.08 2giw s LYS 60 N -6.09 2.44 0.00 -0.99 -2.85 -1.26 -2.21 119.74 108.78 2giw s LYS 60 Ca 0.22 -0.68 0.00 0.00 -1.00 0.00 0.00 55.97 54.51 2giw s LYS 60 Cb -0.12 -2.41 0.00 0.00 -2.06 0.00 0.00 37.83 33.23 2giw s LYS 60 CO 0.43 -0.85 1.07 -0.85 0.10 0.00 0.00 175.35 175.25 2giw n GLU 61 N -2.48 0.62 0.11 1.78 0.28 -1.26 -1.63 120.64 118.06 2giw n GLU 61 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.08 2giw n GLU 61 Cb 0.60 -1.19 0.00 0.00 1.43 0.00 0.00 31.44 32.28 2giw n GLU 61 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2giw n GLU 62 N 1.43 0.00 -0.26 3.44 1.02 -1.26 -4.69 120.64 120.32 2giw n GLU 62 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 2giw n GLU 62 Cb 0.31 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.78 2giw n GLU 62 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 2giw h THR 63 N 0.00 1.20 -0.68 2.62 1.35 -1.84 -1.88 112.91 113.68 2giw h THR 63 Ca 0.00 -0.45 0.01 0.00 -0.55 0.00 0.00 66.41 65.42 2giw h THR 63 Cb 0.00 0.21 -0.03 0.00 -1.73 0.00 0.00 68.15 66.60 2giw h THR 63 CO 0.00 0.21 0.45 -0.07 -0.25 0.00 0.00 175.52 175.86 2giw h LEU 64 N 0.98 0.78 -1.08 3.87 4.07 -1.63 -0.50 115.31 121.80 2giw h LEU 64 Ca 0.26 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.18 2giw h LEU 64 Cb -0.03 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 41.48 2giw h LEU 64 CO -0.05 0.57 0.38 0.24 -1.08 0.00 0.00 178.44 178.50 2giw h MET 65 N 0.92 1.03 -0.07 1.13 2.86 -1.64 -0.30 114.93 118.86 2giw h MET 65 Ca 0.25 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.68 2giw h MET 65 Cb -0.10 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.36 2giw h MET 65 CO -0.05 0.77 -0.29 1.49 1.06 0.00 0.00 176.91 179.89 2giw h GLU 66 N 1.03 0.31 0.69 1.72 4.81 -1.01 -2.84 114.58 119.29 2giw h GLU 66 Ca 0.26 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 2giw h GLU 66 Cb 0.06 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 2giw h GLU 66 CO -0.04 0.89 -0.46 -0.92 -0.73 0.00 0.00 179.01 177.75 2giw h TYR 67 N -0.19 -1.22 -0.37 0.92 3.20 -0.94 -1.27 116.97 117.10 2giw h TYR 67 Ca -0.02 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 2giw h TYR 67 Cb 0.94 0.44 -0.02 0.00 1.54 0.00 0.00 36.73 39.63 2giw h TYR 67 CO 0.13 -0.67 0.22 -0.07 -1.64 0.00 0.00 178.16 176.13 2giw h LEU 68 N -1.09 0.44 0.49 2.82 -0.00 -1.18 0.46 115.31 117.25 2giw h LEU 68 Ca -0.09 -0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 57.75 2giw h LEU 68 Cb 0.89 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.44 2giw h LEU 68 CO 0.07 0.34 -0.24 -0.08 -0.00 0.00 0.00 178.44 178.53 2giw h GLU 69 N 0.51 -0.64 -1.93 1.13 4.81 -1.32 -3.42 114.58 113.73 2giw h GLU 69 Ca 0.14 0.04 -0.52 0.00 -0.13 0.00 0.00 59.36 58.89 2giw h GLU 69 Cb -0.02 0.14 -0.39 0.00 0.63 0.00 0.00 28.75 29.12 2giw h GLU 69 CO -0.03 -0.42 -1.12 -1.71 -0.73 0.00 0.00 179.01 175.01 2giw n ASN 70 N -5.37 0.31 -0.14 1.04 4.05 -0.49 -4.65 115.26 110.01 2giw n ASN 70 Ca -0.12 -2.83 -0.10 0.00 0.45 0.00 0.00 54.58 51.98 2giw n ASN 70 Cb 0.28 -0.55 -0.01 0.00 1.23 0.00 0.00 39.78 40.73 2giw n ASN 70 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2giw h PRO 71 N 3.62 0.69 0.00 1.20 0.13 -1.17 0.52 132.00 136.99 2giw h PRO 71 Ca 0.07 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 2giw h PRO 71 Cb 0.92 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2giw h PRO 71 CO 0.47 0.74 0.00 0.87 -0.23 0.00 0.00 178.00 179.84 2giw h LYS 72 N 0.54 0.00 0.00 0.86 6.56 -1.83 -0.91 116.57 121.79 2giw h LYS 72 Ca 0.12 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.47 2giw h LYS 72 Cb 0.38 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.01 2giw h LYS 72 CO 0.01 0.00 -1.41 1.17 -2.06 0.00 0.00 179.45 177.16 2giw n LYS 73 N -2.67 0.55 -0.22 3.15 0.00 -0.01 -3.99 118.16 114.99 2giw n LYS 73 Ca -0.01 0.50 0.02 0.00 0.00 0.00 0.00 58.31 58.82 2giw n LYS 73 Cb 0.12 -1.68 0.13 0.00 0.00 0.00 0.00 35.03 33.60 2giw n LYS 73 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 2giw h TYR 74 N -1.00 0.15 -3.73 5.64 3.20 -0.94 -3.35 116.97 116.94 2giw h TYR 74 Ca -0.37 0.04 -0.68 0.00 3.14 0.00 0.00 58.73 60.87 2giw h TYR 74 Cb 1.26 0.04 -0.34 0.00 1.54 0.00 0.00 36.73 39.23 2giw h TYR 74 CO 0.01 -0.09 -0.74 0.42 -1.64 0.00 0.00 178.16 176.11 2giw s ILE 75 N -6.10 2.71 -1.18 1.81 1.01 -0.36 -5.05 121.20 114.04 2giw s ILE 75 Ca -0.13 -1.37 -0.19 0.00 0.00 0.00 0.00 60.65 58.96 2giw s ILE 75 Cb 0.19 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 2giw s ILE 75 CO 0.74 -0.01 1.98 -0.81 0.00 0.00 0.00 174.94 176.84 2giw n PRO 76 N 4.58 2.34 0.00 2.79 -0.04 -1.26 -3.19 135.00 140.22 2giw n PRO 76 Ca -0.14 -2.53 0.00 0.00 -0.04 0.00 0.00 63.50 60.78 2giw n PRO 76 Cb 0.44 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.58 2giw n PRO 76 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2giw n GLY 77 N 4.83 0.74 3.78 0.55 0.00 -1.26 -4.90 105.19 108.94 2giw n GLY 77 Ca 0.49 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.18 2giw n GLY 77 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2giw s THR 78 N -0.68 3.48 -0.35 2.61 -1.32 -1.19 -4.69 115.64 113.49 2giw s THR 78 Ca 0.00 0.73 0.09 0.00 -1.21 0.00 0.00 61.69 61.31 2giw s THR 78 Cb 0.00 -3.25 0.68 0.00 -1.51 0.00 0.00 72.50 68.42 2giw s THR 78 CO 0.00 -0.38 1.69 1.17 -2.21 0.00 0.00 174.62 174.89 2giw n LYS 79 N -2.04 3.62 0.13 7.08 4.81 -1.26 -4.57 118.16 125.94 2giw n LYS 79 Ca 0.10 -2.77 -0.02 0.00 -0.87 0.00 0.00 58.31 54.76 2giw n LYS 79 Cb 0.52 -2.14 0.16 0.00 0.02 0.00 0.00 35.03 33.59 2giw n LYS 79 CO 0.00 0.00 0.00 1.98 1.17 0.00 0.00 177.40 180.55 2giw h MET 80 N 2.59 0.00 -6.24 1.64 4.05 -1.93 -3.49 114.93 111.56 2giw h MET 80 Ca 0.21 -0.00 -0.39 0.00 -0.28 0.00 0.00 59.70 59.24 2giw h MET 80 Cb 2.14 0.00 0.05 0.00 -0.80 0.00 0.00 31.60 32.99 2giw h MET 80 CO 0.64 0.63 -0.83 -0.89 0.23 0.00 0.00 176.91 176.70 2giw n ILE 81 N -3.79 -5.87 -3.85 1.77 2.08 -1.26 -5.01 119.36 103.42 2giw n ILE 81 Ca -0.01 -0.64 -0.11 0.00 0.56 0.00 0.00 62.75 62.55 2giw n ILE 81 Cb 0.63 -4.36 -0.09 0.00 -0.75 0.00 0.00 39.64 35.07 2giw n ILE 81 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 2giw s PHE 82 N -3.30 0.05 -0.39 1.39 5.36 -1.26 -5.09 117.98 114.75 2giw s PHE 82 Ca 0.31 -0.23 0.06 0.00 -0.96 0.00 0.00 56.93 56.11 2giw s PHE 82 Cb -0.12 -0.04 0.29 0.00 -0.34 0.00 0.00 43.02 42.82 2giw s PHE 82 CO 0.86 -0.39 1.24 0.00 -1.46 0.00 0.00 175.22 175.47 2giw n ALA 83 N 0.90 -0.52 0.00 11.12 0.00 -1.26 -4.65 120.51 126.10 2giw n ALA 83 Ca -0.20 -1.04 0.00 0.00 0.00 0.00 0.00 53.44 52.20 2giw n ALA 83 Cb 0.58 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2giw n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2giw n GLY 84 N -0.24 2.01 0.13 0.00 0.00 -1.26 -5.08 105.19 100.75 2giw n GLY 84 Ca -0.07 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2giw n GLY 84 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2giw n ILE 85 N 0.57 0.00 0.00 -0.61 3.06 -1.26 -5.09 119.36 116.03 2giw n ILE 85 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 2giw n ILE 85 Cb 0.00 -0.01 0.00 0.00 0.54 0.00 0.00 39.64 40.17 2giw n ILE 85 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22 2giw n LYS 86 N -1.56 0.00 0.23 9.51 4.81 -1.26 -5.10 118.16 124.78 2giw n LYS 86 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2giw n LYS 86 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2giw n LYS 86 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2giw n LYS 87 N -0.98 0.00 0.00 1.64 3.00 -1.26 -5.05 118.16 115.51 2giw n LYS 87 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2giw n LYS 87 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 2giw n LYS 87 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2giw n LYS 88 N -3.45 0.00 -0.32 1.64 0.00 -1.26 -4.95 118.16 109.82 2giw n LYS 88 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 58.31 58.46 2giw n LYS 88 Cb 0.00 -0.05 0.34 0.00 0.00 0.00 0.00 35.03 35.32 2giw n LYS 88 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2giw h THR 89 N 0.00 0.49 -1.00 3.15 2.02 -2.01 0.32 112.91 115.89 2giw h THR 89 Ca 0.00 -0.16 0.19 0.00 0.77 0.00 0.00 66.41 67.21 2giw h THR 89 Cb 0.00 -0.01 -0.18 0.00 -1.74 0.00 0.00 68.15 66.22 2giw h THR 89 CO 0.00 0.08 -0.28 -1.84 0.37 0.00 0.00 175.52 173.86 2giw n GLU 90 N -4.99 -0.12 0.24 6.66 -0.00 -1.26 -0.33 120.64 120.85 2giw n GLU 90 Ca 0.24 1.55 0.18 0.00 -0.00 0.00 0.00 57.16 59.13 2giw n GLU 90 Cb 0.69 -2.32 0.89 0.00 -0.00 0.00 0.00 31.44 30.70 2giw n GLU 90 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2giw h ARG 91 N 0.00 0.00 0.00 3.44 2.43 -0.74 0.45 114.38 119.96 2giw h ARG 91 Ca 0.45 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.45 2giw h ARG 91 Cb 0.70 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.23 2giw h ARG 91 CO -1.02 0.00 -1.12 -1.91 -1.51 0.00 0.00 179.97 174.41 2giw n GLU 92 N -3.62 0.53 0.28 0.20 4.07 0.05 -4.22 120.64 117.92 2giw n GLU 92 Ca 0.00 0.53 -0.16 0.00 -0.06 0.00 0.00 57.16 57.47 2giw n GLU 92 Cb 0.28 -1.71 -0.08 0.00 -0.06 0.00 0.00 31.44 29.87 2giw n GLU 92 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 2giw h ASP 93 N -1.00 -0.75 -0.30 4.31 1.82 0.27 -0.78 116.42 119.99 2giw h ASP 93 Ca -0.26 0.05 0.07 0.00 -0.39 0.00 0.00 57.03 56.49 2giw h ASP 93 Cb 1.08 0.22 -0.07 0.00 0.68 0.00 0.00 39.33 41.24 2giw h ASP 93 CO -0.16 -0.47 -0.14 -0.07 -1.61 0.00 0.00 179.24 176.79 2giw h LEU 94 N -0.74 -0.49 -0.23 2.28 -0.00 -1.20 0.12 115.31 115.06 2giw h LEU 94 Ca -0.05 0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 2giw h LEU 94 Cb 0.61 0.27 0.00 0.00 -0.00 0.00 0.00 40.66 41.54 2giw h LEU 94 CO 0.05 -0.18 0.00 -0.38 -0.00 0.00 0.00 178.44 177.93 2giw n ILE 95 N -5.32 1.05 -0.07 1.22 2.08 -1.08 -0.94 119.36 116.29 2giw n ILE 95 Ca 0.00 0.28 -0.18 0.00 0.56 0.00 0.00 62.75 63.42 2giw n ILE 95 Cb 0.23 -1.11 -0.13 0.00 -0.75 0.00 0.00 39.64 37.88 2giw n ILE 95 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2giw n ALA 96 N -1.58 1.24 0.30 -1.39 0.00 0.04 -3.29 120.51 115.83 2giw n ALA 96 Ca 0.03 -0.91 -0.17 0.00 0.00 0.00 0.00 53.44 52.38 2giw n ALA 96 Cb 0.17 -0.38 -0.09 0.00 0.00 0.00 0.00 19.45 19.15 2giw n ALA 96 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2giw h TYR 97 N 0.03 -1.12 -0.02 0.00 3.20 -0.43 -3.01 116.97 115.61 2giw h TYR 97 Ca -0.50 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.38 2giw h TYR 97 Cb 1.99 0.42 -0.00 0.00 1.54 0.00 0.00 36.73 40.68 2giw h TYR 97 CO 0.04 -0.59 0.02 -0.07 -1.64 0.00 0.00 178.16 175.92 2giw h LEU 98 N -0.92 0.00 -2.27 2.82 3.38 -1.19 0.24 115.31 117.38 2giw h LEU 98 Ca -0.06 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2giw h LEU 98 Cb 0.78 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 2giw h LEU 98 CO -0.01 0.00 0.05 0.50 0.09 0.00 0.00 178.44 179.07 2giw h LYS 99 N 0.00 0.00 0.00 1.13 3.64 -1.51 -1.96 116.57 117.86 2giw h LYS 99 Ca 0.01 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.21 2giw h LYS 99 Cb 0.04 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 2giw h LYS 99 CO -0.00 0.00 -1.91 0.36 -2.27 0.00 0.00 179.45 175.63 2giw n LYS 100 N -4.08 1.28 -0.27 1.90 2.85 0.33 -4.58 118.16 115.60 2giw n LYS 100 Ca -0.02 -0.05 0.02 0.00 -1.05 0.00 0.00 58.31 57.21 2giw n LYS 100 Cb 0.15 -1.37 0.15 0.00 -0.65 0.00 0.00 35.03 33.31 2giw n LYS 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2giw h ALA 101 N 0.93 1.09 0.00 0.58 0.00 0.06 0.57 119.26 122.49 2giw h ALA 101 Ca -0.27 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2giw h ALA 101 Cb 1.53 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.22 2giw h ALA 101 CO 0.01 0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.56 2giw n THR 102 N -4.79 1.38 -2.69 0.00 -2.24 -0.85 -2.61 114.28 102.48 2giw n THR 102 Ca 0.12 0.52 -0.00 0.00 -2.27 0.00 0.00 64.05 62.42 2giw n THR 102 Cb 0.27 -1.49 0.05 0.00 -2.10 0.00 0.00 70.33 67.07 2giw n THR 102 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2giw n ASN 103 N -1.87 0.64 -0.14 3.42 4.05 0.42 -4.44 115.26 117.32 2giw n ASN 103 Ca 0.00 -2.06 0.15 0.00 0.45 0.00 0.00 54.58 53.13 2giw n ASN 103 Cb 0.06 -0.14 0.82 0.00 1.23 0.00 0.00 39.78 41.75 2giw n ASN 103 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59