#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 0.01 2.53 3.14 -1.26 -4.63 118.33 118.11 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 -0.08 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 0.04 -0.93 1.45 4.39 -1.97 0.90 114.58 118.45 2giw h GLU 4 Ca 0.00 -0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.78 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 0.24 0.58 0.87 -1.16 0.00 0.00 179.01 179.54 2giw h LYS 5 N -0.17 0.96 0.29 2.33 1.79 -1.94 0.19 116.57 120.03 2giw h LYS 5 Ca 0.01 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 2giw h LYS 5 Cb 0.21 -0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 30.62 2giw h LYS 5 CO -0.00 0.64 -0.39 0.78 -1.08 0.00 0.00 179.45 179.40 2giw h GLY 6 N 0.99 -0.87 0.65 3.86 0.00 -1.58 -0.31 103.07 105.81 2giw h GLY 6 Ca 0.43 0.46 0.08 0.00 0.00 0.00 0.00 47.33 48.30 2giw h GLY 6 CO -0.22 -0.30 0.58 1.70 0.00 0.00 0.00 176.54 178.30 2giw h LYS 7 N -0.74 0.98 -0.01 4.80 3.64 0.05 0.12 116.57 125.41 2giw h LYS 7 Ca -0.01 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2giw h LYS 7 Cb 0.69 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 2giw h LYS 7 CO -0.12 0.65 -0.02 0.87 -2.27 0.00 0.00 179.45 178.56 2giw h LYS 8 N 1.01 0.03 -0.31 1.90 1.79 -0.48 -0.32 116.57 120.19 2giw h LYS 8 Ca 0.42 -0.02 -0.13 0.00 -2.18 0.00 0.00 60.65 58.74 2giw h LYS 8 Cb 0.25 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 2giw h LYS 8 CO -0.20 0.58 -0.33 0.82 -1.08 0.00 0.00 179.45 179.25 2giw h ILE 9 N -0.51 1.28 0.02 1.86 1.08 -0.81 -0.43 117.51 120.00 2giw h ILE 9 Ca 0.00 -1.46 0.00 0.00 -0.39 0.00 0.00 64.86 63.01 2giw h ILE 9 Cb 0.58 1.39 -0.00 0.00 -3.07 0.00 0.00 36.82 35.72 2giw h ILE 9 CO 0.00 0.47 -0.04 0.15 -0.69 0.00 0.00 178.15 178.05 2giw h PHE 10 N 0.58 -0.10 -0.96 1.37 3.04 -0.80 -2.83 116.94 117.23 2giw h PHE 10 Ca 0.06 0.00 0.19 0.00 3.98 0.00 0.00 57.97 62.20 2giw h PHE 10 Cb 0.84 0.04 -0.09 0.00 2.56 0.00 0.00 35.95 39.30 2giw h PHE 10 CO 0.04 -0.04 0.61 0.28 -2.02 0.00 0.00 178.31 177.18 2giw h VAL 11 N -0.06 0.72 -0.77 1.41 2.07 -0.72 0.71 116.25 119.61 2giw h VAL 11 Ca -0.00 -0.22 0.15 0.00 0.82 0.00 0.00 66.70 67.45 2giw h VAL 11 Cb 0.06 0.02 -0.10 0.00 -1.52 0.00 0.00 31.29 29.75 2giw h VAL 11 CO -0.01 0.12 0.30 1.56 0.02 0.00 0.00 177.57 179.56 2giw h GLN 12 N 0.65 0.42 0.00 1.57 1.08 -1.04 -3.34 115.11 114.45 2giw h GLN 12 Ca 0.52 -0.03 -0.04 0.00 -1.45 0.00 0.00 58.65 57.66 2giw h GLN 12 Cb 0.96 -0.10 -0.08 0.00 -0.05 0.00 0.00 27.48 28.21 2giw h GLN 12 CO -0.28 0.28 -0.56 0.36 -0.95 0.00 0.00 178.83 177.68 2giw n LYS 13 N -5.01 0.00 0.00 1.46 0.00 1.00 -4.89 118.16 110.72 2giw n LYS 13 Ca 0.15 -1.11 0.00 0.00 -0.00 0.00 0.00 58.31 57.34 2giw n LYS 13 Cb 0.44 -0.33 0.00 0.00 -0.00 0.00 0.00 35.03 35.14 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 2.42 -1.20 0.00 0.00 -1.67 0.11 119.26 118.92 2giw h ALA 15 Ca 0.00 0.01 0.36 0.00 0.00 0.00 0.00 54.91 55.28 2giw h ALA 15 Cb 0.74 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.42 2giw h ALA 15 CO 0.00 -0.70 0.77 -0.56 0.00 0.00 0.00 179.25 178.76 2giw h GLN 16 N 0.27 0.20 0.00 0.00 3.07 -1.88 -1.24 115.11 115.54 2giw h GLN 16 Ca 0.47 -0.01 -0.01 0.00 0.09 0.00 0.00 58.65 59.19 2giw h GLN 16 Cb 1.38 -0.05 -0.00 0.00 0.08 0.00 0.00 27.48 28.89 2giw h GLN 16 CO -0.13 0.14 -1.59 0.00 0.09 0.00 0.00 178.83 177.34 2giw n HIS 18 N -1.96 -0.46 -1.08 0.00 8.25 0.16 -1.43 115.22 118.70 2giw n HIS 18 Ca -0.03 -3.45 -0.22 0.00 -0.26 0.00 0.00 57.72 53.76 2giw n HIS 18 Cb 0.35 0.01 -0.11 0.00 1.12 0.00 0.00 29.99 31.37 2giw n HIS 18 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2giw n THR 19 N 2.30 3.41 -2.24 1.59 -1.04 -1.18 -3.99 114.28 113.13 2giw n THR 19 Ca 0.27 -1.87 -0.32 0.00 -2.04 0.00 0.00 64.05 60.08 2giw n THR 19 Cb 0.49 -2.23 -0.04 0.00 -1.82 0.00 0.00 70.33 66.73 2giw n THR 19 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2giw s VAL 20 N 1.57 3.64 0.00 12.58 0.11 -1.26 -3.74 120.40 133.30 2giw s VAL 20 Ca 0.66 -0.60 0.00 0.00 -2.93 0.00 0.00 61.98 59.10 2giw s VAL 20 Cb 0.25 -4.45 0.00 0.00 -1.53 0.00 0.00 36.38 30.66 2giw s VAL 20 CO -0.02 -1.33 0.00 -0.62 -3.33 0.00 0.00 175.10 169.80 2giw n GLU 21 N 8.81 0.00 -2.74 1.54 1.02 -1.26 -4.97 120.64 123.03 2giw n GLU 21 Ca 0.38 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.51 2giw n GLU 21 Cb 0.48 -0.62 0.09 0.00 -0.02 0.00 0.00 31.44 31.37 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 -2.11 1.49 -2.25 3.49 2.85 -1.26 -5.00 118.16 115.37 2giw n LYS 22 Ca 0.00 -2.22 -0.01 0.00 -1.05 0.00 0.00 58.31 55.02 2giw n LYS 22 Cb 0.22 -0.46 0.00 0.00 -0.65 0.00 0.00 35.03 34.15 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 -1.06 -0.85 0.00 2.58 0.00 -1.26 -5.08 105.19 99.52 2giw n GLY 23 Ca -0.06 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -1.07 0.93 3.19 -0.02 0.00 -1.25 -5.11 105.19 101.87 2giw n GLY 24 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 0.30 0.88 -0.04 1.61 2.47 -1.26 -5.04 119.74 118.65 2giw s LYS 25 Ca 0.00 -1.18 -0.01 0.00 -1.56 0.00 0.00 55.97 53.22 2giw s LYS 25 Cb 0.00 0.29 -0.01 0.00 -1.46 0.00 0.00 37.83 36.66 2giw s LYS 25 CO 0.00 -0.26 0.08 0.45 0.16 0.00 0.00 175.35 175.78 2giw h HIS 26 N 2.83 -0.03 0.00 4.03 3.86 -1.89 -3.40 115.15 120.55 2giw h HIS 26 Ca -0.34 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.87 2giw h HIS 26 Cb 1.19 0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.67 2giw h HIS 26 CO 0.45 -0.02 0.00 1.17 0.86 0.00 0.00 177.93 180.39 2giw n LYS 27 N -3.12 0.00 0.00 2.45 0.00 -1.26 -2.34 118.16 113.88 2giw n LYS 27 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2giw n LYS 27 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.04 2giw n LYS 27 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2giw n THR 28 N 0.00 0.00 -3.66 3.15 -1.04 -1.26 -5.06 114.28 106.40 2giw n THR 28 Ca 0.00 -0.14 -0.15 0.00 -2.04 0.00 0.00 64.05 61.72 2giw n THR 28 Cb 0.00 1.42 -0.08 0.00 -1.82 0.00 0.00 70.33 69.85 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 -0.12 -0.33 0.14 3.41 0.00 -0.51 -4.92 107.32 104.98 2giw s GLY 29 Ca 0.00 0.79 -0.31 0.00 0.00 0.00 0.00 44.72 45.20 2giw s GLY 29 CO 0.00 0.52 1.73 2.56 0.00 0.00 0.00 173.10 177.91 2giw s PRO 30 N -1.16 4.16 -0.98 2.90 0.04 -1.26 -4.25 135.00 134.45 2giw s PRO 30 Ca -0.12 2.50 -0.27 0.00 0.04 0.00 0.00 61.00 63.16 2giw s PRO 30 Cb -0.03 -3.42 -0.20 0.00 0.04 0.00 0.00 34.50 30.89 2giw s PRO 30 CO 0.06 -0.76 2.22 1.21 0.04 0.00 0.00 177.00 179.77 2giw s ASN 31 N 2.08 3.53 0.00 6.66 2.47 -1.26 -4.79 114.94 123.62 2giw s ASN 31 Ca 0.76 -0.61 0.00 0.00 0.42 0.00 0.00 52.86 53.44 2giw s ASN 31 Cb -0.45 -2.58 0.00 0.00 -1.45 0.00 0.00 41.25 36.77 2giw s ASN 31 CO 0.34 -4.52 0.31 0.18 -3.72 0.00 0.00 177.10 169.68 2giw n LEU 32 N 19.54 0.00 -3.66 3.21 4.77 -1.26 -4.80 117.00 134.80 2giw n LEU 32 Ca 0.43 0.31 -0.21 0.00 -0.03 0.00 0.00 56.01 56.51 2giw n LEU 32 Cb 0.46 -0.15 0.01 0.00 -2.33 0.00 0.00 43.42 41.40 2giw n LEU 32 CO 0.57 -0.15 -0.11 1.57 -1.33 0.00 0.00 177.39 177.95 2giw n HIS 33 N -2.24 -0.85 0.00 -1.77 -0.00 -1.26 -4.48 115.22 104.62 2giw n HIS 33 Ca 0.00 0.17 0.00 0.00 0.46 0.00 0.00 57.72 58.35 2giw n HIS 33 Cb 0.00 -1.45 0.00 0.00 -0.12 0.00 0.00 29.99 28.42 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 -1.39 1.87 0.92 1.57 0.00 -1.26 -5.04 105.19 101.86 2giw n GLY 34 Ca -0.10 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 -4.47 0.99 4.32 -1.26 -4.85 117.00 111.72 2giw n LEU 35 Ca 0.00 0.00 -0.57 0.00 -0.02 0.00 0.00 56.01 55.42 2giw n LEU 35 Cb 0.00 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.71 2giw n LEU 35 CO 0.00 -0.38 1.60 0.49 -1.22 0.00 0.00 177.39 177.89 2giw n PHE 36 N -2.13 1.58 -0.55 -1.77 3.72 -1.08 -0.28 117.46 116.95 2giw n PHE 36 Ca 0.00 0.59 0.00 0.00 -0.05 0.00 0.00 57.45 57.99 2giw n PHE 36 Cb 0.00 -2.41 0.00 0.00 -0.94 0.00 0.00 39.48 36.13 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 6.08 0.75 3.07 1.37 0.00 -0.70 -5.02 105.19 110.74 2giw n GLY 37 Ca 0.41 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.45 2.61 0.12 1.61 3.52 0.62 -5.01 118.95 121.96 2giw s ARG 38 Ca 0.00 -0.71 -0.32 0.00 -0.13 0.00 0.00 55.73 54.57 2giw s ARG 38 Cb 0.00 -2.35 -0.11 0.00 -1.56 0.00 0.00 34.95 30.93 2giw s ARG 38 CO 0.00 -0.24 1.82 0.36 -0.81 0.00 0.00 175.30 176.43 2giw n LYS 39 N 4.69 2.72 0.00 5.12 2.85 -1.26 -3.36 118.16 128.91 2giw n LYS 39 Ca -0.19 0.99 0.00 0.00 -1.05 0.00 0.00 58.31 58.06 2giw n LYS 39 Cb 0.50 -2.87 0.00 0.00 -0.65 0.00 0.00 35.03 32.01 2giw n LYS 39 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2giw n THR 40 N 4.60 0.00 -0.99 0.58 5.66 0.06 -4.78 114.28 119.41 2giw n THR 40 Ca 0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.18 2giw n THR 40 Cb 0.36 -0.90 0.00 0.00 -1.55 0.00 0.00 70.33 68.24 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 0.40 0.00 1.09 0.00 -1.26 -4.45 105.19 105.97 2giw n GLY 41 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 2giw n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2giw n GLN 42 N -2.92 0.00 -3.61 1.61 6.02 -1.26 -4.77 117.38 112.45 2giw n GLN 42 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.71 2giw n GLN 42 Cb 0.01 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.15 2giw n GLN 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2giw s ALA 43 N 0.00 2.01 -0.11 -1.58 0.00 -1.26 -5.02 121.76 115.79 2giw s ALA 43 Ca 0.00 -2.64 -0.29 0.00 0.00 0.00 0.00 51.96 49.03 2giw s ALA 43 Cb 0.00 -1.80 -0.06 0.00 0.00 0.00 0.00 23.12 21.26 2giw s ALA 43 CO 0.00 -2.05 1.85 -1.25 0.00 0.00 0.00 175.76 174.31 2giw s PRO 44 N 0.08 3.83 0.00 0.00 0.04 -1.26 -0.15 135.00 137.54 2giw s PRO 44 Ca 0.23 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.39 2giw s PRO 44 Cb -0.12 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.28 2giw s PRO 44 CO -0.08 -1.28 0.00 0.41 0.04 0.00 0.00 177.00 176.08 2giw n GLY 45 N 4.76 2.13 0.91 0.56 0.00 -1.26 -4.89 105.19 107.40 2giw n GLY 45 Ca 0.21 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.31 -0.55 1.61 7.35 -0.95 -5.11 117.46 119.50 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 0.23 0.00 0.00 0.35 0.00 0.00 39.48 40.06 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 -1.96 0.00 -3.75 -2.13 5.66 0.79 -5.00 114.28 107.90 2giw n THR 47 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 2giw n THR 47 Cb 0.00 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 68.79 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 0.00 -1.95 -1.54 1.09 0.18 -1.26 -4.90 117.16 108.78 2giw n TYR 48 Ca 0.00 -1.69 -0.40 0.00 1.88 0.00 0.00 57.90 57.69 2giw n TYR 48 Cb 0.00 0.71 0.02 0.00 -0.38 0.00 0.00 39.34 39.69 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 -0.46 2.46 -0.32 -3.48 -2.24 -1.26 -4.66 114.28 104.32 2giw n THR 49 Ca -0.06 -0.50 0.23 0.00 -2.27 0.00 0.00 64.05 61.45 2giw n THR 49 Cb 0.50 -0.90 0.45 0.00 -2.10 0.00 0.00 70.33 68.28 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 0.88 0.23 -0.77 3.42 2.03 -1.96 0.20 116.42 120.46 2giw h ASP 50 Ca -0.44 0.22 0.09 0.00 -0.73 0.00 0.00 57.03 56.17 2giw h ASP 50 Cb 1.37 0.25 -0.05 0.00 -0.83 0.00 0.00 39.33 40.07 2giw h ASP 50 CO 0.52 -0.26 0.50 0.00 -1.03 0.00 0.00 179.24 178.98 2giw h ALA 51 N 1.90 1.76 0.12 4.15 0.00 -1.87 0.33 119.26 125.64 2giw h ALA 51 Ca 0.72 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 55.28 2giw h ALA 51 Cb 1.68 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2giw h ALA 51 CO -0.70 0.09 -1.80 -0.91 0.00 0.00 0.00 179.25 175.92 2giw h ASN 52 N 0.72 0.39 -0.49 0.00 4.21 -1.55 -3.38 115.58 115.48 2giw h ASN 52 Ca 0.35 -0.72 -0.05 0.00 1.21 0.00 0.00 56.30 57.08 2giw h ASN 52 Cb 0.40 -0.13 -0.02 0.00 -1.12 0.00 0.00 38.32 37.45 2giw h ASN 52 CO -0.13 1.63 0.13 0.50 -1.29 0.00 0.00 177.43 178.27 2giw h LYS 53 N 0.07 0.84 0.00 0.81 3.64 0.29 -0.85 116.57 121.37 2giw h LYS 53 Ca -0.35 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 58.84 2giw h LYS 53 Cb 2.04 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 33.73 2giw h LYS 53 CO 0.12 0.76 -0.10 -0.97 -2.27 0.00 0.00 179.45 177.00 2giw h ASN 54 N 0.81 0.00 0.11 4.20 -0.73 -0.59 -3.38 115.58 116.00 2giw h ASN 54 Ca 0.18 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.34 2giw h ASN 54 Cb 0.30 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.89 2giw h ASN 54 CO -0.00 0.10 -0.05 0.50 -0.37 0.00 0.00 177.43 177.60 2giw h LYS 55 N 0.00 -0.14 -5.84 6.67 1.63 -1.32 -3.48 116.57 114.09 2giw h LYS 55 Ca -0.00 0.01 -0.34 0.00 -0.85 0.00 0.00 60.65 59.46 2giw h LYS 55 Cb 0.37 0.03 0.14 0.00 -0.60 0.00 0.00 32.23 32.17 2giw h LYS 55 CO 0.01 0.30 -0.89 0.41 -3.45 0.00 0.00 179.45 175.83 2giw n GLY 56 N 0.19 -1.02 3.64 5.01 0.00 -1.26 -4.99 105.19 106.76 2giw n GLY 56 Ca -0.09 0.49 -0.25 0.00 0.00 0.00 0.00 46.02 46.18 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 -3.44 2.63 -0.31 -0.61 -4.36 -1.26 -4.83 121.20 109.02 2giw s ILE 57 Ca 0.43 -1.96 0.03 0.00 -0.26 0.00 0.00 60.65 58.89 2giw s ILE 57 Cb -0.10 -2.81 0.34 0.00 1.25 0.00 0.00 42.46 41.14 2giw s ILE 57 CO 0.80 -0.19 1.37 0.41 0.24 0.00 0.00 174.94 177.57 2giw n THR 58 N -0.96 1.91 -2.63 8.37 -1.04 -1.26 -0.76 114.28 117.90 2giw n THR 58 Ca -0.04 -0.88 0.00 0.00 -2.04 0.00 0.00 64.05 61.09 2giw n THR 58 Cb 0.62 -0.66 0.00 0.00 -1.82 0.00 0.00 70.33 68.47 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 -2.19 -1.42 5.03 -1.21 -1.72 117.44 115.76 2giw n TRP 59 Ca 0.26 0.00 -0.27 0.00 3.03 0.00 0.00 57.50 60.52 2giw n TRP 59 Cb 0.99 0.00 0.06 0.00 -1.03 0.00 0.00 31.31 31.33 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 -2.86 2.37 0.22 -0.99 -2.85 -1.26 -2.64 119.74 111.74 2giw s LYS 60 Ca 0.00 -0.11 -0.08 0.00 -1.00 0.00 0.00 55.97 54.78 2giw s LYS 60 Cb 0.00 -2.16 0.33 0.00 -2.06 0.00 0.00 37.83 33.95 2giw s LYS 60 CO 0.00 -1.15 1.73 1.05 0.10 0.00 0.00 175.35 177.08 2giw h GLU 61 N -0.56 0.38 -0.17 1.78 4.11 -1.95 -0.08 114.58 118.09 2giw h GLU 61 Ca -0.45 -0.02 0.03 0.00 0.07 0.00 0.00 59.36 58.99 2giw h GLU 61 Cb 1.30 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 2giw h GLU 61 CO 0.61 0.25 -0.04 0.93 0.07 0.00 0.00 179.01 180.84 2giw h GLU 62 N 0.39 0.00 -0.25 1.06 5.08 -1.99 0.12 114.58 119.00 2giw h GLU 62 Ca 0.34 -0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.54 2giw h GLU 62 Cb 0.47 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2giw h GLU 62 CO -0.35 0.00 -0.46 1.79 -1.00 0.00 0.00 179.01 178.99 2giw h THR 63 N 0.00 1.30 -0.55 1.13 1.35 -1.83 -2.14 112.91 112.18 2giw h THR 63 Ca 0.08 -1.66 0.07 0.00 -0.55 0.00 0.00 66.41 64.35 2giw h THR 63 Cb 0.12 1.74 -0.06 0.00 -1.73 0.00 0.00 68.15 68.22 2giw h THR 63 CO -0.17 0.53 0.21 -0.07 -0.25 0.00 0.00 175.52 175.77 2giw h LEU 64 N 0.48 0.23 0.23 3.87 4.07 -0.72 -0.89 115.31 122.58 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 1.06 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.83 2giw h LEU 64 CO 0.10 0.16 -0.18 -0.03 -1.08 0.00 0.00 178.44 177.40 2giw h MET 65 N 0.41 -0.41 -0.29 1.13 4.05 -0.45 0.35 114.93 119.71 2giw h MET 65 Ca 0.27 0.03 0.03 0.00 -0.28 0.00 0.00 59.70 59.74 2giw h MET 65 Cb 0.28 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.15 2giw h MET 65 CO -0.26 -0.27 0.11 1.49 0.23 0.00 0.00 176.91 178.21 2giw h GLU 66 N -0.42 0.24 0.67 0.39 4.81 -1.19 -0.63 114.58 118.46 2giw h GLU 66 Ca -0.01 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2giw h GLU 66 Cb 0.38 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 2giw h GLU 66 CO -0.02 0.16 -0.43 -0.92 -0.73 0.00 0.00 179.01 177.08 2giw h TYR 67 N 0.25 -1.14 -0.87 0.92 3.20 -0.91 -0.63 116.97 117.79 2giw h TYR 67 Ca 0.13 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.08 2giw h TYR 67 Cb 0.09 0.41 -0.07 0.00 1.54 0.00 0.00 36.73 38.69 2giw h TYR 67 CO -0.12 -0.63 0.52 -0.07 -1.64 0.00 0.00 178.16 176.21 2giw h LEU 68 N -1.03 0.76 -0.67 2.82 -0.00 -0.87 0.15 115.31 116.47 2giw h LEU 68 Ca -0.09 0.04 -0.02 0.00 -0.00 0.00 0.00 57.88 57.81 2giw h LEU 68 Cb 0.83 -0.11 -0.03 0.00 -0.00 0.00 0.00 40.66 41.35 2giw h LEU 68 CO 0.08 0.44 0.36 -0.08 -0.00 0.00 0.00 178.44 179.24 2giw h GLU 69 N 0.87 0.95 -1.11 1.13 4.81 -0.95 -3.38 114.58 116.90 2giw h GLU 69 Ca 0.41 -0.12 -0.37 0.00 -0.13 0.00 0.00 59.36 59.16 2giw h GLU 69 Cb 0.34 -0.18 -0.25 0.00 0.63 0.00 0.00 28.75 29.28 2giw h GLU 69 CO -0.23 0.72 -0.75 -1.71 -0.73 0.00 0.00 179.01 176.31 2giw n ASN 70 N -4.50 -1.71 -0.11 1.04 2.85 -0.26 -4.47 115.26 108.10 2giw n ASN 70 Ca 0.05 -2.92 -0.12 0.00 -0.11 0.00 0.00 54.58 51.48 2giw n ASN 70 Cb 0.10 0.73 -0.03 0.00 1.24 0.00 0.00 39.78 41.81 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 4.39 0.69 0.00 1.20 0.13 -0.96 0.40 132.00 137.85 2giw h PRO 71 Ca 0.01 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2giw h PRO 71 Cb 0.98 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2giw h PRO 71 CO 0.32 0.89 0.00 1.63 -0.23 0.00 0.00 178.00 180.61 2giw n LYS 72 N -4.36 0.25 -0.12 0.86 4.01 -1.26 -1.31 118.16 116.23 2giw n LYS 72 Ca -0.03 0.12 -0.21 0.00 -0.51 0.00 0.00 58.31 57.68 2giw n LYS 72 Cb 0.38 -1.50 -0.10 0.00 -0.51 0.00 0.00 35.03 33.30 2giw n LYS 72 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2giw n LYS 73 N -1.24 0.58 -0.14 1.97 0.00 -0.08 -4.41 118.16 114.84 2giw n LYS 73 Ca 0.08 0.18 -0.04 0.00 0.00 0.00 0.00 58.31 58.53 2giw n LYS 73 Cb 0.10 -1.45 0.03 0.00 0.00 0.00 0.00 35.03 33.71 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 -0.39 -0.25 -4.06 5.64 3.20 -0.90 -3.42 116.97 116.79 2giw h TYR 74 Ca -0.59 0.04 -0.67 0.00 3.14 0.00 0.00 58.73 60.65 2giw h TYR 74 Cb 1.72 0.18 -0.31 0.00 1.54 0.00 0.00 36.73 39.86 2giw h TYR 74 CO -0.02 -0.20 -0.88 0.42 -1.64 0.00 0.00 178.16 175.84 2giw s ILE 75 N -6.22 1.96 -1.23 1.81 1.01 -0.43 -5.06 121.20 113.04 2giw s ILE 75 Ca -0.14 -1.02 -0.20 0.00 0.00 0.00 0.00 60.65 59.29 2giw s ILE 75 Cb 0.16 -1.66 -0.01 0.00 0.01 0.00 0.00 42.46 40.96 2giw s ILE 75 CO 0.71 0.55 1.86 -0.81 0.00 0.00 0.00 174.94 177.26 2giw n PRO 76 N 2.92 2.43 -0.31 2.79 -0.04 -1.26 -4.11 135.00 137.42 2giw n PRO 76 Ca -0.17 -2.82 0.00 0.00 -0.04 0.00 0.00 63.50 60.46 2giw n PRO 76 Cb 0.52 -3.54 0.00 0.00 -0.04 0.00 0.00 33.50 30.44 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 5.41 0.80 3.80 0.55 0.00 -1.26 -4.82 105.19 109.67 2giw n GLY 77 Ca 0.48 -0.69 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.21 3.98 -2.00 2.61 -1.32 -1.26 -4.76 115.64 110.68 2giw s THR 78 Ca 0.00 1.32 0.12 0.00 -1.21 0.00 0.00 61.69 61.92 2giw s THR 78 Cb 0.00 -3.59 0.32 0.00 -1.51 0.00 0.00 72.50 67.73 2giw s THR 78 CO 0.00 -0.18 1.44 1.17 -2.21 0.00 0.00 174.62 174.84 2giw n LYS 79 N -0.56 1.02 0.05 7.08 4.81 -1.26 -4.18 118.16 125.12 2giw n LYS 79 Ca 0.07 -0.03 0.01 0.00 -0.87 0.00 0.00 58.31 57.49 2giw n LYS 79 Cb 0.52 -1.18 0.35 0.00 0.02 0.00 0.00 35.03 34.74 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 0.06 0.40 -6.15 1.64 4.05 -1.92 -3.48 114.93 109.52 2giw h MET 80 Ca 0.00 -0.08 -0.30 0.00 -0.28 0.00 0.00 59.70 59.04 2giw h MET 80 Cb 0.01 -0.06 0.02 0.00 -0.80 0.00 0.00 31.60 30.77 2giw h MET 80 CO 0.00 0.46 -0.67 -0.89 0.23 0.00 0.00 176.91 176.04 2giw n ILE 81 N -4.29 -6.31 -3.80 1.77 2.08 -1.26 -5.01 119.36 102.54 2giw n ILE 81 Ca 0.01 -0.29 -0.10 0.00 0.56 0.00 0.00 62.75 62.93 2giw n ILE 81 Cb 0.24 -4.66 -0.07 0.00 -0.75 0.00 0.00 39.64 34.40 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 -3.09 0.02 -0.42 1.39 5.36 -1.26 -5.12 117.98 114.85 2giw s PHE 82 Ca 0.10 -0.31 0.00 0.00 -0.96 0.00 0.00 56.93 55.76 2giw s PHE 82 Cb -0.04 0.03 0.21 0.00 -0.34 0.00 0.00 43.02 42.88 2giw s PHE 82 CO 0.84 -0.53 0.95 0.00 -1.46 0.00 0.00 175.22 175.02 2giw n ALA 83 N 0.26 -2.80 -0.15 11.12 0.00 -1.26 -4.61 120.51 123.07 2giw n ALA 83 Ca -0.17 -0.54 0.02 0.00 0.00 0.00 0.00 53.44 52.75 2giw n ALA 83 Cb 0.61 -2.40 -0.01 0.00 0.00 0.00 0.00 19.45 17.65 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 2.52 -2.22 0.00 0.00 0.00 -1.26 -5.03 105.19 99.20 2giw n GLY 84 Ca 0.13 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.56 0.00 0.01 -0.61 3.06 -1.26 -5.07 119.36 112.93 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 0.07 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.25 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 -1.32 0.00 0.05 9.51 4.81 -1.26 -5.10 118.16 124.86 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 -0.01 0.00 0.00 0.02 0.00 0.00 35.03 35.04 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 -2.55 0.00 0.00 1.64 3.00 -1.26 -5.04 118.16 113.94 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 0.36 0.00 0.00 0.00 177.40 177.76 2giw n LYS 88 N -2.68 0.00 -0.33 1.64 2.85 -1.26 -4.96 118.16 113.42 2giw n LYS 88 Ca 0.00 0.00 0.16 0.00 -1.05 0.00 0.00 58.31 57.42 2giw n LYS 88 Cb 0.00 0.00 0.36 0.00 -0.65 0.00 0.00 35.03 34.74 2giw n LYS 88 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 2giw h THR 89 N 0.00 0.53 -0.93 0.58 2.02 -2.01 0.11 112.91 113.21 2giw h THR 89 Ca 0.00 -0.18 0.18 0.00 0.77 0.00 0.00 66.41 67.17 2giw h THR 89 Cb 0.00 -0.06 -0.17 0.00 -1.74 0.00 0.00 68.15 66.18 2giw h THR 89 CO 0.00 0.10 -0.26 -1.84 0.37 0.00 0.00 175.52 173.88 2giw n GLU 90 N -4.93 -0.12 -0.16 6.66 0.28 -1.26 -0.08 120.64 121.03 2giw n GLU 90 Ca 0.25 1.45 0.27 0.00 -0.16 0.00 0.00 57.16 58.97 2giw n GLU 90 Cb 0.71 -2.16 0.72 0.00 1.43 0.00 0.00 31.44 32.14 2giw n GLU 90 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 177.13 177.04 2giw h ARG 91 N 0.00 0.01 0.04 3.44 -0.00 -1.17 0.11 114.38 116.81 2giw h ARG 91 Ca 0.42 -0.00 -0.38 0.00 -0.00 0.00 0.00 59.98 60.02 2giw h ARG 91 Cb 0.65 -0.00 -0.05 0.00 -0.00 0.00 0.00 29.97 30.57 2giw h ARG 91 CO -0.95 0.01 -2.25 -1.91 -0.00 0.00 0.00 179.97 174.87 2giw n GLU 92 N -4.29 0.68 0.47 0.08 4.07 0.32 -4.09 120.64 117.88 2giw n GLU 92 Ca 0.18 0.23 -0.19 0.00 -0.06 0.00 0.00 57.16 57.32 2giw n GLU 92 Cb 0.92 -1.60 -0.09 0.00 -0.06 0.00 0.00 31.44 30.62 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 -0.14 -1.02 -0.58 4.31 1.82 0.79 -1.11 116.42 120.50 2giw h ASP 93 Ca -0.52 0.04 0.07 0.00 -0.39 0.00 0.00 57.03 56.22 2giw h ASP 93 Cb 1.88 0.26 -0.06 0.00 0.68 0.00 0.00 39.33 42.10 2giw h ASP 93 CO -0.07 -0.68 0.26 -0.07 -1.61 0.00 0.00 179.24 177.06 2giw h LEU 94 N -1.31 0.32 0.00 2.28 -0.00 -1.09 0.16 115.31 115.68 2giw h LEU 94 Ca -0.12 0.05 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2giw h LEU 94 Cb 0.93 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.59 2giw h LEU 94 CO 0.20 0.21 0.00 -0.38 -0.00 0.00 0.00 178.44 178.47 2giw n ILE 95 N -4.93 0.36 -0.12 1.22 -0.00 -1.17 -0.91 119.36 113.81 2giw n ILE 95 Ca 0.07 0.09 -0.26 0.00 -0.00 0.00 0.00 62.75 62.65 2giw n ILE 95 Cb 0.21 -0.77 -0.11 0.00 -0.00 0.00 0.00 39.64 38.97 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 -1.25 1.10 -0.02 -1.39 0.00 -0.12 -3.80 120.51 115.03 2giw n ALA 96 Ca 0.10 -0.93 -0.13 0.00 0.00 0.00 0.00 53.44 52.48 2giw n ALA 96 Cb 0.14 -0.10 -0.07 0.00 0.00 0.00 0.00 19.45 19.42 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 -0.85 -1.37 0.00 0.00 3.20 -0.80 -1.49 116.97 115.67 2giw h TYR 97 Ca -0.59 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.33 2giw h TYR 97 Cb 1.59 0.62 0.00 0.00 1.54 0.00 0.00 36.73 40.48 2giw h TYR 97 CO -0.02 -0.50 0.00 -0.07 -1.64 0.00 0.00 178.16 175.93 2giw h LEU 98 N -0.50 0.00 -1.17 2.82 3.38 -1.23 0.27 115.31 118.88 2giw h LEU 98 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2giw h LEU 98 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2giw h LEU 98 CO -0.44 0.00 0.00 0.50 0.09 0.00 0.00 178.44 178.59 2giw h LYS 99 N 0.00 0.00 0.00 1.13 3.64 -1.37 -2.76 116.57 117.22 2giw h LYS 99 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2giw h LYS 99 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2giw h LYS 99 CO 0.00 0.00 -1.47 0.36 -2.27 0.00 0.00 179.45 176.07 2giw n LYS 100 N -2.97 0.44 0.07 1.90 2.85 0.00 -4.61 118.16 115.84 2giw n LYS 100 Ca 0.01 -0.10 -0.01 0.00 -1.05 0.00 0.00 58.31 57.17 2giw n LYS 100 Cb 0.33 -1.26 0.29 0.00 -0.65 0.00 0.00 35.03 33.74 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 1.03 1.28 0.00 0.58 0.00 -0.31 0.59 119.26 122.44 2giw h ALA 101 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2giw h ALA 101 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2giw h ALA 101 CO 0.00 0.48 0.00 0.25 0.00 0.00 0.00 179.25 179.98 2giw n THR 102 N -4.17 1.17 -2.94 0.00 -2.24 -1.06 -3.70 114.28 101.34 2giw n THR 102 Ca -0.01 0.40 -0.14 0.00 -2.27 0.00 0.00 64.05 62.04 2giw n THR 102 Cb 0.36 -1.32 0.02 0.00 -2.10 0.00 0.00 70.33 67.29 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 -1.89 -1.25 0.00 3.42 5.15 0.06 -4.67 115.26 116.08 2giw n ASN 103 Ca 0.01 -3.23 0.00 0.00 -0.60 0.00 0.00 54.58 50.77 2giw n ASN 103 Cb 0.12 0.79 0.00 0.00 -0.53 0.00 0.00 39.78 40.16 2giw n ASN 103 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82