#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 0.00 0.04 1.61 8.00 -1.24 -4.80 116.55 120.16 2giw n ASP 2 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2giw n ASP 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2giw n ASP 2 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2giw n VAL 3 N 0.00 0.00 -0.09 2.53 3.14 -1.26 -4.63 118.33 118.02 2giw n VAL 3 Ca 0.00 0.00 -0.12 0.00 -2.96 0.00 0.00 64.34 61.26 2giw n VAL 3 Cb 0.00 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 32.74 2giw n VAL 3 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2giw h GLU 4 N 0.00 0.56 -0.55 1.45 4.39 -1.95 -1.02 114.58 117.45 2giw h GLU 4 Ca 0.00 -0.25 0.08 0.00 0.34 0.00 0.00 59.36 59.54 2giw h GLU 4 Cb 0.00 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.57 2giw h GLU 4 CO 0.00 0.81 0.19 0.87 -1.16 0.00 0.00 179.01 179.72 2giw h LYS 5 N 0.29 0.35 -0.31 2.33 1.57 -1.94 -1.95 116.57 116.91 2giw h LYS 5 Ca 0.06 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 2giw h LYS 5 Cb 0.65 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.80 2giw h LYS 5 CO 0.04 0.23 -0.27 0.78 -0.57 0.00 0.00 179.45 179.66 2giw h GLY 6 N 0.36 -0.18 1.84 3.86 0.00 -1.51 0.03 103.07 107.47 2giw h GLY 6 Ca 0.27 0.34 -0.04 0.00 0.00 0.00 0.00 47.33 47.91 2giw h GLY 6 CO -0.29 -0.21 -0.10 0.07 0.00 0.00 0.00 176.54 176.02 2giw h LYS 7 N -0.25 0.20 0.27 4.80 2.10 -0.78 0.66 116.57 123.57 2giw h LYS 7 Ca 0.16 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.75 2giw h LYS 7 Cb 0.49 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.80 2giw h LYS 7 CO -0.45 0.31 -0.13 0.87 -2.00 0.00 0.00 179.45 178.05 2giw h LYS 8 N 0.19 -0.34 -0.33 0.07 1.79 -0.45 -1.70 116.57 115.80 2giw h LYS 8 Ca 0.04 0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.48 2giw h LYS 8 Cb 0.30 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.01 2giw h LYS 8 CO 0.02 0.01 0.01 0.82 -1.08 0.00 0.00 179.45 179.22 2giw h ILE 9 N -0.81 1.26 -0.13 1.86 5.03 -0.83 -0.06 117.51 123.83 2giw h ILE 9 Ca -0.04 -0.94 0.02 0.00 -0.12 0.00 0.00 64.86 63.78 2giw h ILE 9 Cb 0.51 1.21 -0.03 0.00 -3.03 0.00 0.00 36.82 35.48 2giw h ILE 9 CO 0.06 0.31 -0.23 0.15 -0.68 0.00 0.00 178.15 177.76 2giw h PHE 10 N 0.39 -0.69 -0.98 1.37 3.57 -0.96 -2.04 116.94 117.60 2giw h PHE 10 Ca 0.10 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.77 2giw h PHE 10 Cb 0.43 0.32 -0.09 0.00 2.79 0.00 0.00 35.95 39.40 2giw h PHE 10 CO 0.03 -0.21 0.60 0.28 -2.23 0.00 0.00 178.31 176.79 2giw h VAL 11 N -0.19 0.84 -0.64 1.41 2.07 -1.01 0.69 116.25 119.42 2giw h VAL 11 Ca 0.02 -0.31 0.12 0.00 0.82 0.00 0.00 66.70 67.36 2giw h VAL 11 Cb 0.26 -0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 29.87 2giw h VAL 11 CO -0.22 0.16 0.44 -0.61 0.02 0.00 0.00 177.57 177.36 2giw h GLN 12 N 0.89 0.34 0.00 1.57 4.15 -0.34 -3.20 115.11 118.52 2giw h GLN 12 Ca 0.51 -0.02 -0.16 0.00 0.77 0.00 0.00 58.65 59.76 2giw h GLN 12 Cb 0.61 -0.08 -0.30 0.00 0.21 0.00 0.00 27.48 27.93 2giw h GLN 12 CO -0.31 0.23 -0.80 0.36 -1.93 0.00 0.00 178.83 176.39 2giw n LYS 13 N -4.46 0.00 0.00 1.69 -0.00 0.22 -4.91 118.16 110.71 2giw n LYS 13 Ca 0.11 -1.65 0.00 0.00 -0.00 0.00 0.00 58.31 56.77 2giw n LYS 13 Cb 0.46 0.11 0.00 0.00 -0.00 0.00 0.00 35.03 35.60 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 0.00 2.49 -1.13 0.00 0.00 -1.54 0.45 119.26 119.53 2giw h ALA 15 Ca 0.00 -0.02 0.43 0.00 0.00 0.00 0.00 54.91 55.33 2giw h ALA 15 Cb 0.08 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 17.73 2giw h ALA 15 CO 0.00 -0.68 0.66 -0.56 0.00 0.00 0.00 179.25 178.67 2giw h GLN 16 N 0.08 0.02 0.00 0.00 3.07 -1.90 -1.88 115.11 114.50 2giw h GLN 16 Ca 0.31 -0.00 -0.24 0.00 0.09 0.00 0.00 58.65 58.81 2giw h GLN 16 Cb 1.12 -0.01 -0.04 0.00 0.08 0.00 0.00 27.48 28.63 2giw h GLN 16 CO -0.03 0.02 -1.90 0.00 0.09 0.00 0.00 178.83 177.01 2giw s HIS 18 N -2.32 2.89 -1.39 0.00 3.76 -0.16 -3.04 115.29 115.03 2giw s HIS 18 Ca -0.08 -3.03 -0.09 0.00 -0.15 0.00 0.00 55.06 51.71 2giw s HIS 18 Cb 0.04 -2.31 -0.10 0.00 1.11 0.00 0.00 32.58 31.32 2giw s HIS 18 CO 0.52 -0.65 3.02 0.25 -0.85 0.00 0.00 174.74 177.04 2giw n THR 19 N 2.47 4.20 -1.49 1.30 -2.24 -1.22 -4.06 114.28 113.23 2giw n THR 19 Ca 0.18 -2.53 -0.42 0.00 -2.27 0.00 0.00 64.05 59.01 2giw n THR 19 Cb 0.37 -2.50 -0.03 0.00 -2.10 0.00 0.00 70.33 66.06 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 3.32 2.56 -2.16 2.28 3.14 -1.26 -3.67 118.33 122.54 2giw n VAL 20 Ca 0.73 -2.28 -0.04 0.00 -2.96 0.00 0.00 64.34 59.79 2giw n VAL 20 Cb 0.32 -2.43 -0.04 0.00 -1.06 0.00 0.00 33.84 30.64 2giw n VAL 20 CO 0.00 0.00 0.00 -1.84 -6.46 0.00 0.00 176.83 168.53 2giw n GLU 21 N 6.79 0.11 -0.22 1.45 0.28 -1.26 -4.98 120.64 122.80 2giw n GLU 21 Ca 0.50 -1.27 0.03 0.00 -0.16 0.00 0.00 57.16 56.27 2giw n GLU 21 Cb 0.40 0.36 -0.01 0.00 1.43 0.00 0.00 31.44 33.62 2giw n GLU 21 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2giw n LYS 22 N 0.01 -0.45 0.00 3.44 5.02 -1.24 -4.93 118.16 120.01 2giw n LYS 22 Ca -0.20 0.30 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 2giw n LYS 22 Cb 0.81 -0.55 0.00 0.00 -0.02 0.00 0.00 35.03 35.27 2giw n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2giw n GLY 23 N -0.67 1.97 3.06 0.72 0.00 -1.26 -4.85 105.19 104.16 2giw n GLY 23 Ca 0.00 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 2giw n GLY 23 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2giw s GLY 24 N 0.00 0.38 0.19 -0.02 0.00 -1.26 -5.17 107.32 101.43 2giw s GLY 24 Ca 0.00 -0.97 -0.01 0.00 0.00 0.00 0.00 44.72 43.74 2giw s GLY 24 CO 0.00 -1.07 0.10 -1.59 0.00 0.00 0.00 173.10 170.54 2giw s LYS 25 N -3.09 1.15 3.26 2.90 0.00 -1.26 -4.59 119.74 118.10 2giw s LYS 25 Ca -0.01 -1.59 0.00 0.00 0.00 0.00 0.00 55.97 54.37 2giw s LYS 25 Cb 0.02 0.18 0.00 0.00 0.00 0.00 0.00 37.83 38.03 2giw s LYS 25 CO -0.07 -0.33 0.00 0.72 0.00 0.00 0.00 175.35 175.67 2giw n HIS 26 N -0.24 -0.67 -1.16 1.78 8.25 -1.20 -4.88 115.22 117.09 2giw n HIS 26 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2giw n HIS 26 Cb 0.65 0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.93 2giw n HIS 26 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2giw n LYS 27 N 0.00 0.00 -1.06 -0.41 4.81 -1.26 -4.21 118.16 116.03 2giw n LYS 27 Ca 0.00 0.23 -0.02 0.00 -0.87 0.00 0.00 58.31 57.65 2giw n LYS 27 Cb 0.00 -1.16 -0.01 0.00 0.02 0.00 0.00 35.03 33.89 2giw n LYS 27 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2giw n THR 28 N -0.93 0.00 -3.41 3.15 -1.04 -1.26 -4.73 114.28 106.06 2giw n THR 28 Ca 0.00 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.03 2giw n THR 28 Cb 0.39 -0.47 -0.05 0.00 -1.82 0.00 0.00 70.33 68.37 2giw n THR 28 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2giw s GLY 29 N -2.46 0.18 0.25 3.41 0.00 -1.17 -4.86 107.32 102.68 2giw s GLY 29 Ca 0.00 3.45 -0.31 0.00 0.00 0.00 0.00 44.72 47.87 2giw s GLY 29 CO 0.00 3.11 1.59 2.56 0.00 0.00 0.00 173.10 180.36 2giw s PRO 30 N 1.86 4.16 -0.18 2.90 0.04 -1.26 -3.27 135.00 139.24 2giw s PRO 30 Ca -0.03 2.51 -0.37 0.00 0.04 0.00 0.00 61.00 63.14 2giw s PRO 30 Cb -0.03 -3.06 -0.14 0.00 0.04 0.00 0.00 34.50 31.31 2giw s PRO 30 CO -0.15 -0.62 1.82 0.27 0.04 0.00 0.00 177.00 178.36 2giw n ASN 31 N 2.79 2.94 -1.90 6.66 6.94 -1.26 -4.80 115.26 126.63 2giw n ASN 31 Ca 0.10 1.02 -0.08 0.00 -0.02 0.00 0.00 54.58 55.60 2giw n ASN 31 Cb 0.38 -1.26 -0.11 0.00 -2.36 0.00 0.00 39.78 36.42 2giw n ASN 31 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2giw n LEU 32 N 6.06 4.88 -4.50 -4.53 4.77 -1.26 -4.84 117.00 117.57 2giw n LEU 32 Ca 0.25 -2.78 -0.42 0.00 -0.03 0.00 0.00 56.01 53.03 2giw n LEU 32 Cb 0.21 -1.24 -0.03 0.00 -2.33 0.00 0.00 43.42 40.03 2giw n LEU 32 CO 0.77 1.37 1.16 -2.28 -1.33 0.00 0.00 177.39 177.08 2giw s HIS 33 N 0.88 2.73 0.00 -1.77 2.46 -1.26 -3.96 115.29 114.36 2giw s HIS 33 Ca 0.45 -0.90 0.00 0.00 0.47 0.00 0.00 55.06 55.08 2giw s HIS 33 Cb 0.22 -4.48 0.00 0.00 -0.13 0.00 0.00 32.58 28.18 2giw s HIS 33 CO 0.00 -1.75 0.00 0.41 -2.47 0.00 0.00 174.74 170.93 2giw n GLY 34 N 5.98 2.25 5.31 1.59 0.00 -1.26 -5.02 105.19 114.04 2giw n GLY 34 Ca 0.21 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2giw n GLY 34 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2giw n LEU 35 N 0.00 0.00 -4.64 0.99 0.00 -1.25 -4.19 117.00 107.91 2giw n LEU 35 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 56.01 55.59 2giw n LEU 35 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 43.42 43.39 2giw n LEU 35 CO 0.00 0.00 1.64 -0.36 0.00 0.00 0.00 177.39 178.67 2giw s PHE 36 N 0.00 1.37 0.00 1.96 0.08 -1.23 -0.78 117.98 119.38 2giw s PHE 36 Ca 0.00 -0.04 0.00 0.00 0.12 0.00 0.00 56.93 57.01 2giw s PHE 36 Cb 0.00 -4.11 0.00 0.00 -0.57 0.00 0.00 43.02 38.34 2giw s PHE 36 CO 0.00 -4.79 0.00 0.41 -0.10 0.00 0.00 175.22 170.74 2giw n GLY 37 N 4.88 1.99 3.59 4.36 0.00 -0.88 -5.01 105.19 114.12 2giw n GLY 37 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 2giw n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2giw s ARG 38 N -0.59 3.34 -0.48 1.61 6.06 0.04 -4.91 118.95 124.02 2giw s ARG 38 Ca 0.00 1.06 -0.31 0.00 -2.50 0.00 0.00 55.73 53.98 2giw s ARG 38 Cb 0.00 -4.15 -0.11 0.00 0.06 0.00 0.00 34.95 30.75 2giw s ARG 38 CO 0.00 -1.86 2.34 1.63 -2.50 0.00 0.00 175.30 174.91 2giw n LYS 39 N 8.41 0.96 -0.99 5.12 4.01 -1.26 -3.31 118.16 131.10 2giw n LYS 39 Ca 0.19 0.18 -0.30 0.00 -0.51 0.00 0.00 58.31 57.88 2giw n LYS 39 Cb 0.48 -2.63 0.16 0.00 -0.51 0.00 0.00 35.03 32.53 2giw n LYS 39 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2giw s THR 40 N 9.02 2.45 0.00 -0.18 2.01 0.20 -4.20 115.64 124.94 2giw s THR 40 Ca 1.10 0.15 0.00 0.00 0.31 0.00 0.00 61.69 63.25 2giw s THR 40 Cb -0.70 -2.46 0.00 0.00 0.01 0.00 0.00 72.50 69.35 2giw s THR 40 CO 0.42 -0.19 0.00 0.61 -0.69 0.00 0.00 174.62 174.77 2giw n GLY 41 N -0.52 0.74 2.94 4.40 0.00 -1.26 -4.41 105.19 107.09 2giw n GLY 41 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.64 0.85 -0.25 1.61 0.74 -1.26 -4.77 119.66 115.94 2giw s GLN 42 Ca 0.00 -0.72 -0.20 0.00 0.05 0.00 0.00 55.36 54.48 2giw s GLN 42 Cb 0.00 -0.23 -0.02 0.00 1.10 0.00 0.00 33.01 33.86 2giw s GLN 42 CO 0.00 -1.24 0.62 0.00 -0.55 0.00 0.00 175.29 174.12 2giw s ALA 43 N 1.39 3.61 -1.06 1.58 0.00 -1.26 -5.01 121.76 121.00 2giw s ALA 43 Ca 0.21 -0.43 -0.22 0.00 0.00 0.00 0.00 51.96 51.52 2giw s ALA 43 Cb -0.05 -3.02 0.04 0.00 0.00 0.00 0.00 23.12 20.08 2giw s ALA 43 CO -0.06 -0.78 1.59 -1.25 0.00 0.00 0.00 175.76 175.25 2giw s PRO 44 N 2.44 3.50 0.00 0.00 0.04 -1.26 -4.07 135.00 135.65 2giw s PRO 44 Ca 0.26 -1.19 0.00 0.00 0.04 0.00 0.00 61.00 60.12 2giw s PRO 44 Cb -0.16 -5.35 0.00 0.00 0.04 0.00 0.00 34.50 29.03 2giw s PRO 44 CO 0.09 -2.43 0.00 0.41 0.04 0.00 0.00 177.00 175.10 2giw n GLY 45 N 6.56 1.48 3.24 0.56 0.00 -1.26 -5.07 105.19 110.69 2giw n GLY 45 Ca 0.37 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 46.02 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 1.90 0.10 1.61 2.19 -1.26 -5.15 117.98 117.37 2giw s PHE 46 Ca 0.00 -0.36 0.01 0.00 0.33 0.00 0.00 56.93 56.90 2giw s PHE 46 Cb 0.00 -1.20 -0.00 0.00 -1.31 0.00 0.00 43.02 40.51 2giw s PHE 46 CO 0.00 0.00 0.03 -2.37 1.83 0.00 0.00 175.22 174.71 2giw n THR 47 N 2.37 0.00 -4.15 0.12 5.66 -1.26 -4.49 114.28 112.52 2giw n THR 47 Ca -0.16 -0.55 -0.10 0.00 -3.05 0.00 0.00 64.05 60.20 2giw n THR 47 Cb 0.53 0.19 -0.04 0.00 -1.55 0.00 0.00 70.33 69.46 2giw n THR 47 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2giw n TYR 48 N -0.22 -0.28 -1.65 1.09 0.18 -1.26 -5.09 117.16 109.93 2giw n TYR 48 Ca -0.02 -1.27 -0.42 0.00 1.88 0.00 0.00 57.90 58.07 2giw n TYR 48 Cb 0.14 0.11 0.01 0.00 -0.38 0.00 0.00 39.34 39.21 2giw n TYR 48 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 2giw n THR 49 N -0.32 2.35 0.04 -3.48 -2.24 -1.26 -4.64 114.28 104.73 2giw n THR 49 Ca 0.02 -0.50 0.14 0.00 -2.27 0.00 0.00 64.05 61.44 2giw n THR 49 Cb 0.28 -1.35 0.61 0.00 -2.10 0.00 0.00 70.33 67.77 2giw n THR 49 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2giw h ASP 50 N 1.95 0.13 -0.94 3.42 1.82 -1.96 0.16 116.42 120.99 2giw h ASP 50 Ca -0.45 0.00 0.09 0.00 -0.39 0.00 0.00 57.03 56.27 2giw h ASP 50 Cb 1.31 -0.02 -0.07 0.00 0.68 0.00 0.00 39.33 41.23 2giw h ASP 50 CO 0.59 0.08 0.61 0.00 -1.61 0.00 0.00 179.24 178.91 2giw h ALA 51 N 1.79 1.53 0.11 -0.78 0.00 -1.85 0.42 119.26 120.48 2giw h ALA 51 Ca 0.19 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 2giw h ALA 51 Cb 0.58 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.14 2giw h ALA 51 CO -0.03 0.30 -0.84 -0.97 0.00 0.00 0.00 179.25 177.71 2giw h ASN 52 N 1.01 0.36 -0.27 0.00 -0.73 -1.11 -3.32 115.58 111.53 2giw h ASN 52 Ca 0.43 -0.92 -0.01 0.00 1.87 0.00 0.00 56.30 57.67 2giw h ASN 52 Cb 0.31 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 38.77 2giw h ASN 52 CO -0.18 1.39 0.15 0.50 -0.37 0.00 0.00 177.43 178.91 2giw h LYS 53 N -0.48 0.40 -0.00 6.67 3.64 -0.43 -0.24 116.57 126.14 2giw h LYS 53 Ca -0.16 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2giw h LYS 53 Cb 1.56 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.30 2giw h LYS 53 CO 0.10 0.31 -0.06 -1.71 -2.27 0.00 0.00 179.45 175.81 2giw n ASN 54 N -4.45 0.21 0.04 4.20 5.15 0.14 -4.14 115.26 116.42 2giw n ASN 54 Ca 0.01 -0.33 -0.01 0.00 -0.60 0.00 0.00 54.58 53.65 2giw n ASN 54 Cb 0.10 -0.18 0.27 0.00 -0.53 0.00 0.00 39.78 39.44 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 0.24 0.42 -5.84 1.20 1.63 -1.13 -3.47 116.57 109.62 2giw h LYS 55 Ca 0.00 -0.13 -0.38 0.00 -0.85 0.00 0.00 60.65 59.29 2giw h LYS 55 Cb 0.32 -0.04 0.12 0.00 -0.60 0.00 0.00 32.23 32.03 2giw h LYS 55 CO 0.00 0.58 -0.76 0.41 -3.45 0.00 0.00 179.45 176.23 2giw n GLY 56 N -0.60 -0.40 0.00 5.01 0.00 -1.26 -5.02 105.19 102.92 2giw n GLY 56 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2giw n GLY 56 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2giw n ILE 57 N -4.42 0.00 -2.02 -0.61 -5.35 -1.26 -4.96 119.36 100.74 2giw n ILE 57 Ca -0.19 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.33 2giw n ILE 57 Cb 0.63 -0.25 0.06 0.00 -1.74 0.00 0.00 39.64 38.34 2giw n ILE 57 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 2giw n THR 58 N -0.05 0.60 -2.04 7.28 -1.04 -1.26 -0.63 114.28 117.14 2giw n THR 58 Ca 0.00 -1.22 0.00 0.00 -2.04 0.00 0.00 64.05 60.79 2giw n THR 58 Cb 0.00 0.49 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 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 -0.16 0.00 -2.56 -1.42 7.02 -1.21 -2.08 117.44 117.03 2giw n TRP 59 Ca 0.08 0.00 -0.22 0.00 -1.02 0.00 0.00 57.50 56.34 2giw n TRP 59 Cb 0.87 0.00 0.05 0.00 -2.42 0.00 0.00 31.31 29.81 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 -1.57 2.44 0.00 -0.99 0.00 -1.26 -3.46 119.74 114.90 2giw s LYS 60 Ca 0.00 -0.71 0.05 0.00 0.00 0.00 0.00 55.97 55.31 2giw s LYS 60 Cb 0.00 -2.43 0.27 0.00 0.00 0.00 0.00 37.83 35.67 2giw s LYS 60 CO 0.00 -0.84 0.88 -0.85 0.00 0.00 0.00 175.35 174.54 2giw n GLU 61 N -2.47 0.11 -0.09 1.78 0.28 -1.26 -1.11 120.64 117.88 2giw n GLU 61 Ca 0.08 0.12 -0.15 0.00 -0.16 0.00 0.00 57.16 57.05 2giw n GLU 61 Cb 0.60 -1.50 -0.07 0.00 1.43 0.00 0.00 31.44 31.89 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 -1.14 0.52 -0.06 3.44 1.02 -1.26 -4.00 120.64 119.16 2giw n GLU 62 Ca 0.03 0.54 -0.14 0.00 -0.02 0.00 0.00 57.16 57.57 2giw n GLU 62 Cb 0.03 -1.71 -0.02 0.00 -0.02 0.00 0.00 31.44 29.71 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 -1.00 1.28 -0.75 2.62 1.35 -1.63 -1.99 112.91 112.79 2giw h THR 63 Ca -0.23 -1.76 0.10 0.00 -0.55 0.00 0.00 66.41 63.98 2giw h THR 63 Cb 1.01 1.67 -0.08 0.00 -1.73 0.00 0.00 68.15 69.02 2giw h THR 63 CO -0.14 0.57 0.38 -0.07 -0.25 0.00 0.00 175.52 176.01 2giw h LEU 64 N 0.62 0.50 0.02 3.87 4.07 -1.36 -0.93 115.31 122.11 2giw h LEU 64 Ca 0.01 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 2giw h LEU 64 Cb 1.16 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.88 2giw h LEU 64 CO 0.12 0.27 -0.01 -0.03 -1.08 0.00 0.00 178.44 177.72 2giw h MET 65 N 0.63 -0.02 -0.29 1.13 4.05 -1.50 0.59 114.93 119.52 2giw h MET 65 Ca 0.38 0.00 0.02 0.00 -0.28 0.00 0.00 59.70 59.82 2giw h MET 65 Cb 0.41 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.19 2giw h MET 65 CO -0.28 0.08 0.12 0.93 0.23 0.00 0.00 176.91 178.00 2giw h GLU 66 N -0.12 0.26 0.81 0.39 4.39 -1.29 -0.73 114.58 118.30 2giw h GLU 66 Ca -0.00 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 2giw h GLU 66 Cb 0.11 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2giw h GLU 66 CO 0.00 0.17 -0.43 -0.92 -1.16 0.00 0.00 179.01 176.68 2giw h TYR 67 N 0.27 -1.12 -0.73 4.33 3.20 -0.91 -0.20 116.97 121.81 2giw h TYR 67 Ca 0.12 -0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.07 2giw h TYR 67 Cb 0.07 0.38 -0.05 0.00 1.54 0.00 0.00 36.73 38.67 2giw h TYR 67 CO -0.11 -0.67 0.48 -0.07 -1.64 0.00 0.00 178.16 176.15 2giw h LEU 68 N -1.14 0.55 -0.42 2.82 -0.00 -0.89 0.18 115.31 116.41 2giw h LEU 68 Ca -0.11 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.77 2giw h LEU 68 Cb 0.89 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 41.43 2giw h LEU 68 CO 0.16 0.32 0.19 -0.08 -0.00 0.00 0.00 178.44 179.03 2giw h GLU 69 N 0.61 0.62 -1.22 1.13 4.81 -0.90 -3.35 114.58 116.28 2giw h GLU 69 Ca 0.34 -0.10 -0.18 0.00 -0.13 0.00 0.00 59.36 59.29 2giw h GLU 69 Cb 0.50 -0.11 -0.21 0.00 0.63 0.00 0.00 28.75 29.57 2giw h GLU 69 CO -0.12 0.55 -0.54 1.21 -0.73 0.00 0.00 179.01 179.38 2giw s ASN 70 N -5.83 -0.96 0.06 1.04 3.84 -0.11 -4.35 114.94 108.63 2giw s ASN 70 Ca -0.13 -1.49 -0.17 0.00 0.21 0.00 0.00 52.86 51.28 2giw s ASN 70 Cb 0.10 1.59 -0.17 0.00 -0.55 0.00 0.00 41.25 42.22 2giw s ASN 70 CO 0.75 -0.13 1.26 1.55 -2.79 0.00 0.00 177.10 177.74 2giw h PRO 71 N 5.99 0.58 0.00 0.43 0.13 -0.92 -0.36 132.00 137.86 2giw h PRO 71 Ca 0.07 -0.46 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2giw h PRO 71 Cb 1.11 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2giw h PRO 71 CO 0.09 1.08 0.01 0.87 -0.23 0.00 0.00 178.00 179.83 2giw h LYS 72 N 0.22 0.00 0.00 0.86 1.79 -1.86 -0.92 116.57 116.67 2giw h LYS 72 Ca -0.03 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.28 2giw h LYS 72 Cb 1.17 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.80 2giw h LYS 72 CO 0.11 0.00 -1.28 1.17 -1.08 0.00 0.00 179.45 178.38 2giw n LYS 73 N -2.43 0.53 -0.30 3.15 0.00 -0.79 -4.24 118.16 114.08 2giw n LYS 73 Ca -0.02 0.39 0.18 0.00 0.00 0.00 0.00 58.31 58.87 2giw n LYS 73 Cb 0.05 -1.59 0.45 0.00 0.00 0.00 0.00 35.03 33.95 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 0.73 -3.21 5.64 3.20 -0.84 -3.36 116.97 118.14 2giw h TYR 74 Ca -0.24 0.02 -0.67 0.00 3.14 0.00 0.00 58.73 60.98 2giw h TYR 74 Cb 1.07 -0.22 -0.33 0.00 1.54 0.00 0.00 36.73 38.80 2giw h TYR 74 CO -0.18 0.15 -0.84 0.42 -1.64 0.00 0.00 178.16 176.08 2giw s ILE 75 N -5.57 2.35 -1.15 1.81 1.01 -0.37 -5.03 121.20 114.25 2giw s ILE 75 Ca -0.09 -0.87 -0.19 0.00 0.00 0.00 0.00 60.65 59.49 2giw s ILE 75 Cb 0.24 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2giw s ILE 75 CO 0.79 0.53 1.96 -0.81 0.00 0.00 0.00 174.94 177.41 2giw n PRO 76 N 4.22 2.22 0.00 2.79 -0.04 -1.26 -3.76 135.00 139.17 2giw n PRO 76 Ca -0.20 -2.48 0.00 0.00 -0.04 0.00 0.00 63.50 60.78 2giw n PRO 76 Cb 0.51 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.65 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 4.90 0.82 3.86 0.55 0.00 -1.26 -4.75 105.19 109.30 2giw n GLY 77 Ca 0.49 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.70 4.64 -0.56 2.61 -1.32 -1.25 -4.60 115.64 113.46 2giw s THR 78 Ca 0.00 0.97 0.24 0.00 -1.21 0.00 0.00 61.69 61.69 2giw s THR 78 Cb 0.00 -3.74 0.31 0.00 -1.51 0.00 0.00 72.50 67.56 2giw s THR 78 CO 0.00 -0.66 1.66 0.50 -2.21 0.00 0.00 174.62 173.91 2giw h LYS 79 N 0.94 0.00 -6.93 7.08 3.64 -1.97 -3.46 116.57 115.87 2giw h LYS 79 Ca -0.47 0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.36 2giw h LYS 79 Cb 1.19 0.00 0.12 0.00 -0.41 0.00 0.00 32.23 33.13 2giw h LYS 79 CO 0.62 0.00 0.64 -0.12 -2.27 0.00 0.00 179.45 178.32 2giw n MET 80 N -2.72 2.17 -3.83 1.90 1.56 -1.26 -4.99 117.12 109.95 2giw n MET 80 Ca 0.05 0.77 -0.29 0.00 -0.27 0.00 0.00 57.70 57.96 2giw n MET 80 Cb 0.49 -2.55 -0.13 0.00 2.15 0.00 0.00 33.22 33.18 2giw n MET 80 CO 0.00 0.00 0.00 0.42 -0.73 0.00 0.00 175.97 175.66 2giw s ILE 81 N -1.19 2.20 -0.47 1.12 -1.09 -1.26 -4.82 121.20 115.69 2giw s ILE 81 Ca 0.60 -3.37 0.05 0.00 -2.23 0.00 0.00 60.65 55.70 2giw s ILE 81 Cb -0.47 -2.50 0.23 0.00 -1.58 0.00 0.00 42.46 38.15 2giw s ILE 81 CO 0.58 -0.92 0.91 0.33 -1.23 0.00 0.00 174.94 174.61 2giw n PHE 82 N 2.85 -2.97 -0.29 3.97 7.35 -1.26 -5.06 117.46 122.05 2giw n PHE 82 Ca 0.12 -1.49 0.07 0.00 -0.76 0.00 0.00 57.45 55.40 2giw n PHE 82 Cb 0.35 1.47 0.22 0.00 0.35 0.00 0.00 39.48 41.87 2giw n PHE 82 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2giw h ALA 83 N 4.10 1.25 -2.75 3.13 0.00 -1.93 -3.38 119.26 119.67 2giw h ALA 83 Ca -0.11 0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.67 2giw h ALA 83 Cb 1.08 0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.77 2giw h ALA 83 CO 0.18 -0.14 -0.40 0.20 0.00 0.00 0.00 179.25 179.09 2giw s GLY 84 N -3.52 1.33 -0.23 0.00 0.00 -1.26 -4.40 107.32 99.23 2giw s GLY 84 Ca -0.12 -1.50 -0.16 0.00 0.00 0.00 0.00 44.72 42.94 2giw s GLY 84 CO 0.78 -1.14 -0.35 4.51 0.00 0.00 0.00 173.10 176.90 2giw n ILE 85 N -0.40 1.52 0.00 0.90 0.13 -1.26 -5.01 119.36 115.25 2giw n ILE 85 Ca 0.02 -0.14 0.00 0.00 -1.10 0.00 0.00 62.75 61.52 2giw n ILE 85 Cb 0.64 -2.10 0.00 0.00 -0.84 0.00 0.00 39.64 37.34 2giw n ILE 85 CO 0.00 0.00 0.00 1.17 2.80 0.00 0.00 176.55 180.52 2giw n LYS 86 N -4.35 0.00 0.12 9.51 4.81 -1.26 -4.99 118.16 122.00 2giw n LYS 86 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.08 2giw n LYS 86 Cb 0.72 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.77 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 -2.28 0.00 0.00 1.64 4.81 -1.26 -5.06 118.16 116.01 2giw n LYS 87 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2giw n LYS 87 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2giw n LYS 87 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2giw n LYS 88 N -3.01 0.00 -0.30 1.64 4.81 -1.26 -4.95 118.16 115.09 2giw n LYS 88 Ca 0.00 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.56 2giw n LYS 88 Cb 0.00 0.00 0.26 0.00 0.02 0.00 0.00 35.03 35.31 2giw n LYS 88 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 2giw h THR 89 N 0.00 0.22 -0.78 3.15 2.02 -1.98 0.29 112.91 115.83 2giw h THR 89 Ca 0.00 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 2giw h THR 89 Cb 0.00 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.47 2giw h THR 89 CO 0.00 0.02 0.47 -0.08 0.37 0.00 0.00 175.52 176.30 2giw h GLU 90 N 0.11 1.06 0.00 6.66 4.81 -1.94 -0.41 114.58 124.88 2giw h GLU 90 Ca 0.54 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.67 2giw h GLU 90 Cb 1.07 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.23 2giw h GLU 90 CO -0.74 0.75 0.03 0.54 -0.73 0.00 0.00 179.01 178.86 2giw n ARG 91 N -4.48 0.00 0.00 1.92 1.74 0.10 -1.03 116.66 114.91 2giw n ARG 91 Ca 0.07 0.47 0.02 0.00 -0.77 0.00 0.00 57.85 57.65 2giw n ARG 91 Cb 0.06 -1.55 0.01 0.00 -1.02 0.00 0.00 32.46 29.96 2giw n ARG 91 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2giw n GLU 92 N -1.50 1.42 -0.06 5.56 4.07 -0.19 -4.25 120.64 125.70 2giw n GLU 92 Ca -0.00 -0.52 -0.12 0.00 -0.06 0.00 0.00 57.16 56.46 2giw n GLU 92 Cb 0.03 -0.96 -0.04 0.00 -0.06 0.00 0.00 31.44 30.42 2giw n GLU 92 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 2giw n ASP 93 N -0.16 0.93 -0.09 4.31 5.75 -0.68 0.30 116.55 126.92 2giw n ASP 93 Ca 0.02 0.16 -0.06 0.00 -0.01 0.00 0.00 54.79 54.89 2giw n ASP 93 Cb 0.09 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 39.80 2giw n ASP 93 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2giw h LEU 94 N -0.44 -0.08 -0.06 -2.12 -0.00 -1.35 0.37 115.31 111.62 2giw h LEU 94 Ca -0.28 0.07 0.00 0.00 -0.00 0.00 0.00 57.88 57.67 2giw h LEU 94 Cb 1.18 0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.95 2giw h LEU 94 CO -0.17 -0.01 0.00 -0.38 -0.00 0.00 0.00 178.44 177.88 2giw n ILE 95 N -5.14 0.01 -0.13 1.22 5.41 -1.26 -2.51 119.36 116.96 2giw n ILE 95 Ca 0.00 -0.02 -0.25 0.00 1.00 0.00 0.00 62.75 63.49 2giw n ILE 95 Cb 0.16 -0.22 -0.09 0.00 -0.71 0.00 0.00 39.64 38.78 2giw n ILE 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2giw n ALA 96 N -0.69 1.09 -0.01 -1.39 0.00 -0.01 -4.05 120.51 115.45 2giw n ALA 96 Ca 0.12 -0.98 -0.11 0.00 0.00 0.00 0.00 53.44 52.47 2giw n ALA 96 Cb 0.07 0.05 -0.05 0.00 0.00 0.00 0.00 19.45 19.52 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 -1.00 -1.06 0.00 0.00 3.20 -1.12 -2.17 116.97 114.82 2giw h TYR 97 Ca -0.54 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.37 2giw h TYR 97 Cb 1.46 0.49 -0.00 0.00 1.54 0.00 0.00 36.73 40.21 2giw h TYR 97 CO -0.13 -0.44 -0.05 -0.07 -1.64 0.00 0.00 178.16 175.83 2giw h LEU 98 N -0.44 0.00 -0.19 2.82 3.38 -1.71 0.13 115.31 119.30 2giw h LEU 98 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2giw h LEU 98 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2giw h LEU 98 CO -0.40 0.05 0.00 1.17 0.09 0.00 0.00 178.44 179.35 2giw n LYS 99 N -3.57 0.06 -0.07 1.13 4.81 -0.82 -2.05 118.16 117.65 2giw n LYS 99 Ca -0.02 0.28 -0.09 0.00 -0.87 0.00 0.00 58.31 57.60 2giw n LYS 99 Cb 0.15 -1.61 -0.07 0.00 0.02 0.00 0.00 35.03 33.53 2giw n LYS 99 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2giw n LYS 100 N -1.73 0.50 -0.33 1.64 4.81 0.20 -4.65 118.16 118.59 2giw n LYS 100 Ca 0.03 0.07 0.05 0.00 -0.87 0.00 0.00 58.31 57.60 2giw n LYS 100 Cb 0.21 -1.28 0.21 0.00 0.02 0.00 0.00 35.03 34.18 2giw n LYS 100 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2giw h ALA 101 N 0.04 1.36 -1.13 3.14 0.00 -0.54 0.20 119.26 122.33 2giw h ALA 101 Ca -0.31 0.03 0.43 0.00 0.00 0.00 0.00 54.91 55.06 2giw h ALA 101 Cb 1.50 -0.17 -0.16 0.00 0.00 0.00 0.00 17.79 18.95 2giw h ALA 101 CO -0.04 0.17 0.66 -2.37 0.00 0.00 0.00 179.25 177.67 2giw n THR 102 N -4.68 -0.35 -2.83 0.00 5.66 -0.87 -2.41 114.28 108.80 2giw n THR 102 Ca 0.17 1.91 -0.12 0.00 -3.05 0.00 0.00 64.05 62.96 2giw n THR 102 Cb 0.32 -3.11 0.01 0.00 -1.55 0.00 0.00 70.33 66.01 2giw n THR 102 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2giw n ASN 103 N -5.01 1.12 -0.07 1.09 5.15 0.48 -4.32 115.26 113.71 2giw n ASN 103 Ca 0.38 -2.81 0.16 0.00 -0.60 0.00 0.00 54.58 51.71 2giw n ASN 103 Cb 1.37 -0.49 0.89 0.00 -0.53 0.00 0.00 39.78 41.03 2giw n ASN 103 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04