#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 0.00 1.61 8.00 -1.26 -4.83 116.55 120.07 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 0.20 2.53 3.14 -1.26 -4.59 118.33 118.35 2giw n VAL 3 Ca 0.00 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.24 2giw n VAL 3 Cb 0.00 0.00 -0.08 0.00 -1.06 0.00 0.00 33.84 32.70 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 -0.49 -0.98 1.45 4.39 -1.98 0.10 114.58 117.08 2giw h GLU 4 Ca 0.00 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.74 2giw h GLU 4 Cb 0.00 0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 28.71 2giw h GLU 4 CO 0.00 -0.22 0.65 0.87 -1.16 0.00 0.00 179.01 179.15 2giw h LYS 5 N -0.70 1.29 -0.04 2.33 1.57 -1.94 -0.19 116.57 118.88 2giw h LYS 5 Ca -0.05 -0.08 0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2giw h LYS 5 Cb 0.49 -0.29 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 2giw h LYS 5 CO 0.08 0.85 -0.32 0.78 -0.57 0.00 0.00 179.45 180.28 2giw h GLY 6 N 1.33 -0.50 1.49 3.86 0.00 -1.65 0.56 103.07 108.16 2giw h GLY 6 Ca 0.36 0.39 -0.08 0.00 0.00 0.00 0.00 47.33 48.00 2giw h GLY 6 CO -0.08 -0.23 -0.11 0.07 0.00 0.00 0.00 176.54 176.20 2giw h LYS 7 N -0.45 0.61 -0.14 4.80 2.10 -0.52 0.11 116.57 123.09 2giw h LYS 7 Ca 0.07 -0.18 -0.04 0.00 -2.00 0.00 0.00 60.65 58.50 2giw h LYS 7 Cb 0.55 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 31.82 2giw h LYS 7 CO -0.29 0.71 -0.06 -0.22 -2.00 0.00 0.00 179.45 177.59 2giw h LYS 8 N 0.56 0.28 -0.09 0.07 1.63 -0.60 -0.99 116.57 117.43 2giw h LYS 8 Ca 0.10 -0.12 -0.04 0.00 -0.85 0.00 0.00 60.65 59.75 2giw h LYS 8 Cb 0.52 -0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 32.14 2giw h LYS 8 CO 0.03 0.60 -0.09 0.82 -3.45 0.00 0.00 179.45 177.36 2giw h ILE 9 N -0.05 1.37 -0.23 2.00 2.04 -0.75 -1.43 117.51 120.44 2giw h ILE 9 Ca 0.03 -1.26 0.03 0.00 1.00 0.00 0.00 64.86 64.66 2giw h ILE 9 Cb 0.51 2.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.55 2giw h ILE 9 CO 0.02 0.36 -0.25 0.15 0.00 0.00 0.00 178.15 178.42 2giw h PHE 10 N -0.20 -0.78 -0.89 1.37 3.57 -0.81 -1.37 116.94 117.83 2giw h PHE 10 Ca 0.01 0.04 0.15 0.00 3.53 0.00 0.00 57.97 61.70 2giw h PHE 10 Cb 0.61 0.37 -0.07 0.00 2.79 0.00 0.00 35.95 39.65 2giw h PHE 10 CO 0.09 -0.21 0.57 0.28 -2.23 0.00 0.00 178.31 176.82 2giw h VAL 11 N -0.14 0.82 0.00 1.41 2.07 -1.10 0.53 116.25 119.84 2giw h VAL 11 Ca 0.04 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 2giw h VAL 11 Cb 0.25 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 2giw h VAL 11 CO -0.29 0.12 -0.02 1.56 0.02 0.00 0.00 177.57 178.96 2giw h GLN 12 N 0.68 0.00 0.00 1.57 4.20 -0.14 -3.29 115.11 118.13 2giw h GLN 12 Ca 0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.16 2giw h GLN 12 Cb 0.74 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.52 2giw h GLN 12 CO -0.21 0.02 0.00 0.36 -0.67 0.00 0.00 178.83 178.33 2giw n LYS 13 N -3.33 0.00 -0.06 1.46 0.00 -0.09 -4.94 118.16 111.20 2giw n LYS 13 Ca -0.02 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.16 2giw n LYS 13 Cb 0.13 -0.31 -0.05 0.00 -0.00 0.00 0.00 35.03 34.80 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 -0.38 2.29 -1.20 0.00 0.00 -1.62 0.65 119.26 119.01 2giw h ALA 15 Ca -0.31 -0.01 0.42 0.00 0.00 0.00 0.00 54.91 55.01 2giw h ALA 15 Cb 1.31 0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.96 2giw h ALA 15 CO -0.17 -0.40 0.73 -0.56 0.00 0.00 0.00 179.25 178.85 2giw h GLN 16 N 0.08 0.08 0.01 0.00 3.07 -1.85 -1.51 115.11 114.98 2giw h GLN 16 Ca 0.20 -0.00 -0.42 0.00 0.09 0.00 0.00 58.65 58.52 2giw h GLN 16 Cb 0.68 -0.02 -0.06 0.00 0.08 0.00 0.00 27.48 28.16 2giw h GLN 16 CO -0.02 0.05 -2.35 0.00 0.09 0.00 0.00 178.83 176.60 2giw n HIS 18 N -4.00 3.45 -2.42 0.00 8.25 -0.11 -3.91 115.22 116.47 2giw n HIS 18 Ca -0.49 -3.90 -0.38 0.00 -0.26 0.00 0.00 57.72 52.69 2giw n HIS 18 Cb 0.90 -0.78 -0.02 0.00 1.12 0.00 0.00 29.99 31.20 2giw n HIS 18 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2giw s THR 19 N -2.24 3.93 0.00 1.59 2.01 -0.96 -4.11 115.64 115.85 2giw s THR 19 Ca 0.34 -1.54 0.00 0.00 0.31 0.00 0.00 61.69 60.81 2giw s THR 19 Cb 0.07 -4.99 0.00 0.00 0.01 0.00 0.00 72.50 67.60 2giw s THR 19 CO -0.03 -1.70 0.11 1.33 -0.69 0.00 0.00 174.62 173.64 2giw n VAL 20 N 6.87 0.00 -2.73 3.82 0.24 -1.26 -3.43 118.33 121.83 2giw n VAL 20 Ca 0.47 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.76 2giw n VAL 20 Cb 0.46 -0.67 0.09 0.00 -1.47 0.00 0.00 33.84 32.25 2giw n VAL 20 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2giw n GLU 21 N 1.86 1.48 0.00 7.34 1.02 -1.26 -4.93 120.64 126.14 2giw n GLU 21 Ca 0.00 -2.29 0.00 0.00 -0.02 0.00 0.00 57.16 54.85 2giw n GLU 21 Cb 0.00 -0.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.90 2giw n GLU 21 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2giw n LYS 22 N -1.04 0.00 0.00 3.49 2.85 -1.22 -4.80 118.16 117.44 2giw n LYS 22 Ca -0.06 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.20 2giw n LYS 22 Cb 0.84 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.22 2giw n LYS 22 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2giw n GLY 23 N 0.00 1.32 0.14 2.58 0.00 -1.26 -4.36 105.19 103.61 2giw n GLY 23 Ca 0.00 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.12 2giw n GLY 23 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2giw h GLY 24 N 0.00 0.00 0.00 -0.02 0.00 -1.87 -3.47 103.07 97.71 2giw h GLY 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2giw h GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 2giw n LYS 25 N -2.32 0.00 0.00 4.80 5.02 -1.26 -3.71 118.16 120.69 2giw n LYS 25 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2giw n LYS 25 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2giw n LYS 25 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2giw n HIS 26 N 0.00 -0.14 -3.93 2.13 8.25 -1.26 -0.69 115.22 119.58 2giw n HIS 26 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 2giw n HIS 26 Cb 0.00 0.35 0.02 0.00 1.12 0.00 0.00 29.99 31.48 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 -2.06 -0.89 -1.88 -0.41 4.81 -1.24 -0.93 118.16 115.55 2giw n LYS 27 Ca 0.00 0.24 -0.07 0.00 -0.87 0.00 0.00 58.31 57.61 2giw n LYS 27 Cb 0.00 -3.35 -0.01 0.00 0.02 0.00 0.00 35.03 31.69 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 -4.66 -0.24 0.00 3.15 -1.04 -1.26 -4.83 114.28 105.40 2giw n THR 28 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 2giw n THR 28 Cb 0.59 -1.22 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 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 -1.31 -1.80 3.66 3.41 0.00 -0.10 -4.83 105.19 104.22 2giw n GLY 29 Ca -0.08 1.00 -0.50 0.00 0.00 0.00 0.00 46.02 46.44 2giw n GLY 29 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2giw n PRO 30 N 0.00 1.72 -1.58 1.61 -0.04 -1.26 -4.09 135.00 131.37 2giw n PRO 30 Ca 0.00 0.62 -0.58 0.00 -0.04 0.00 0.00 63.50 63.50 2giw n PRO 30 Cb 0.00 -2.37 -0.09 0.00 -0.04 0.00 0.00 33.50 31.01 2giw n PRO 30 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2giw n ASN 31 N 4.51 1.84 -3.35 3.54 5.15 0.13 -4.77 115.26 122.32 2giw n ASN 31 Ca 0.21 0.88 -0.32 0.00 -0.60 0.00 0.00 54.58 54.75 2giw n ASN 31 Cb 0.23 -1.08 -0.03 0.00 -0.53 0.00 0.00 39.78 38.38 2giw n ASN 31 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2giw n LEU 32 N 6.49 5.76 -0.03 1.20 4.77 -1.26 -4.61 117.00 129.32 2giw n LEU 32 Ca 0.36 -3.33 -0.15 0.00 -0.03 0.00 0.00 56.01 52.86 2giw n LEU 32 Cb 0.09 -1.25 -0.10 0.00 -2.33 0.00 0.00 43.42 39.83 2giw n LEU 32 CO 0.83 0.77 0.45 -0.74 -1.33 0.00 0.00 177.39 177.37 2giw h HIS 33 N 6.33 0.38 -3.08 -1.77 2.76 -1.87 -3.39 115.15 114.51 2giw h HIS 33 Ca 0.57 -0.17 -0.42 0.00 -2.20 0.00 0.00 60.37 58.15 2giw h HIS 33 Cb 0.33 -0.06 -0.40 0.00 1.55 0.00 0.00 27.41 28.84 2giw h HIS 33 CO 1.75 0.90 -0.73 0.20 -1.30 0.00 0.00 177.93 178.75 2giw s GLY 34 N -3.75 0.28 -0.00 5.26 0.00 -1.26 -4.24 107.32 103.60 2giw s GLY 34 Ca -0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 44.72 44.44 2giw s GLY 34 CO 0.76 1.67 -0.06 1.04 0.00 0.00 0.00 173.10 176.52 2giw n LEU 35 N 5.29 0.58 -4.55 0.66 4.32 -1.26 -4.73 117.00 117.31 2giw n LEU 35 Ca -0.06 0.09 -0.35 0.00 -0.02 0.00 0.00 56.01 55.67 2giw n LEU 35 Cb 0.49 -0.32 -0.03 0.00 -1.62 0.00 0.00 43.42 41.94 2giw n LEU 35 CO 0.09 -0.53 1.83 -0.36 -1.22 0.00 0.00 177.39 177.20 2giw s PHE 36 N -1.55 1.26 0.00 -1.77 0.40 -1.00 -0.59 117.98 114.74 2giw s PHE 36 Ca -0.05 1.35 0.00 0.00 -0.60 0.00 0.00 56.93 57.63 2giw s PHE 36 Cb 0.01 -3.73 0.00 0.00 0.51 0.00 0.00 43.02 39.81 2giw s PHE 36 CO 0.07 -2.38 0.00 0.41 0.70 0.00 0.00 175.22 174.02 2giw n GLY 37 N 6.00 0.93 3.54 4.36 0.00 -0.77 -5.02 105.19 114.22 2giw n GLY 37 Ca 0.33 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.87 3.54 -0.39 1.61 3.52 0.25 -5.00 118.95 121.61 2giw s ARG 38 Ca 0.00 -0.57 -0.37 0.00 -0.13 0.00 0.00 55.73 54.66 2giw s ARG 38 Cb 0.00 -3.80 -0.13 0.00 -1.56 0.00 0.00 34.95 29.46 2giw s ARG 38 CO 0.00 -0.45 2.19 0.36 -0.81 0.00 0.00 175.30 176.59 2giw n LYS 39 N 5.17 0.85 -1.59 5.12 2.85 -1.26 -3.23 118.16 126.06 2giw n LYS 39 Ca -0.12 0.23 -0.30 0.00 -1.05 0.00 0.00 58.31 57.07 2giw n LYS 39 Cb 0.50 -2.27 0.20 0.00 -0.65 0.00 0.00 35.03 32.81 2giw n LYS 39 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2giw s THR 40 N 7.14 1.84 -0.80 0.58 2.01 -0.03 -4.38 115.64 122.01 2giw s THR 40 Ca 1.12 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 63.11 2giw s THR 40 Cb -0.98 -2.80 0.00 0.00 0.01 0.00 0.00 72.50 68.73 2giw s THR 40 CO 0.52 0.00 0.11 0.61 -0.69 0.00 0.00 174.62 175.17 2giw n GLY 41 N -2.63 0.02 0.00 4.40 0.00 -1.26 -4.37 105.19 101.36 2giw n GLY 41 Ca 0.14 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2giw n GLY 41 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2giw n GLN 42 N -2.07 0.00 -1.77 1.61 7.27 -1.26 -4.84 117.38 116.31 2giw n GLN 42 Ca -0.09 0.00 -0.00 0.00 0.07 0.00 0.00 57.00 56.98 2giw n GLN 42 Cb 0.58 0.00 -0.00 0.00 2.41 0.00 0.00 30.24 33.22 2giw n GLN 42 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2giw n ALA 43 N -1.71 -2.49 -2.40 1.69 0.00 -1.26 -4.52 120.51 109.82 2giw n ALA 43 Ca 0.00 0.33 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 2giw n ALA 43 Cb 0.00 -0.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.53 2giw n ALA 43 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2giw n PRO 44 N 1.02 3.03 0.00 0.00 -0.04 -1.26 -3.92 135.00 133.83 2giw n PRO 44 Ca -0.01 -3.11 0.00 0.00 -0.04 0.00 0.00 63.50 60.34 2giw n PRO 44 Cb 0.02 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.00 2giw n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2giw n GLY 45 N 5.22 2.33 3.14 0.55 0.00 -1.26 -5.09 105.19 110.09 2giw n GLY 45 Ca 0.49 -0.26 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 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 1.26 0.35 1.61 2.19 -1.25 -5.17 117.98 116.98 2giw s PHE 46 Ca 0.00 -0.34 0.04 0.00 0.33 0.00 0.00 56.93 56.97 2giw s PHE 46 Cb 0.00 -0.76 -0.02 0.00 -1.31 0.00 0.00 43.02 40.93 2giw s PHE 46 CO 0.00 0.03 0.15 -2.37 1.83 0.00 0.00 175.22 174.86 2giw n THR 47 N 2.03 0.00 -3.30 0.12 5.66 -1.26 -4.56 114.28 112.97 2giw n THR 47 Ca -0.17 -2.14 0.00 0.00 -3.05 0.00 0.00 64.05 58.68 2giw n THR 47 Cb 0.55 0.82 0.00 0.00 -1.55 0.00 0.00 70.33 70.15 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 -0.78 -0.14 -0.81 1.09 4.11 -1.26 -5.11 117.16 114.25 2giw n TYR 48 Ca -0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 57.90 57.53 2giw n TYR 48 Cb 0.55 0.00 0.12 0.00 -0.00 0.00 0.00 39.34 40.00 2giw n TYR 48 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 2giw n THR 49 N -0.05 0.00 -0.13 -3.48 -2.24 -1.26 -4.65 114.28 102.47 2giw n THR 49 Ca 0.00 -0.25 -0.05 0.00 -2.27 0.00 0.00 64.05 61.48 2giw n THR 49 Cb 0.00 -0.49 0.04 0.00 -2.10 0.00 0.00 70.33 67.78 2giw n THR 49 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2giw h ASP 50 N -1.56 0.12 0.14 3.42 2.03 -1.95 0.18 116.42 118.80 2giw h ASP 50 Ca -0.46 0.05 -0.01 0.00 -0.73 0.00 0.00 57.03 55.89 2giw h ASP 50 Cb 1.31 0.05 0.00 0.00 -0.83 0.00 0.00 39.33 39.86 2giw h ASP 50 CO 0.33 0.10 -0.07 0.00 -1.03 0.00 0.00 179.24 178.58 2giw h ALA 51 N 1.28 -0.18 -0.19 4.15 0.00 -1.92 0.57 119.26 122.97 2giw h ALA 51 Ca 0.20 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2giw h ALA 51 Cb 0.20 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2giw h ALA 51 CO -0.21 -0.59 -0.39 -0.97 0.00 0.00 0.00 179.25 177.08 2giw h ASN 52 N -0.21 0.67 1.21 0.00 -0.73 -1.77 -3.23 115.58 111.52 2giw h ASN 52 Ca -0.02 -0.56 0.00 0.00 1.87 0.00 0.00 56.30 57.59 2giw h ASN 52 Cb 0.16 -0.19 0.00 0.00 0.27 0.00 0.00 38.32 38.56 2giw h ASN 52 CO 0.03 1.10 0.00 0.07 -0.37 0.00 0.00 177.43 178.26 2giw h LYS 53 N 0.26 0.00 0.00 6.67 5.09 -0.35 -0.61 116.57 127.63 2giw h LYS 53 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2giw h LYS 53 Cb 1.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.33 2giw h LYS 53 CO 0.09 0.00 -0.07 -1.71 -2.09 0.00 0.00 179.45 175.67 2giw n ASN 54 N -2.33 0.33 -0.28 7.07 2.85 0.20 -4.16 115.26 118.94 2giw n ASN 54 Ca 0.04 0.45 -0.01 0.00 -0.11 0.00 0.00 54.58 54.95 2giw n ASN 54 Cb 0.36 -0.51 0.18 0.00 1.24 0.00 0.00 39.78 41.05 2giw n ASN 54 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 2giw h LYS 55 N 0.00 1.12 -5.54 1.20 1.63 -1.12 -3.46 116.57 110.40 2giw h LYS 55 Ca 0.00 -0.08 -0.36 0.00 -0.85 0.00 0.00 60.65 59.35 2giw h LYS 55 Cb 0.59 -0.24 0.14 0.00 -0.60 0.00 0.00 32.23 32.11 2giw h LYS 55 CO 0.00 0.77 -0.66 0.41 -3.45 0.00 0.00 179.45 176.52 2giw n GLY 56 N -1.34 -0.43 0.00 5.01 0.00 -1.26 -5.00 105.19 102.17 2giw n GLY 56 Ca 0.09 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 -4.68 0.00 -2.27 -0.61 -5.35 -1.26 -4.89 119.36 100.30 2giw n ILE 57 Ca -0.05 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.47 2giw n ILE 57 Cb 0.58 -0.55 0.04 0.00 -1.74 0.00 0.00 39.64 37.97 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 0.00 0.29 -2.44 7.28 -1.04 -1.26 -0.85 114.28 116.27 2giw n THR 58 Ca 0.00 -1.10 0.00 0.00 -2.04 0.00 0.00 64.05 60.91 2giw n THR 58 Cb 0.00 0.74 0.00 0.00 -1.82 0.00 0.00 70.33 69.25 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 0.18 0.00 -3.39 -1.42 5.03 -1.20 -1.84 117.44 114.79 2giw n TRP 59 Ca 0.07 0.00 -0.21 0.00 3.03 0.00 0.00 57.50 60.39 2giw n TRP 59 Cb 1.00 0.00 -0.00 0.00 -1.03 0.00 0.00 31.31 31.28 2giw n TRP 59 CO 0.00 0.00 0.00 -1.59 -0.03 0.00 0.00 177.69 176.07 2giw s LYS 60 N -2.25 2.52 0.44 -0.99 -2.85 -1.26 -2.38 119.74 112.97 2giw s LYS 60 Ca 0.00 -1.56 0.19 0.00 -1.00 0.00 0.00 55.97 53.60 2giw s LYS 60 Cb 0.00 -2.47 1.13 0.00 -2.06 0.00 0.00 37.83 34.43 2giw s LYS 60 CO 0.00 -0.39 1.89 1.05 0.10 0.00 0.00 175.35 178.00 2giw h GLU 61 N 0.75 0.33 0.37 1.78 9.09 -1.97 0.31 114.58 125.23 2giw h GLU 61 Ca -0.38 -0.02 -0.02 0.00 0.05 0.00 0.00 59.36 58.99 2giw h GLU 61 Cb 1.28 -0.07 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 2giw h GLU 61 CO 0.52 0.22 -0.18 0.93 0.05 0.00 0.00 179.01 180.55 2giw h GLU 62 N 0.34 -0.47 -0.10 1.06 5.08 -2.00 -2.61 114.58 115.88 2giw h GLU 62 Ca 0.41 0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.57 2giw h GLU 62 Cb 1.08 0.11 0.01 0.00 0.50 0.00 0.00 28.75 30.45 2giw h GLU 62 CO -0.12 -0.16 -0.85 1.79 -1.00 0.00 0.00 179.01 178.66 2giw h THR 63 N -0.82 1.30 -0.88 1.13 1.35 -1.78 -2.57 112.91 110.64 2giw h THR 63 Ca -0.05 -2.10 0.06 0.00 -0.55 0.00 0.00 66.41 63.78 2giw h THR 63 Cb 0.53 2.13 -0.06 0.00 -1.73 0.00 0.00 68.15 69.01 2giw h THR 63 CO 0.08 0.65 0.55 -0.07 -0.25 0.00 0.00 175.52 176.48 2giw h LEU 64 N 0.45 0.86 0.10 3.87 4.07 -1.07 -0.72 115.31 122.88 2giw h LEU 64 Ca -0.07 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.90 2giw h LEU 64 Cb 1.48 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 43.05 2giw h LEU 64 CO 0.17 0.55 -0.05 -0.03 -1.08 0.00 0.00 178.44 177.99 2giw h MET 65 N 0.99 -0.14 -0.22 1.13 4.05 -1.11 -0.10 114.93 119.54 2giw h MET 65 Ca 0.38 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.85 2giw h MET 65 Cb 0.18 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 2giw h MET 65 CO -0.18 -0.04 0.01 1.49 0.23 0.00 0.00 176.91 178.43 2giw h GLU 66 N -0.20 0.08 0.81 0.39 4.57 -1.20 -0.55 114.58 118.49 2giw h GLU 66 Ca -0.01 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.12 2giw h GLU 66 Cb 0.16 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 2giw h GLU 66 CO 0.02 0.06 -0.45 -0.92 -1.18 0.00 0.00 179.01 176.54 2giw h TYR 67 N 0.09 -1.20 -0.49 0.92 3.20 -1.01 -0.95 116.97 117.53 2giw h TYR 67 Ca 0.10 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2giw h TYR 67 Cb 0.12 0.42 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 2giw h TYR 67 CO -0.17 -0.70 0.26 -0.07 -1.64 0.00 0.00 178.16 175.84 2giw h LEU 68 N -1.17 0.59 -0.02 2.82 -0.00 -0.93 0.19 115.31 116.79 2giw h LEU 68 Ca -0.11 -0.04 -0.00 0.00 -0.00 0.00 0.00 57.88 57.73 2giw h LEU 68 Cb 0.92 -0.15 -0.00 0.00 -0.00 0.00 0.00 40.66 41.43 2giw h LEU 68 CO 0.14 0.49 0.01 -0.08 -0.00 0.00 0.00 178.44 178.99 2giw h GLU 69 N 0.68 0.02 -1.49 1.13 4.22 -1.03 -3.42 114.58 114.70 2giw h GLU 69 Ca 0.17 -0.00 -0.46 0.00 0.08 0.00 0.00 59.36 59.15 2giw h GLU 69 Cb 0.03 -0.00 -0.32 0.00 0.50 0.00 0.00 28.75 28.96 2giw h GLU 69 CO -0.03 0.17 -0.91 -1.71 -2.18 0.00 0.00 179.01 174.35 2giw n ASN 70 N -5.00 -0.84 -0.06 1.04 2.85 -0.37 -4.73 115.26 108.15 2giw n ASN 70 Ca -0.07 -2.82 -0.11 0.00 -0.11 0.00 0.00 54.58 51.46 2giw n ASN 70 Cb 0.10 0.10 -0.05 0.00 1.24 0.00 0.00 39.78 41.17 2giw n ASN 70 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2giw h PRO 71 N 4.21 0.32 -0.02 1.20 0.13 -0.85 0.31 132.00 137.30 2giw h PRO 71 Ca 0.03 -0.09 0.01 0.00 -0.87 0.00 0.00 66.00 65.08 2giw h PRO 71 Cb 0.93 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 2giw h PRO 71 CO 0.40 0.51 0.04 1.57 -0.23 0.00 0.00 178.00 180.29 2giw h LYS 72 N 0.09 0.00 0.00 0.86 5.09 -1.77 -0.88 116.57 119.96 2giw h LYS 72 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 60.65 60.68 2giw h LYS 72 Cb 0.35 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.66 2giw h LYS 72 CO 0.01 0.00 -0.63 -0.22 -2.09 0.00 0.00 179.45 176.52 2giw h LYS 73 N 0.00 0.00 -0.91 0.07 3.11 -1.45 -3.01 116.57 114.39 2giw h LYS 73 Ca 0.01 0.00 0.18 0.00 -2.81 0.00 0.00 60.65 58.03 2giw h LYS 73 Cb 0.10 0.00 -0.11 0.00 -1.00 0.00 0.00 32.23 31.22 2giw h LYS 73 CO -0.00 0.98 0.48 -0.92 -2.81 0.00 0.00 179.45 177.18 2giw h TYR 74 N -1.00 0.83 -2.93 1.91 3.20 -0.55 -3.34 116.97 115.09 2giw h TYR 74 Ca -0.17 0.04 -0.56 0.00 3.14 0.00 0.00 58.73 61.17 2giw h TYR 74 Cb 1.14 -0.23 -0.40 0.00 1.54 0.00 0.00 36.73 38.78 2giw h TYR 74 CO 0.18 0.14 -0.77 0.42 -1.64 0.00 0.00 178.16 176.49 2giw s ILE 75 N -5.91 0.40 -1.25 1.81 1.01 -0.38 -5.06 121.20 111.82 2giw s ILE 75 Ca -0.12 -1.17 -0.16 0.00 0.00 0.00 0.00 60.65 59.21 2giw s ILE 75 Cb 0.24 -1.32 -0.02 0.00 0.01 0.00 0.00 42.46 41.37 2giw s ILE 75 CO 0.79 -0.73 2.16 -0.81 0.00 0.00 0.00 174.94 176.34 2giw n PRO 76 N 4.93 2.46 0.00 2.79 -0.04 -1.14 -3.19 135.00 140.82 2giw n PRO 76 Ca -0.02 -2.35 0.00 0.00 -0.04 0.00 0.00 63.50 61.08 2giw n PRO 76 Cb 0.41 -3.16 0.00 0.00 -0.04 0.00 0.00 33.50 30.72 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 4.21 -0.12 3.93 0.55 0.00 -1.26 -5.06 105.19 107.44 2giw n GLY 77 Ca 0.52 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 5.28 0.25 2.61 -1.32 -1.19 -4.35 115.64 116.91 2giw s THR 78 Ca 0.00 -0.44 0.16 0.00 -1.21 0.00 0.00 61.69 60.20 2giw s THR 78 Cb 0.00 -3.71 0.10 0.00 -1.51 0.00 0.00 72.50 67.39 2giw s THR 78 CO 0.00 -0.06 1.75 0.50 -2.21 0.00 0.00 174.62 174.60 2giw h LYS 79 N 2.34 0.00 -7.00 7.08 3.64 -1.96 -3.45 116.57 117.23 2giw h LYS 79 Ca -0.47 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.38 2giw h LYS 79 Cb 1.18 0.00 0.10 0.00 -0.41 0.00 0.00 32.23 33.10 2giw h LYS 79 CO 0.70 0.41 0.58 1.41 -2.27 0.00 0.00 179.45 180.28 2giw s MET 80 N -3.77 3.60 -0.45 1.90 1.75 -1.26 -5.01 119.30 116.06 2giw s MET 80 Ca -0.01 2.10 0.03 0.00 -1.25 0.00 0.00 55.69 56.56 2giw s MET 80 Cb 0.12 -2.48 0.13 0.00 2.84 0.00 0.00 34.83 35.44 2giw s MET 80 CO 0.70 -0.78 0.23 0.42 -0.65 0.00 0.00 175.02 174.95 2giw s ILE 81 N -1.35 1.73 0.30 10.11 -1.09 -1.26 -4.95 121.20 124.69 2giw s ILE 81 Ca 0.64 -2.71 -0.20 0.00 -2.23 0.00 0.00 60.65 56.15 2giw s ILE 81 Cb -0.37 -2.21 0.02 0.00 -1.58 0.00 0.00 42.46 38.32 2giw s ILE 81 CO 0.45 -0.85 0.72 0.12 -1.23 0.00 0.00 174.94 174.15 2giw s PHE 82 N 0.24 -0.11 0.14 3.97 5.36 -1.26 -5.10 117.98 121.22 2giw s PHE 82 Ca 0.17 -0.38 0.00 0.00 -0.96 0.00 0.00 56.93 55.76 2giw s PHE 82 Cb -0.25 0.70 0.00 0.00 -0.34 0.00 0.00 43.02 43.14 2giw s PHE 82 CO -0.01 -1.28 0.00 0.00 -1.46 0.00 0.00 175.22 172.47 2giw n ALA 83 N -0.47 0.00 -2.97 11.12 0.00 -1.26 -4.41 120.51 122.52 2giw n ALA 83 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.30 2giw n ALA 83 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 2giw n ALA 83 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2giw s GLY 84 N -2.00 0.71 0.02 0.00 0.00 -1.26 -4.57 107.32 100.21 2giw s GLY 84 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.68 2giw s GLY 84 CO 0.00 -0.78 0.00 4.51 0.00 0.00 0.00 173.10 176.83 2giw n ILE 85 N -0.35 0.00 0.00 0.90 3.06 -1.26 -5.08 119.36 116.63 2giw n ILE 85 Ca -0.01 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.24 2giw n ILE 85 Cb 0.63 -0.29 0.00 0.00 0.54 0.00 0.00 39.64 40.51 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 -2.54 0.00 0.05 9.51 4.81 -1.26 -5.09 118.16 123.63 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 -1.98 0.00 0.00 1.64 3.00 -1.26 -5.05 118.16 114.52 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 -2.88 0.00 -0.35 1.64 4.81 -1.26 -4.94 118.16 115.18 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 -0.02 0.24 0.00 0.02 0.00 0.00 35.03 35.27 2giw n LYS 88 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2giw n THR 89 N -2.38 -0.41 -0.10 3.15 -1.04 -1.26 -0.03 114.28 112.21 2giw n THR 89 Ca 0.00 2.20 0.00 0.00 -2.04 0.00 0.00 64.05 64.21 2giw n THR 89 Cb 0.00 -3.15 0.28 0.00 -1.82 0.00 0.00 70.33 65.63 2giw n THR 89 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2giw h GLU 90 N 0.00 0.75 0.00 -2.82 3.07 -1.98 0.58 114.58 114.18 2giw h GLU 90 Ca 0.55 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 59.31 2giw h GLU 90 Cb 1.05 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 2giw h GLU 90 CO -0.96 0.60 0.00 2.89 -1.40 0.00 0.00 179.01 180.14 2giw n ARG 91 N -4.36 0.05 -0.05 2.33 -4.01 0.95 -1.22 116.66 110.36 2giw n ARG 91 Ca 0.04 0.28 -0.09 0.00 -1.04 0.00 0.00 57.85 57.04 2giw n ARG 91 Cb 0.14 -1.50 -0.03 0.00 -3.04 0.00 0.00 32.46 28.03 2giw n ARG 91 CO 0.00 0.00 0.00 -1.91 -3.04 0.00 0.00 177.63 172.68 2giw n GLU 92 N -1.32 0.31 -0.00 2.89 2.13 -0.06 -4.46 120.64 120.12 2giw n GLU 92 Ca 0.02 0.13 -0.10 0.00 0.66 0.00 0.00 57.16 57.87 2giw n GLU 92 Cb 0.03 -1.03 -0.03 0.00 0.27 0.00 0.00 31.44 30.68 2giw n GLU 92 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 2giw h ASP 93 N -0.56 -0.87 -0.35 4.31 3.58 -0.71 0.38 116.42 122.20 2giw h ASP 93 Ca -0.14 0.13 0.05 0.00 0.42 0.00 0.00 57.03 57.50 2giw h ASP 93 Cb 0.83 0.38 -0.04 0.00 1.72 0.00 0.00 39.33 42.22 2giw h ASP 93 CO -0.08 -0.32 0.09 -0.07 -2.88 0.00 0.00 179.24 175.98 2giw h LEU 94 N -0.34 0.06 0.00 2.28 -0.00 -1.40 -0.09 115.31 115.82 2giw h LEU 94 Ca 0.10 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 58.03 2giw h LEU 94 Cb 0.50 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 41.22 2giw h LEU 94 CO -0.34 0.07 0.00 -0.38 -0.00 0.00 0.00 178.44 177.79 2giw n ILE 95 N -5.06 0.50 -0.11 1.22 2.08 -0.21 -1.06 119.36 116.71 2giw n ILE 95 Ca 0.01 0.12 -0.25 0.00 0.56 0.00 0.00 62.75 63.20 2giw n ILE 95 Cb 0.14 -0.85 -0.11 0.00 -0.75 0.00 0.00 39.64 38.07 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 -1.28 1.14 0.11 -1.39 0.00 0.12 -3.66 120.51 115.54 2giw n ALA 96 Ca 0.08 -0.92 -0.15 0.00 0.00 0.00 0.00 53.44 52.45 2giw n ALA 96 Cb 0.13 -0.16 -0.08 0.00 0.00 0.00 0.00 19.45 19.34 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 -0.64 -1.32 0.00 0.00 3.20 -0.86 -2.34 116.97 115.01 2giw h TYR 97 Ca -0.57 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.33 2giw h TYR 97 Cb 1.67 0.57 -0.00 0.00 1.54 0.00 0.00 36.73 40.51 2giw h TYR 97 CO -0.00 -0.55 -0.00 -0.07 -1.64 0.00 0.00 178.16 175.89 2giw h LEU 98 N -0.69 0.00 0.00 2.82 3.38 -1.29 0.15 115.31 119.68 2giw h LEU 98 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2giw h LEU 98 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2giw h LEU 98 CO -0.27 0.00 0.00 1.17 0.09 0.00 0.00 178.44 179.43 2giw n LYS 99 N -3.17 0.56 0.00 1.13 4.81 -0.88 -1.81 118.16 118.80 2giw n LYS 99 Ca -0.03 0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 2giw n LYS 99 Cb 0.10 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.65 2giw n LYS 99 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 2giw n LYS 100 N -1.04 1.36 -0.33 1.64 2.85 0.31 -4.79 118.16 118.17 2giw n LYS 100 Ca 0.14 0.00 0.17 0.00 -1.05 0.00 0.00 58.31 57.57 2giw n LYS 100 Cb 0.08 -0.82 0.41 0.00 -0.65 0.00 0.00 35.03 34.05 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 0.00 1.92 0.00 0.58 0.00 -0.88 0.66 119.26 121.54 2giw h ALA 101 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2giw h ALA 101 Cb 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2giw h ALA 101 CO 0.00 -0.30 0.00 -2.37 0.00 0.00 0.00 179.25 176.58 2giw n THR 102 N -4.70 0.81 0.05 0.00 5.66 -0.75 -3.77 114.28 111.58 2giw n THR 102 Ca 0.24 0.20 0.00 0.00 -3.05 0.00 0.00 64.05 61.44 2giw n THR 102 Cb 0.69 -1.20 0.00 0.00 -1.55 0.00 0.00 70.33 68.27 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 -1.20 0.10 0.00 1.09 5.15 0.39 -4.48 115.26 116.30 2giw n ASN 103 Ca 0.00 0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.13 2giw n ASN 103 Cb 0.00 0.07 0.00 0.00 -0.53 0.00 0.00 39.78 39.32 2giw n ASN 103 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04