#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2giw s ASP 2 N 0.00 2.78 0.16 1.61 1.11 -1.26 -4.73 116.67 116.34 2giw s ASP 2 Ca 0.00 -1.01 -0.08 0.00 0.18 0.00 0.00 52.55 51.65 2giw s ASP 2 Cb 0.00 -0.17 0.01 0.00 1.07 0.00 0.00 42.92 43.83 2giw s ASP 2 CO 0.00 -0.11 1.46 1.62 1.18 0.00 0.00 175.17 179.32 2giw h VAL 3 N 2.58 1.29 0.69 -1.27 3.04 -1.86 0.29 116.25 121.01 2giw h VAL 3 Ca -0.39 -1.73 -0.03 0.00 -1.01 0.00 0.00 66.70 63.54 2giw h VAL 3 Cb 1.23 1.64 0.01 0.00 -2.01 0.00 0.00 31.29 32.16 2giw h VAL 3 CO 0.60 0.55 -0.33 -0.33 -1.01 0.00 0.00 177.57 177.06 2giw h GLU 4 N 0.58 -0.90 -0.39 4.17 5.08 -1.96 0.15 114.58 121.31 2giw h GLU 4 Ca 0.02 0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2giw h GLU 4 Cb 1.10 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 30.54 2giw h GLU 4 CO 0.11 -0.57 0.08 0.87 -1.00 0.00 0.00 179.01 178.50 2giw h LYS 5 N -1.14 0.64 0.16 2.33 1.79 -1.95 -1.53 116.57 116.87 2giw h LYS 5 Ca -0.10 -0.17 0.02 0.00 -2.18 0.00 0.00 60.65 58.22 2giw h LYS 5 Cb 0.74 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 31.28 2giw h LYS 5 CO 0.16 0.69 -0.36 0.78 -1.08 0.00 0.00 179.45 179.63 2giw h GLY 6 N 0.50 -0.73 1.62 3.86 0.00 -0.38 0.34 103.07 108.27 2giw h GLY 6 Ca 0.12 0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.81 2giw h GLY 6 CO 0.01 -0.27 -0.14 0.07 0.00 0.00 0.00 176.54 176.21 2giw h LYS 7 N -0.62 0.46 -0.01 4.80 2.10 -0.65 0.21 116.57 122.86 2giw h LYS 7 Ca 0.02 -0.13 -0.00 0.00 -2.00 0.00 0.00 60.65 58.53 2giw h LYS 7 Cb 0.63 -0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 31.91 2giw h LYS 7 CO -0.19 0.60 -0.01 -0.22 -2.00 0.00 0.00 179.45 177.64 2giw h LYS 8 N 0.42 0.02 -0.29 0.07 1.63 -0.92 -0.03 116.57 117.48 2giw h LYS 8 Ca 0.08 -0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 59.77 2giw h LYS 8 Cb 0.50 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 2giw h LYS 8 CO 0.03 0.44 -0.22 0.82 -3.45 0.00 0.00 179.45 177.08 2giw h ILE 9 N -0.40 1.30 -0.08 2.00 2.04 -0.80 -0.72 117.51 120.86 2giw h ILE 9 Ca 0.00 -1.36 0.01 0.00 1.00 0.00 0.00 64.86 64.52 2giw h ILE 9 Cb 0.44 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 2giw h ILE 9 CO 0.00 0.43 -0.21 0.15 0.00 0.00 0.00 178.15 178.52 2giw h PHE 10 N 0.39 -0.64 -0.55 1.37 3.57 -0.58 -1.31 116.94 119.19 2giw h PHE 10 Ca 0.05 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.71 2giw h PHE 10 Cb 0.76 0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 2giw h PHE 10 CO 0.07 -0.21 0.39 0.28 -2.23 0.00 0.00 178.31 176.61 2giw h VAL 11 N -0.21 0.79 0.00 1.41 2.07 -0.89 0.56 116.25 119.99 2giw h VAL 11 Ca 0.02 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.47 2giw h VAL 11 Cb 0.26 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2giw h VAL 11 CO -0.19 0.03 -0.06 -0.61 0.02 0.00 0.00 177.57 176.76 2giw h GLN 12 N 0.16 0.00 0.00 1.57 -0.00 0.01 -3.34 115.11 113.51 2giw h GLN 12 Ca 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.91 2giw h GLN 12 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.31 2giw h GLN 12 CO -0.04 0.06 0.00 0.36 0.00 0.00 0.00 178.83 179.21 2giw n LYS 13 N -4.08 0.00 -0.03 1.69 0.00 0.01 -4.94 118.16 110.80 2giw n LYS 13 Ca -0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.23 2giw n LYS 13 Cb 0.14 -0.32 -0.03 0.00 -0.00 0.00 0.00 35.03 34.83 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 -0.12 2.39 -1.19 0.00 0.00 -1.66 0.99 119.26 119.69 2giw h ALA 15 Ca -0.15 -0.00 0.39 0.00 0.00 0.00 0.00 54.91 55.15 2giw h ALA 15 Cb 1.18 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.84 2giw h ALA 15 CO -0.06 -0.64 0.74 -0.56 0.00 0.00 0.00 179.25 178.73 2giw h GLN 16 N 0.25 0.15 0.00 0.00 3.07 -1.84 -1.82 115.11 114.92 2giw h GLN 16 Ca 0.41 -0.01 -0.28 0.00 0.09 0.00 0.00 58.65 58.86 2giw h GLN 16 Cb 1.23 -0.03 -0.05 0.00 0.08 0.00 0.00 27.48 28.70 2giw h GLN 16 CO -0.10 0.10 -2.07 0.00 0.09 0.00 0.00 178.83 176.85 2giw s HIS 18 N -2.38 2.46 -0.48 0.00 3.76 -0.04 -3.36 115.29 115.25 2giw s HIS 18 Ca -0.09 -2.86 -0.07 0.00 -0.15 0.00 0.00 55.06 51.89 2giw s HIS 18 Cb 0.05 -1.94 -0.18 0.00 1.11 0.00 0.00 32.58 31.62 2giw s HIS 18 CO 0.62 -0.68 3.33 0.25 -0.85 0.00 0.00 174.74 177.42 2giw n THR 19 N 2.46 3.44 -1.46 1.30 -2.24 -1.21 -4.06 114.28 112.51 2giw n THR 19 Ca 0.23 -2.03 -0.37 0.00 -2.27 0.00 0.00 64.05 59.61 2giw n THR 19 Cb 0.40 -2.11 -0.07 0.00 -2.10 0.00 0.00 70.33 66.46 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 2.55 1.63 0.00 2.28 3.14 -1.26 -2.79 118.33 123.88 2giw n VAL 20 Ca 0.53 -1.55 0.00 0.00 -2.96 0.00 0.00 64.34 60.36 2giw n VAL 20 Cb 0.69 -2.22 0.00 0.00 -1.06 0.00 0.00 33.84 31.25 2giw n VAL 20 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2giw n GLU 21 N 7.62 0.00 -4.41 1.45 2.13 -1.26 -5.01 120.64 121.16 2giw n GLU 21 Ca 0.47 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.99 2giw n GLU 21 Cb 0.43 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.09 2giw n GLU 21 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2giw s LYS 22 N -1.46 2.21 -1.27 5.31 1.02 -1.12 -5.02 119.74 119.41 2giw s LYS 22 Ca 0.00 -2.22 -0.11 0.00 0.02 0.00 0.00 55.97 53.66 2giw s LYS 22 Cb 0.00 -1.77 -0.06 0.00 -0.52 0.00 0.00 37.83 35.48 2giw s LYS 22 CO 0.00 -0.42 2.43 0.41 -0.92 0.00 0.00 175.35 176.85 2giw n GLY 23 N -1.42 3.72 0.00 -3.33 0.00 -1.26 -4.85 105.19 98.05 2giw n GLY 23 Ca -0.11 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.62 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 3.86 0.38 1.01 -0.02 0.00 -1.26 -5.14 105.19 104.03 2giw n GLY 24 Ca 0.59 -1.31 -0.05 0.00 0.00 0.00 0.00 46.02 45.26 2giw n GLY 24 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2giw n LYS 25 N 0.00 0.19 -4.57 1.61 3.00 -1.26 -5.12 118.16 112.01 2giw n LYS 25 Ca 0.00 -0.90 -0.33 0.00 -0.00 0.00 0.00 58.31 57.08 2giw n LYS 25 Cb 0.00 0.83 -0.15 0.00 0.00 0.00 0.00 35.03 35.70 2giw n LYS 25 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 2giw s HIS 26 N -3.79 2.76 0.00 5.64 3.76 -1.26 -4.27 115.29 118.13 2giw s HIS 26 Ca 0.10 -1.07 0.00 0.00 -0.15 0.00 0.00 55.06 53.94 2giw s HIS 26 Cb -0.00 -1.87 0.00 0.00 1.11 0.00 0.00 32.58 31.82 2giw s HIS 26 CO 0.07 -0.49 0.00 0.36 -0.85 0.00 0.00 174.74 173.83 2giw n LYS 27 N 4.04 0.00 -0.12 1.40 2.85 -1.26 -4.88 118.16 120.18 2giw n LYS 27 Ca -0.19 0.00 0.04 0.00 -1.05 0.00 0.00 58.31 57.11 2giw n LYS 27 Cb 0.52 0.00 0.11 0.00 -0.65 0.00 0.00 35.03 35.01 2giw n LYS 27 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2giw n THR 28 N -0.51 0.33 0.00 0.58 -1.04 -1.26 -4.87 114.28 107.51 2giw n THR 28 Ca 0.00 -0.33 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 2giw n THR 28 Cb 0.00 0.16 0.00 0.00 -1.82 0.00 0.00 70.33 68.67 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 0.89 1.20 3.74 3.41 0.00 -1.21 -4.86 105.19 108.36 2giw n GLY 29 Ca 0.08 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2giw n GLY 29 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2giw s PRO 30 N -1.25 4.67 0.02 1.61 0.04 -1.26 -4.40 135.00 134.43 2giw s PRO 30 Ca 0.00 1.34 -0.34 0.00 0.04 0.00 0.00 61.00 62.04 2giw s PRO 30 Cb 0.00 -3.34 -0.13 0.00 0.04 0.00 0.00 34.50 31.07 2giw s PRO 30 CO 0.00 0.34 1.74 -1.71 0.04 0.00 0.00 177.00 177.41 2giw n ASN 31 N 2.35 3.25 -2.36 6.66 2.85 -1.26 -4.81 115.26 121.94 2giw n ASN 31 Ca -0.01 1.02 -0.16 0.00 -0.11 0.00 0.00 54.58 55.33 2giw n ASN 31 Cb 0.49 -1.39 -0.12 0.00 1.24 0.00 0.00 39.78 40.00 2giw n ASN 31 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2giw n LEU 32 N 5.15 5.27 -2.21 1.20 4.77 -1.26 -4.77 117.00 125.15 2giw n LEU 32 Ca 0.20 -3.08 -0.19 0.00 -0.03 0.00 0.00 56.01 52.91 2giw n LEU 32 Cb 0.29 -1.27 -0.11 0.00 -2.33 0.00 0.00 43.42 39.99 2giw n LEU 32 CO 0.69 1.46 1.58 1.57 -1.33 0.00 0.00 177.39 181.36 2giw n HIS 33 N 2.86 0.75 0.00 -1.77 -0.00 -1.26 -4.24 115.22 111.55 2giw n HIS 33 Ca 0.45 -1.70 0.00 0.00 0.46 0.00 0.00 57.72 56.93 2giw n HIS 33 Cb 0.65 -1.46 0.00 0.00 -0.12 0.00 0.00 29.99 29.06 2giw n HIS 33 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2giw n GLY 34 N 1.70 1.76 0.00 1.57 0.00 -1.26 -5.04 105.19 103.91 2giw n GLY 34 Ca 0.44 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -4.42 0.99 4.77 -1.26 -4.61 117.00 112.47 2giw n LEU 35 Ca 0.00 0.00 -0.62 0.00 -0.03 0.00 0.00 56.01 55.36 2giw n LEU 35 Cb 0.00 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 40.98 2giw n LEU 35 CO 0.00 0.00 1.55 0.49 -1.33 0.00 0.00 177.39 178.10 2giw n PHE 36 N -1.41 1.37 0.00 -1.77 3.72 -1.15 -0.29 117.46 117.93 2giw n PHE 36 Ca 0.00 0.87 0.00 0.00 -0.05 0.00 0.00 57.45 58.27 2giw n PHE 36 Cb 0.00 -2.28 0.00 0.00 -0.94 0.00 0.00 39.48 36.26 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 6.33 2.80 3.70 1.37 0.00 -0.65 -5.01 105.19 113.73 2giw n GLY 37 Ca 0.47 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 46.06 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 0.00 4.44 0.06 1.61 3.00 0.60 -4.95 118.95 123.71 2giw s ARG 38 Ca 0.00 1.56 -0.30 0.00 0.00 0.00 0.00 55.73 56.99 2giw s ARG 38 Cb 0.00 -3.48 -0.05 0.00 0.00 0.00 0.00 34.95 31.42 2giw s ARG 38 CO 0.00 -0.27 1.13 0.15 0.00 0.00 0.00 175.30 176.31 2giw s LYS 39 N 1.59 4.49 0.00 3.54 3.01 -1.26 -3.93 119.74 127.18 2giw s LYS 39 Ca 0.54 1.67 0.00 0.00 -1.01 0.00 0.00 55.97 57.16 2giw s LYS 39 Cb -0.23 -3.37 0.00 0.00 -1.01 0.00 0.00 37.83 33.22 2giw s LYS 39 CO 0.24 -0.16 0.00 -2.37 0.51 0.00 0.00 175.35 173.57 2giw n THR 40 N 3.74 0.00 -1.00 2.17 5.66 0.02 -4.73 114.28 120.15 2giw n THR 40 Ca 0.07 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 61.07 2giw n THR 40 Cb 0.48 -1.45 -0.00 0.00 -1.55 0.00 0.00 70.33 67.81 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 5.00 0.48 3.15 1.09 0.00 -1.26 -4.25 105.19 109.40 2giw n GLY 41 Ca 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.27 0.30 -0.40 1.61 0.74 -1.26 -4.77 119.66 115.60 2giw s GLN 42 Ca 0.00 0.33 0.01 0.00 0.05 0.00 0.00 55.36 55.75 2giw s GLN 42 Cb 0.00 0.16 0.13 0.00 1.10 0.00 0.00 33.01 34.39 2giw s GLN 42 CO 0.00 -0.53 0.20 0.00 -0.55 0.00 0.00 175.29 174.40 2giw s ALA 43 N 2.91 1.98 -1.13 1.58 0.00 -1.26 -5.07 121.76 120.77 2giw s ALA 43 Ca 0.19 -2.35 -0.23 0.00 0.00 0.00 0.00 51.96 49.57 2giw s ALA 43 Cb -0.06 -1.82 -0.06 0.00 0.00 0.00 0.00 23.12 21.18 2giw s ALA 43 CO -0.23 -1.97 1.91 -1.25 0.00 0.00 0.00 175.76 174.22 2giw s PRO 44 N 0.69 2.66 0.00 0.00 0.04 -1.26 -2.36 135.00 134.77 2giw s PRO 44 Ca 0.16 -1.04 0.00 0.00 0.04 0.00 0.00 61.00 60.16 2giw s PRO 44 Cb -0.23 -5.23 0.00 0.00 0.04 0.00 0.00 34.50 29.08 2giw s PRO 44 CO -0.05 -3.66 0.00 0.41 0.04 0.00 0.00 177.00 173.73 2giw n GLY 45 N 6.04 -1.69 0.25 0.56 0.00 -1.26 -4.98 105.19 104.11 2giw n GLY 45 Ca 0.44 0.59 -0.26 0.00 0.00 0.00 0.00 46.02 46.79 2giw n GLY 45 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2giw n PHE 46 N 0.00 0.00 -1.31 1.61 7.35 -1.23 -5.12 117.46 118.76 2giw n PHE 46 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2giw n PHE 46 Cb 0.00 -0.87 0.00 0.00 0.35 0.00 0.00 39.48 38.96 2giw n PHE 46 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 2giw n THR 47 N -4.08 0.00 -4.12 -2.13 5.66 -1.00 -5.03 114.28 103.59 2giw n THR 47 Ca -0.48 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.37 2giw n THR 47 Cb 0.84 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.57 2giw n THR 47 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2giw s TYR 48 N 0.00 1.13 0.57 1.09 -0.85 -1.26 -4.96 117.35 113.07 2giw s TYR 48 Ca 0.00 -1.32 -0.20 0.00 -0.52 0.00 0.00 57.07 55.03 2giw s TYR 48 Cb 0.00 -0.19 -0.05 0.00 0.38 0.00 0.00 41.96 42.11 2giw s TYR 48 CO 0.00 -1.06 1.17 0.25 -1.52 0.00 0.00 175.55 174.38 2giw n THR 49 N -0.55 3.84 -0.30 -3.49 -2.24 -1.26 -4.53 114.28 105.76 2giw n THR 49 Ca 0.02 -0.50 0.20 0.00 -2.27 0.00 0.00 64.05 61.50 2giw n THR 49 Cb 0.62 -1.39 0.38 0.00 -2.10 0.00 0.00 70.33 67.84 2giw n THR 49 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2giw n ASP 50 N -0.92 0.08 -0.33 3.42 8.00 -1.26 -0.41 116.55 125.14 2giw n ASP 50 Ca 0.12 1.51 0.02 0.00 0.71 0.00 0.00 54.79 57.15 2giw n ASP 50 Cb 0.46 -0.63 0.19 0.00 -0.02 0.00 0.00 41.12 41.12 2giw n ASP 50 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2giw h ALA 51 N 1.80 1.42 0.13 2.24 0.00 -1.84 0.38 119.26 123.39 2giw h ALA 51 Ca 0.64 -0.04 -0.27 0.00 0.00 0.00 0.00 54.91 55.25 2giw h ALA 51 Cb 1.52 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2giw h ALA 51 CO -0.78 0.47 -1.33 -0.97 0.00 0.00 0.00 179.25 176.65 2giw h ASN 52 N 1.15 0.43 -0.96 0.00 -0.73 -1.00 -3.36 115.58 111.10 2giw h ASN 52 Ca 0.38 -0.88 0.17 0.00 1.87 0.00 0.00 56.30 57.84 2giw h ASN 52 Cb 0.06 -0.14 -0.09 0.00 0.27 0.00 0.00 38.32 38.42 2giw h ASN 52 CO -0.12 1.59 0.61 0.50 -0.37 0.00 0.00 177.43 179.64 2giw h LYS 53 N -0.27 0.71 0.00 6.67 1.63 -0.41 -0.02 116.57 124.88 2giw h LYS 53 Ca -0.28 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.45 2giw h LYS 53 Cb 1.78 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 33.24 2giw h LYS 53 CO 0.09 0.47 -0.16 -0.97 -3.45 0.00 0.00 179.45 175.43 2giw h ASN 54 N 0.73 0.00 0.46 4.20 -0.73 -0.39 -3.38 115.58 116.47 2giw h ASN 54 Ca 0.52 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.66 2giw h ASN 54 Cb 0.84 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.43 2giw h ASN 54 CO -0.28 0.16 -0.22 0.11 -0.37 0.00 0.00 177.43 176.83 2giw h LYS 55 N 0.00 -0.59 -4.12 6.67 1.79 -1.14 -3.47 116.57 115.71 2giw h LYS 55 Ca -0.00 0.04 -0.40 0.00 -2.18 0.00 0.00 60.65 58.11 2giw h LYS 55 Cb 0.60 0.13 0.02 0.00 -1.58 0.00 0.00 32.23 31.41 2giw h LYS 55 CO 0.02 -0.29 -0.57 0.41 -1.08 0.00 0.00 179.45 177.94 2giw n GLY 56 N -0.61 -0.51 3.93 3.86 0.00 -1.26 -4.98 105.19 105.62 2giw n GLY 56 Ca -0.11 0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.09 1.99 -0.20 -0.61 -4.36 -1.26 -4.67 121.20 109.00 2giw s ILE 57 Ca 0.21 0.00 0.15 0.00 -0.26 0.00 0.00 60.65 60.75 2giw s ILE 57 Cb -0.10 -2.99 0.45 0.00 1.25 0.00 0.00 42.46 41.07 2giw s ILE 57 CO 0.26 0.00 1.34 0.41 0.24 0.00 0.00 174.94 177.19 2giw n THR 58 N -3.81 2.24 -3.90 8.37 -1.04 -1.26 -0.80 114.28 114.07 2giw n THR 58 Ca 0.16 -2.31 -0.29 0.00 -2.04 0.00 0.00 64.05 59.56 2giw n THR 58 Cb 0.59 -0.27 -0.01 0.00 -1.82 0.00 0.00 70.33 68.83 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 -0.97 -0.88 -1.79 -1.42 5.03 -1.25 -1.64 117.44 114.53 2giw n TRP 59 Ca 0.23 0.12 -0.29 0.00 3.03 0.00 0.00 57.50 60.58 2giw n TRP 59 Cb 0.84 -1.82 0.13 0.00 -1.03 0.00 0.00 31.31 29.44 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 -6.47 1.26 0.00 -0.99 0.00 -1.26 -2.96 119.74 109.32 2giw s LYS 60 Ca 0.25 -0.00 -0.02 0.00 0.00 0.00 0.00 55.97 56.19 2giw s LYS 60 Cb -0.14 -1.88 -0.10 0.00 0.00 0.00 0.00 37.83 35.71 2giw s LYS 60 CO 0.65 -2.06 2.35 -0.85 0.00 0.00 0.00 175.35 175.44 2giw n GLU 61 N -3.61 1.23 0.12 1.78 0.28 -1.26 -2.28 120.64 116.90 2giw n GLU 61 Ca 0.10 -0.36 0.00 0.00 -0.16 0.00 0.00 57.16 56.74 2giw n GLU 61 Cb 0.60 -1.43 0.00 0.00 1.43 0.00 0.00 31.44 32.04 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 1.98 0.00 -0.01 3.44 1.02 -1.26 -4.75 120.64 121.06 2giw n GLU 62 Ca 0.15 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.26 2giw n GLU 62 Cb 0.59 0.00 0.21 0.00 -0.02 0.00 0.00 31.44 32.22 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 1.25 -0.58 2.62 1.35 -1.92 -0.90 112.91 114.74 2giw h THR 63 Ca 0.00 -1.12 0.04 0.00 -0.55 0.00 0.00 66.41 64.78 2giw h THR 63 Cb 0.00 1.18 -0.04 0.00 -1.73 0.00 0.00 68.15 67.55 2giw h THR 63 CO 0.00 0.37 0.32 -0.07 -0.25 0.00 0.00 175.52 175.89 2giw h LEU 64 N 0.50 0.50 0.24 3.87 4.07 -1.77 -0.33 115.31 122.39 2giw h LEU 64 Ca 0.09 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 58.05 2giw h LEU 64 Cb 0.56 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.22 2giw h LEU 64 CO 0.04 0.34 -0.11 0.24 -1.08 0.00 0.00 178.44 177.86 2giw h MET 65 N 0.63 -0.31 -0.22 1.13 2.86 -1.49 -0.31 114.93 117.21 2giw h MET 65 Ca 0.25 0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.97 2giw h MET 65 Cb 0.10 0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.76 2giw h MET 65 CO -0.14 -0.13 -0.23 1.49 1.06 0.00 0.00 176.91 178.96 2giw h GLU 66 N -0.42 -0.24 0.71 1.72 4.81 -1.10 -0.29 114.58 119.77 2giw h GLU 66 Ca -0.03 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2giw h GLU 66 Cb 0.32 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 2giw h GLU 66 CO 0.05 -0.16 -0.45 -0.92 -0.73 0.00 0.00 179.01 176.81 2giw h TYR 67 N -0.25 -1.19 -0.97 0.92 3.20 -0.96 0.32 116.97 118.03 2giw h TYR 67 Ca 0.13 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.10 2giw h TYR 67 Cb 0.45 0.43 -0.08 0.00 1.54 0.00 0.00 36.73 39.07 2giw h TYR 67 CO -0.38 -0.66 0.62 -0.07 -1.64 0.00 0.00 178.16 176.03 2giw h LEU 68 N -1.09 0.90 -0.83 2.82 -0.00 -0.92 0.24 115.31 116.43 2giw h LEU 68 Ca -0.10 0.04 -0.11 0.00 -0.00 0.00 0.00 57.88 57.71 2giw h LEU 68 Cb 0.87 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.37 2giw h LEU 68 CO 0.09 0.50 -0.28 -0.08 -0.00 0.00 0.00 178.44 178.67 2giw h GLU 69 N 0.98 0.55 -0.56 1.13 4.22 -0.85 -3.39 114.58 116.66 2giw h GLU 69 Ca 0.47 -0.23 -0.31 0.00 0.08 0.00 0.00 59.36 59.37 2giw h GLU 69 Cb 0.44 -0.02 -0.21 0.00 0.50 0.00 0.00 28.75 29.46 2giw h GLU 69 CO -0.23 0.78 -0.66 -1.71 -2.18 0.00 0.00 179.01 175.01 2giw n ASN 70 N -4.10 -1.82 -0.14 1.04 2.85 0.08 -4.45 115.26 108.73 2giw n ASN 70 Ca -0.01 -3.29 -0.12 0.00 -0.11 0.00 0.00 54.58 51.05 2giw n ASN 70 Cb 0.44 1.18 -0.01 0.00 1.24 0.00 0.00 39.78 42.63 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 3.60 0.93 0.00 1.20 0.13 -0.79 -0.13 132.00 136.93 2giw h PRO 71 Ca -0.07 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2giw h PRO 71 Cb 1.02 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2giw h PRO 71 CO 0.31 1.08 0.00 1.17 -0.23 0.00 0.00 178.00 180.34 2giw n LYS 72 N -4.14 0.29 -0.08 0.86 0.00 -1.26 -1.31 118.16 112.52 2giw n LYS 72 Ca -0.01 0.10 -0.17 0.00 0.00 0.00 0.00 58.31 58.23 2giw n LYS 72 Cb 0.47 -1.50 -0.06 0.00 0.00 0.00 0.00 35.03 33.95 2giw n LYS 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2giw n LYS 73 N -1.18 0.37 -0.31 1.64 4.81 -0.33 -4.61 118.16 118.55 2giw n LYS 73 Ca 0.08 0.16 0.13 0.00 -0.87 0.00 0.00 58.31 57.81 2giw n LYS 73 Cb 0.09 -1.12 0.31 0.00 0.02 0.00 0.00 35.03 34.32 2giw n LYS 73 CO 0.00 0.00 0.00 -0.92 1.17 0.00 0.00 177.40 177.65 2giw h TYR 74 N -0.63 0.75 -3.30 5.64 3.20 -0.97 -3.38 116.97 118.28 2giw h TYR 74 Ca -0.38 0.04 -0.66 0.00 3.14 0.00 0.00 58.73 60.87 2giw h TYR 74 Cb 1.27 -0.19 -0.29 0.00 1.54 0.00 0.00 36.73 39.06 2giw h TYR 74 CO -0.09 0.02 -0.79 0.42 -1.64 0.00 0.00 178.16 176.08 2giw s ILE 75 N -5.88 2.79 -1.43 1.81 1.01 -0.43 -5.04 121.20 114.03 2giw s ILE 75 Ca -0.11 -0.73 -0.12 0.00 0.00 0.00 0.00 60.65 59.68 2giw s ILE 75 Cb 0.25 -2.18 -0.05 0.00 0.01 0.00 0.00 42.46 40.50 2giw s ILE 75 CO 0.78 0.51 2.54 -0.81 0.00 0.00 0.00 174.94 177.97 2giw n PRO 76 N 3.95 3.07 0.00 2.79 -0.04 -1.26 -3.91 135.00 139.59 2giw n PRO 76 Ca -0.19 -2.23 0.00 0.00 -0.04 0.00 0.00 63.50 61.04 2giw n PRO 76 Cb 0.52 -2.94 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 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 3.85 0.44 3.87 0.55 0.00 -1.26 -4.70 105.19 107.94 2giw n GLY 77 Ca 0.64 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 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 4.77 -0.33 2.61 -1.32 -1.25 -4.58 115.64 115.54 2giw s THR 78 Ca 0.00 0.67 0.10 0.00 -1.21 0.00 0.00 61.69 61.25 2giw s THR 78 Cb 0.00 -3.72 0.75 0.00 -1.51 0.00 0.00 72.50 68.03 2giw s THR 78 CO 0.00 -0.48 1.82 0.29 -2.21 0.00 0.00 174.62 174.04 2giw n LYS 79 N -1.18 3.73 0.06 7.08 4.01 -1.26 -4.67 118.16 125.94 2giw n LYS 79 Ca 0.03 -3.10 -0.03 0.00 -0.51 0.00 0.00 58.31 54.69 2giw n LYS 79 Cb 0.54 -2.22 0.19 0.00 -0.51 0.00 0.00 35.03 33.03 2giw n LYS 79 CO 0.00 0.00 0.00 1.98 -1.11 0.00 0.00 177.40 178.27 2giw h MET 80 N 2.67 0.35 -6.05 1.97 4.05 -1.94 -3.48 114.93 112.50 2giw h MET 80 Ca 0.27 -0.16 -0.24 0.00 -0.28 0.00 0.00 59.70 59.29 2giw h MET 80 Cb 2.36 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 33.15 2giw h MET 80 CO 0.75 0.68 -0.60 -0.89 0.23 0.00 0.00 176.91 177.09 2giw n ILE 81 N -4.04 -6.83 0.03 1.77 2.08 -1.26 -4.94 119.36 106.17 2giw n ILE 81 Ca -0.01 -0.04 0.00 0.00 0.56 0.00 0.00 62.75 63.26 2giw n ILE 81 Cb 0.47 -4.98 0.00 0.00 -0.75 0.00 0.00 39.64 34.38 2giw n ILE 81 CO 0.00 0.00 0.00 0.33 0.56 0.00 0.00 176.55 177.44 2giw n PHE 82 N -1.93 -0.80 0.00 1.39 7.35 -1.26 -5.07 117.46 117.14 2giw n PHE 82 Ca -0.14 0.10 0.00 0.00 -0.76 0.00 0.00 57.45 56.66 2giw n PHE 82 Cb 0.60 0.60 0.00 0.00 0.35 0.00 0.00 39.48 41.03 2giw n PHE 82 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2giw n ALA 83 N -2.66 0.00 -2.52 3.13 0.00 -1.26 -4.72 120.51 112.48 2giw n ALA 83 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 2giw n ALA 83 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 0.00 2.48 0.05 0.00 0.00 -1.26 -4.06 107.32 104.52 2giw s GLY 84 Ca 0.00 -1.85 -0.03 0.00 0.00 0.00 0.00 44.72 42.85 2giw s GLY 84 CO 0.00 -2.00 -0.05 4.51 0.00 0.00 0.00 173.10 175.55 2giw n ILE 85 N -1.22 1.14 0.14 0.90 3.06 -1.26 -4.97 119.36 117.15 2giw n ILE 85 Ca -0.05 0.31 0.00 0.00 -2.50 0.00 0.00 62.75 60.52 2giw n ILE 85 Cb 0.66 -1.68 0.00 0.00 0.54 0.00 0.00 39.64 39.15 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 -3.58 0.00 0.03 9.51 4.81 -1.26 -4.96 118.16 122.71 2giw n LYS 86 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.41 2giw n LYS 86 Cb 0.14 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.19 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 -3.16 0.00 0.12 1.64 4.81 -1.26 -5.04 118.16 115.26 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 -2.74 0.00 -0.23 1.64 4.81 -1.26 -4.97 118.16 115.40 2giw n LYS 88 Ca 0.00 0.00 0.03 0.00 -0.87 0.00 0.00 58.31 57.47 2giw n LYS 88 Cb 0.00 0.00 0.12 0.00 0.02 0.00 0.00 35.03 35.17 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 0.41 -0.66 3.15 2.02 -2.00 0.12 112.91 115.95 2giw h THR 89 Ca 0.00 -0.03 0.01 0.00 0.77 0.00 0.00 66.41 67.16 2giw h THR 89 Cb 0.00 0.30 -0.03 0.00 -1.74 0.00 0.00 68.15 66.68 2giw h THR 89 CO 0.00 0.02 0.43 -0.08 0.37 0.00 0.00 175.52 176.26 2giw h GLU 90 N 0.10 0.83 -0.00 6.66 4.81 -1.94 0.18 114.58 125.22 2giw h GLU 90 Ca 0.36 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 2giw h GLU 90 Cb 0.61 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 2giw h GLU 90 CO -0.61 0.55 0.01 -0.09 -0.73 0.00 0.00 179.01 178.14 2giw h ARG 91 N 0.86 0.00 0.00 1.92 2.43 -1.13 -0.83 114.38 117.62 2giw h ARG 91 Ca 0.25 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 59.21 2giw h ARG 91 Cb -0.05 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 2giw h ARG 91 CO -0.06 0.00 -1.78 -1.91 -1.51 0.00 0.00 179.97 174.71 2giw n GLU 92 N -3.09 1.69 0.22 0.20 4.07 0.07 -4.14 120.64 119.67 2giw n GLU 92 Ca -0.03 0.02 -0.13 0.00 -0.06 0.00 0.00 57.16 56.96 2giw n GLU 92 Cb 0.08 -1.29 -0.07 0.00 -0.06 0.00 0.00 31.44 30.10 2giw n GLU 92 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2giw h ASP 93 N 0.00 -0.50 -0.57 4.31 3.32 -0.56 0.35 116.42 122.76 2giw h ASP 93 Ca -0.31 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 56.68 2giw h ASP 93 Cb 1.64 0.13 -0.04 0.00 0.22 0.00 0.00 39.33 41.28 2giw h ASP 93 CO -0.00 -0.12 0.32 -0.07 -1.72 0.00 0.00 179.24 177.64 2giw h LEU 94 N -0.95 0.48 -0.21 1.55 -0.00 -1.40 0.18 115.31 114.97 2giw h LEU 94 Ca -0.06 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 2giw h LEU 94 Cb 0.57 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.16 2giw h LEU 94 CO 0.10 0.33 0.00 -0.38 -0.00 0.00 0.00 178.44 178.49 2giw n ILE 95 N -4.82 0.05 -0.10 1.22 2.08 -1.24 -1.16 119.36 115.40 2giw n ILE 95 Ca 0.06 -0.07 -0.15 0.00 0.56 0.00 0.00 62.75 63.15 2giw n ILE 95 Cb 0.13 -0.10 -0.05 0.00 -0.75 0.00 0.00 39.64 38.87 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 -0.50 0.91 -0.01 -1.39 0.00 -0.10 -4.21 120.51 115.20 2giw n ALA 96 Ca 0.10 -0.83 -0.13 0.00 0.00 0.00 0.00 53.44 52.58 2giw n ALA 96 Cb 0.09 0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 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 -1.38 0.00 0.00 3.20 -0.99 -1.74 116.97 115.07 2giw h TYR 97 Ca -0.22 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.70 2giw h TYR 97 Cb 1.12 0.62 -0.00 0.00 1.54 0.00 0.00 36.73 40.02 2giw h TYR 97 CO -0.28 -0.50 -0.04 -0.07 -1.64 0.00 0.00 178.16 175.62 2giw h LEU 98 N -0.52 0.00 -0.65 2.82 3.38 -1.39 0.23 115.31 119.17 2giw h LEU 98 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2giw h LEU 98 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2giw h LEU 98 CO -0.43 0.04 0.00 1.17 0.09 0.00 0.00 178.44 179.31 2giw n LYS 99 N -3.66 0.16 -0.05 1.13 4.81 -0.66 -1.87 118.16 118.02 2giw n LYS 99 Ca -0.02 0.42 -0.07 0.00 -0.87 0.00 0.00 58.31 57.77 2giw n LYS 99 Cb 0.14 -1.82 -0.07 0.00 0.02 0.00 0.00 35.03 33.30 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 -2.13 1.45 -0.23 1.64 3.00 0.17 -4.68 118.16 117.38 2giw n LYS 100 Ca 0.02 0.03 -0.03 0.00 -0.00 0.00 0.00 58.31 58.33 2giw n LYS 100 Cb 0.20 -1.25 0.07 0.00 0.00 0.00 0.00 35.03 34.06 2giw n LYS 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2giw h ALA 101 N 0.26 0.87 0.00 3.14 0.00 -0.22 0.25 119.26 123.55 2giw h ALA 101 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2giw h ALA 101 Cb 1.52 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2giw h ALA 101 CO -0.01 0.15 0.17 1.79 0.00 0.00 0.00 179.25 181.35 2giw h THR 102 N 0.78 0.00 -0.35 0.00 1.35 -1.63 -0.61 112.91 112.45 2giw h THR 102 Ca 0.27 0.00 -0.25 0.00 -0.55 0.00 0.00 66.41 65.88 2giw h THR 102 Cb 0.05 0.45 -0.38 0.00 -1.73 0.00 0.00 68.15 66.54 2giw h THR 102 CO -0.12 0.00 -1.04 -3.20 -0.25 0.00 0.00 175.52 170.92 2giw n ASN 103 N -2.29 1.85 0.00 5.36 4.05 0.36 -4.59 115.26 120.00 2giw n ASN 103 Ca -0.01 -2.32 0.13 0.00 0.45 0.00 0.00 54.58 52.83 2giw n ASN 103 Cb 0.20 -0.42 0.78 0.00 1.23 0.00 0.00 39.78 41.57 2giw n ASN 103 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59