#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 6.58 0.27 1.61 1.11 -1.26 -4.60 116.67 120.39 2giw s ASP 2 Ca 0.00 0.70 0.01 0.00 0.18 0.00 0.00 52.55 53.44 2giw s ASP 2 Cb 0.00 -2.15 0.37 0.00 1.07 0.00 0.00 42.92 42.21 2giw s ASP 2 CO 0.00 0.37 1.71 -0.37 1.18 0.00 0.00 175.17 178.05 2giw h VAL 3 N 3.86 1.27 0.54 -1.27 -1.51 -1.86 0.19 116.25 117.46 2giw h VAL 3 Ca -0.53 -1.28 -0.03 0.00 -1.23 0.00 0.00 66.70 63.63 2giw h VAL 3 Cb 1.22 1.33 0.01 0.00 -2.13 0.00 0.00 31.29 31.72 2giw h VAL 3 CO 0.60 0.41 -0.26 -0.33 -1.23 0.00 0.00 177.57 176.76 2giw h GLU 4 N 0.46 -0.69 -0.51 5.19 4.39 -1.94 0.80 114.58 122.28 2giw h GLU 4 Ca 0.07 0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 2giw h GLU 4 Cb 0.68 0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 2giw h GLU 4 CO 0.05 -0.41 0.22 0.87 -1.16 0.00 0.00 179.01 178.58 2giw h LYS 5 N -0.87 0.76 -0.12 2.33 1.57 -1.91 -2.65 116.57 115.68 2giw h LYS 5 Ca -0.07 -0.13 0.05 0.00 -1.87 0.00 0.00 60.65 58.62 2giw h LYS 5 Cb 0.61 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.74 2giw h LYS 5 CO 0.12 0.66 -0.23 0.78 -0.57 0.00 0.00 179.45 180.21 2giw h GLY 6 N 0.69 -0.24 1.22 3.86 0.00 -0.46 0.07 103.07 108.22 2giw h GLY 6 Ca 0.17 0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.74 2giw h GLY 6 CO -0.02 -0.19 0.23 0.07 0.00 0.00 0.00 176.54 176.63 2giw h LYS 7 N -0.30 0.99 0.10 4.80 2.10 -0.78 0.87 116.57 124.36 2giw h LYS 7 Ca 0.10 -0.19 -0.00 0.00 -2.00 0.00 0.00 60.65 58.56 2giw h LYS 7 Cb 0.44 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 2giw h LYS 7 CO -0.29 0.84 -0.05 0.87 -2.00 0.00 0.00 179.45 178.82 2giw h LYS 8 N 0.96 -0.13 -0.07 0.07 1.79 -1.07 -0.96 116.57 117.16 2giw h LYS 8 Ca 0.22 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.67 2giw h LYS 8 Cb 0.24 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2giw h LYS 8 CO -0.01 0.15 -0.05 0.82 -1.08 0.00 0.00 179.45 179.28 2giw h ILE 9 N -0.40 1.34 -0.23 1.86 2.04 -0.77 0.11 117.51 121.45 2giw h ILE 9 Ca -0.01 -1.11 0.02 0.00 1.00 0.00 0.00 64.86 64.76 2giw h ILE 9 Cb 0.34 1.92 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 2giw h ILE 9 CO 0.02 0.31 -0.22 0.15 0.00 0.00 0.00 178.15 178.41 2giw h PHE 10 N -0.23 -0.69 -0.92 1.37 3.57 -0.90 -1.57 116.94 117.57 2giw h PHE 10 Ca 0.02 0.04 0.15 0.00 3.53 0.00 0.00 57.97 61.71 2giw h PHE 10 Cb 0.51 0.33 -0.08 0.00 2.79 0.00 0.00 35.95 39.51 2giw h PHE 10 CO 0.08 -0.18 0.59 0.28 -2.23 0.00 0.00 178.31 176.85 2giw h VAL 11 N -0.11 0.81 -0.58 1.41 2.07 -0.96 0.72 116.25 119.61 2giw h VAL 11 Ca 0.04 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.36 2giw h VAL 11 Cb 0.21 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.00 2giw h VAL 11 CO -0.28 0.13 0.38 -0.61 0.02 0.00 0.00 177.57 177.22 2giw h GLN 12 N 0.70 0.63 0.00 1.57 4.15 0.12 -3.31 115.11 118.97 2giw h GLN 12 Ca 0.47 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.81 2giw h GLN 12 Cb 0.77 -0.14 -0.09 0.00 0.21 0.00 0.00 27.48 28.23 2giw h GLN 12 CO -0.23 0.42 -0.49 0.36 -1.93 0.00 0.00 178.83 176.96 2giw n LYS 13 N -4.47 0.00 0.00 1.69 -0.00 0.32 -4.89 118.16 110.82 2giw n LYS 13 Ca 0.07 -1.00 0.00 0.00 -0.00 0.00 0.00 58.31 57.38 2giw n LYS 13 Cb 0.16 -0.21 0.00 0.00 -0.00 0.00 0.00 35.03 34.97 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 2.52 -1.24 0.00 0.00 -1.62 0.42 119.26 119.35 2giw h ALA 15 Ca 0.00 -0.02 0.40 0.00 0.00 0.00 0.00 54.91 55.29 2giw h ALA 15 Cb 0.14 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 17.85 2giw h ALA 15 CO 0.00 -0.70 0.79 -0.56 0.00 0.00 0.00 179.25 178.78 2giw h GLN 16 N 0.00 0.14 0.00 0.00 3.07 -1.89 -1.97 115.11 114.46 2giw h GLN 16 Ca 0.27 -0.01 -0.27 0.00 0.09 0.00 0.00 58.65 58.73 2giw h GLN 16 Cb 1.08 -0.03 -0.05 0.00 0.08 0.00 0.00 27.48 28.56 2giw h GLN 16 CO -0.00 0.09 -2.01 0.00 0.09 0.00 0.00 178.83 177.00 2giw n HIS 18 N -2.65 1.45 -1.50 0.00 8.25 -0.22 -3.42 115.22 117.13 2giw n HIS 18 Ca -0.26 -3.85 -0.40 0.00 -0.26 0.00 0.00 57.72 52.95 2giw n HIS 18 Cb 0.95 -0.29 -0.02 0.00 1.12 0.00 0.00 29.99 31.75 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 1.97 3.77 -2.63 1.59 -1.04 -1.10 -4.09 114.28 112.75 2giw n THR 19 Ca 0.25 -2.74 -0.42 0.00 -2.04 0.00 0.00 64.05 59.10 2giw n THR 19 Cb 0.43 -2.59 -0.02 0.00 -1.82 0.00 0.00 70.33 66.32 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 2.80 4.13 -0.36 12.58 0.11 -1.26 -3.68 120.40 134.71 2giw s VAL 20 Ca 0.57 -1.28 0.13 0.00 -2.93 0.00 0.00 61.98 58.47 2giw s VAL 20 Cb 0.16 -5.06 0.42 0.00 -1.53 0.00 0.00 36.38 30.37 2giw s VAL 20 CO -0.07 -1.90 1.29 -0.62 -3.33 0.00 0.00 175.10 170.47 2giw n GLU 21 N 8.31 1.26 -3.90 1.54 1.02 -1.26 -4.98 120.64 122.63 2giw n GLU 21 Ca 0.37 -2.14 -0.28 0.00 -0.02 0.00 0.00 57.16 55.09 2giw n GLU 21 Cb 0.49 -0.33 0.01 0.00 -0.02 0.00 0.00 31.44 31.59 2giw n GLU 21 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2giw n LYS 22 N -0.66 -4.73 -2.67 3.49 5.02 -1.26 -4.87 118.16 112.48 2giw n LYS 22 Ca -0.02 0.55 -0.05 0.00 -2.02 0.00 0.00 58.31 56.77 2giw n LYS 22 Cb 0.85 -5.20 0.07 0.00 -0.02 0.00 0.00 35.03 30.72 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 -1.67 -1.64 1.01 0.72 0.00 -1.26 -5.17 105.19 97.19 2giw n GLY 23 Ca -0.11 0.97 -0.04 0.00 0.00 0.00 0.00 46.02 46.84 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 1.62 2.80 3.17 -0.02 0.00 -1.24 -4.89 105.19 106.62 2giw n GLY 24 Ca 0.03 -1.44 -0.10 0.00 0.00 0.00 0.00 46.02 44.51 2giw n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2giw s LYS 25 N -2.23 1.01 -0.53 1.61 3.01 -1.26 -5.06 119.74 116.28 2giw s LYS 25 Ca 0.09 -1.49 -0.07 0.00 -1.01 0.00 0.00 55.97 53.48 2giw s LYS 25 Cb -0.00 0.25 -0.21 0.00 -1.01 0.00 0.00 37.83 36.86 2giw s LYS 25 CO 0.06 -0.30 3.39 0.72 0.51 0.00 0.00 175.35 179.73 2giw n HIS 26 N -0.15 0.79 -3.01 3.18 8.25 -1.26 -4.52 115.22 118.51 2giw n HIS 26 Ca -0.03 -2.02 -0.44 0.00 -0.26 0.00 0.00 57.72 54.97 2giw n HIS 26 Cb 0.64 -1.89 -0.04 0.00 1.12 0.00 0.00 29.99 29.83 2giw n HIS 26 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2giw s LYS 27 N 1.40 3.26 -1.29 -0.41 2.20 -1.26 -4.20 119.74 119.45 2giw s LYS 27 Ca 0.68 -1.41 0.00 0.00 -0.36 0.00 0.00 55.97 54.88 2giw s LYS 27 Cb 0.27 -4.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.14 2giw s LYS 27 CO -0.02 -1.66 0.00 2.41 -0.36 0.00 0.00 175.35 175.72 2giw n THR 28 N 5.51 -0.71 0.00 3.43 -1.04 -1.26 -4.51 114.28 115.70 2giw n THR 28 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 2giw n THR 28 Cb 0.45 -2.28 0.00 0.00 -1.82 0.00 0.00 70.33 66.68 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 -1.02 2.68 3.76 3.41 0.00 -1.22 -4.78 105.19 108.02 2giw n GLY 29 Ca -0.18 0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 4.61 0.08 1.61 0.04 -1.26 -4.28 135.00 135.80 2giw s PRO 30 Ca 0.00 1.71 -0.31 0.00 0.04 0.00 0.00 61.00 62.45 2giw s PRO 30 Cb 0.00 -3.11 -0.08 0.00 0.04 0.00 0.00 34.50 31.35 2giw s PRO 30 CO 0.00 0.21 1.56 -0.80 0.04 0.00 0.00 177.00 178.01 2giw s ASN 31 N -1.02 6.67 -1.37 6.66 0.02 -1.26 -4.80 114.94 119.84 2giw s ASN 31 Ca 0.46 2.42 -0.09 0.00 -1.02 0.00 0.00 52.86 54.63 2giw s ASN 31 Cb -0.30 -2.57 -0.11 0.00 0.02 0.00 0.00 41.25 38.30 2giw s ASN 31 CO 0.38 -0.81 2.95 0.18 0.02 0.00 0.00 177.10 179.81 2giw n LEU 32 N 5.04 7.96 0.22 0.60 4.77 -1.26 -4.67 117.00 129.66 2giw n LEU 32 Ca 0.14 -4.07 0.05 0.00 -0.03 0.00 0.00 56.01 52.11 2giw n LEU 32 Cb 0.41 -1.49 0.49 0.00 -2.33 0.00 0.00 43.42 40.50 2giw n LEU 32 CO 0.61 1.88 0.86 -0.74 -1.33 0.00 0.00 177.39 178.67 2giw h HIS 33 N 4.91 0.00 -0.48 -1.77 2.76 -1.89 -3.38 115.15 115.29 2giw h HIS 33 Ca 0.76 0.00 0.08 0.00 -2.20 0.00 0.00 60.37 59.01 2giw h HIS 33 Cb 0.41 0.00 -0.18 0.00 1.55 0.00 0.00 27.41 29.18 2giw h HIS 33 CO 1.88 0.23 -0.21 0.20 -1.30 0.00 0.00 177.93 178.73 2giw s GLY 34 N -4.22 -1.37 -0.03 5.26 0.00 -1.26 -4.58 107.32 101.11 2giw s GLY 34 Ca -0.03 1.08 -0.01 0.00 0.00 0.00 0.00 44.72 45.76 2giw s GLY 34 CO 0.69 4.07 -0.02 1.41 0.00 0.00 0.00 173.10 179.25 2giw h LEU 35 N 6.26 0.00 -8.44 0.66 -0.00 -1.86 -3.42 115.31 108.50 2giw h LEU 35 Ca -0.02 0.00 -0.63 0.00 -0.00 0.00 0.00 57.88 57.23 2giw h LEU 35 Cb 1.21 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.84 2giw h LEU 35 CO -0.02 0.18 1.49 0.49 -0.00 0.00 0.00 178.44 180.58 2giw n PHE 36 N -2.88 1.41 -1.77 1.13 3.72 -1.13 -1.18 117.46 116.76 2giw n PHE 36 Ca -0.01 0.30 0.00 0.00 -0.05 0.00 0.00 57.45 57.70 2giw n PHE 36 Cb 0.03 -2.51 0.00 0.00 -0.94 0.00 0.00 39.48 36.06 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 6.54 0.95 3.02 1.37 0.00 -0.79 -5.04 105.19 111.25 2giw n GLY 37 Ca 0.45 -0.48 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.53 0.17 -0.40 1.61 0.52 -0.32 -5.06 118.95 111.94 2giw s ARG 38 Ca 0.00 0.60 -0.28 0.00 -0.52 0.00 0.00 55.73 55.53 2giw s ARG 38 Cb 0.00 -0.10 -0.01 0.00 0.52 0.00 0.00 34.95 35.35 2giw s ARG 38 CO 0.00 -0.21 1.75 -1.59 0.02 0.00 0.00 175.30 175.27 2giw s LYS 39 N 1.68 3.23 0.00 3.54 -2.85 -1.26 -3.82 119.74 120.26 2giw s LYS 39 Ca -0.05 1.18 0.00 0.00 -1.00 0.00 0.00 55.97 56.10 2giw s LYS 39 Cb -0.11 -4.21 0.00 0.00 -2.06 0.00 0.00 37.83 31.45 2giw s LYS 39 CO -0.08 -1.99 0.00 -2.37 0.10 0.00 0.00 175.35 171.01 2giw n THR 40 N 7.32 0.00 -1.64 3.79 5.66 0.02 -4.71 114.28 124.72 2giw n THR 40 Ca 0.21 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.21 2giw n THR 40 Cb 0.48 -1.21 0.00 0.00 -1.55 0.00 0.00 70.33 68.05 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 3.03 0.55 0.00 1.09 0.00 -1.26 -4.50 105.19 104.11 2giw n GLY 41 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.25 0.00 -3.33 1.61 6.02 -1.26 -4.80 117.38 114.37 2giw n GLN 42 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 2giw n GLN 42 Cb 0.38 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.65 2giw n GLN 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2giw n ALA 43 N -3.00 -2.66 -1.92 -1.58 0.00 -1.26 -4.20 120.51 105.90 2giw n ALA 43 Ca 0.00 0.21 -0.32 0.00 0.00 0.00 0.00 53.44 53.34 2giw n ALA 43 Cb 0.00 -1.85 -0.06 0.00 0.00 0.00 0.00 19.45 17.54 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 -1.44 1.64 0.01 0.00 -0.04 -1.26 -1.40 135.00 132.51 2giw n PRO 44 Ca -0.09 -2.39 0.00 0.00 -0.04 0.00 0.00 63.50 60.98 2giw n PRO 44 Cb 0.59 -3.58 0.00 0.00 -0.04 0.00 0.00 33.50 30.47 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 5.54 -1.98 0.13 0.55 0.00 -1.26 -4.96 105.19 103.21 2giw n GLY 45 Ca 0.46 0.68 -0.22 0.00 0.00 0.00 0.00 46.02 46.94 2giw n GLY 45 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2giw h PHE 46 N 0.00 0.43 -0.01 1.61 3.57 -1.91 -3.50 116.94 117.12 2giw h PHE 46 Ca 0.00 -0.31 0.00 0.00 3.53 0.00 0.00 57.97 61.19 2giw h PHE 46 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.72 2giw h PHE 46 CO 0.00 1.74 0.00 -2.37 -2.23 0.00 0.00 178.31 175.45 2giw n THR 47 N -3.64 0.00 -3.41 4.41 5.66 -0.50 -5.02 114.28 111.78 2giw n THR 47 Ca -0.31 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 60.66 2giw n THR 47 Cb 0.99 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.77 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 -0.97 -1.04 1.09 4.11 -1.26 -4.98 117.16 114.11 2giw n TYR 48 Ca 0.00 -0.44 -0.35 0.00 -0.00 0.00 0.00 57.90 57.11 2giw n TYR 48 Cb 0.00 0.16 0.09 0.00 -0.00 0.00 0.00 39.34 39.59 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 -0.12 0.94 -0.22 -3.48 -2.24 -1.26 -4.74 114.28 103.16 2giw n THR 49 Ca -0.01 -0.30 0.07 0.00 -2.27 0.00 0.00 64.05 61.54 2giw n THR 49 Cb 0.12 -0.69 0.34 0.00 -2.10 0.00 0.00 70.33 68.00 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 -0.95 0.71 -0.02 3.42 3.58 -1.96 0.19 116.42 121.38 2giw h ASP 50 Ca -0.45 0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.04 2giw h ASP 50 Cb 1.31 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 42.20 2giw h ASP 50 CO 0.38 0.44 -0.11 0.00 -2.88 0.00 0.00 179.24 177.07 2giw h ALA 51 N 1.58 -0.10 0.01 -0.78 0.00 -1.87 0.38 119.26 118.47 2giw h ALA 51 Ca 0.36 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.09 2giw h ALA 51 Cb 0.34 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2giw h ALA 51 CO -0.13 -0.59 -0.91 -0.97 0.00 0.00 0.00 179.25 176.65 2giw h ASN 52 N -0.18 0.07 -0.52 0.00 -1.24 -1.83 -3.28 115.58 108.61 2giw h ASN 52 Ca 0.05 -0.07 -0.12 0.00 0.71 0.00 0.00 56.30 56.88 2giw h ASN 52 Cb 0.24 -0.02 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 2giw h ASN 52 CO -0.13 0.94 -0.13 0.50 -1.29 0.00 0.00 177.43 177.32 2giw h LYS 53 N 0.02 1.01 0.00 6.67 3.64 -0.24 -2.16 116.57 125.52 2giw h LYS 53 Ca -0.02 -0.39 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 2giw h LYS 53 Cb 1.58 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.35 2giw h LYS 53 CO 0.12 1.07 0.00 -1.71 -2.27 0.00 0.00 179.45 176.66 2giw n ASN 54 N -4.16 0.11 -0.03 4.20 5.15 0.13 -3.98 115.26 116.68 2giw n ASN 54 Ca 0.01 0.53 -0.12 0.00 -0.60 0.00 0.00 54.58 54.40 2giw n ASN 54 Cb 0.41 -0.55 -0.06 0.00 -0.53 0.00 0.00 39.78 39.05 2giw n ASN 54 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 2giw h LYS 55 N 0.00 0.19 -6.00 1.20 1.63 -1.44 -3.48 116.57 108.66 2giw h LYS 55 Ca 0.00 -0.04 -0.22 0.00 -0.85 0.00 0.00 60.65 59.53 2giw h LYS 55 Cb 0.21 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 2giw h LYS 55 CO 0.00 0.35 -0.66 0.41 -3.45 0.00 0.00 179.45 176.10 2giw n GLY 56 N -0.51 -1.02 3.22 5.01 0.00 -1.26 -5.02 105.19 105.62 2giw n GLY 56 Ca -0.06 0.80 -0.13 0.00 0.00 0.00 0.00 46.02 46.63 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 -2.64 0.20 -2.22 -0.61 -4.36 -1.26 -4.94 121.20 105.37 2giw s ILE 57 Ca 0.12 -1.98 0.19 0.00 -0.26 0.00 0.00 60.65 58.71 2giw s ILE 57 Cb -0.02 -2.44 0.42 0.00 1.25 0.00 0.00 42.46 41.68 2giw s ILE 57 CO 0.82 -0.10 1.45 0.41 0.24 0.00 0.00 174.94 177.76 2giw n THR 58 N -0.29 0.36 -3.71 8.37 -1.04 -1.26 -0.80 114.28 115.91 2giw n THR 58 Ca -0.00 -0.47 -0.26 0.00 -2.04 0.00 0.00 64.05 61.28 2giw n THR 58 Cb 0.66 0.43 0.00 0.00 -1.82 0.00 0.00 70.33 69.60 2giw n THR 58 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2giw n TRP 59 N 0.61 -1.57 -3.07 -1.42 5.03 -1.25 -1.89 117.44 113.89 2giw n TRP 59 Ca 0.16 0.54 -0.19 0.00 3.03 0.00 0.00 57.50 61.04 2giw n TRP 59 Cb 0.38 -2.31 0.05 0.00 -1.03 0.00 0.00 31.31 28.40 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 -5.13 2.39 0.00 -0.99 -2.85 -1.26 -2.85 119.74 109.05 2giw s LYS 60 Ca 0.10 -1.59 -0.02 0.00 -1.00 0.00 0.00 55.97 53.46 2giw s LYS 60 Cb -0.06 -2.65 -0.07 0.00 -2.06 0.00 0.00 37.83 32.99 2giw s LYS 60 CO 0.77 -0.75 1.87 -0.85 0.10 0.00 0.00 175.35 176.49 2giw n GLU 61 N -2.16 0.95 0.10 1.78 0.00 -1.26 -1.53 120.64 118.52 2giw n GLU 61 Ca 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 57.16 57.02 2giw n GLU 61 Cb 0.61 -1.44 0.00 0.00 0.00 0.00 0.00 31.44 30.61 2giw n GLU 61 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2giw n GLU 62 N 2.07 0.00 -0.12 3.44 1.02 -1.26 -4.72 120.64 121.06 2giw n GLU 62 Ca 0.12 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.14 2giw n GLU 62 Cb 0.46 -0.01 -0.02 0.00 -0.02 0.00 0.00 31.44 31.84 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 1.28 -0.51 2.62 1.35 -1.82 -1.04 112.91 114.78 2giw h THR 63 Ca 0.00 -1.40 0.01 0.00 -0.55 0.00 0.00 66.41 64.47 2giw h THR 63 Cb 0.01 1.36 -0.03 0.00 -1.73 0.00 0.00 68.15 67.77 2giw h THR 63 CO 0.00 0.46 0.34 -0.07 -0.25 0.00 0.00 175.52 176.00 2giw h LEU 64 N 0.63 0.58 0.41 3.87 4.07 -1.60 -0.68 115.31 122.59 2giw h LEU 64 Ca 0.08 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 2giw h LEU 64 Cb 0.81 -0.14 -0.02 0.00 1.08 0.00 0.00 40.66 42.39 2giw h LEU 64 CO 0.07 0.42 -0.42 0.24 -1.08 0.00 0.00 178.44 177.67 2giw h MET 65 N 0.69 -0.82 -0.43 1.13 2.86 -1.72 -0.52 114.93 116.11 2giw h MET 65 Ca 0.19 0.06 0.06 0.00 -2.06 0.00 0.00 59.70 57.95 2giw h MET 65 Cb -0.07 0.19 -0.05 0.00 0.06 0.00 0.00 31.60 31.72 2giw h MET 65 CO -0.05 -0.55 0.12 1.49 1.06 0.00 0.00 176.91 178.99 2giw h GLU 66 N -0.85 0.26 0.41 1.72 4.81 -1.08 -0.39 114.58 119.46 2giw h GLU 66 Ca -0.04 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2giw h GLU 66 Cb 0.76 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2giw h GLU 66 CO -0.07 0.17 -0.34 -0.92 -0.73 0.00 0.00 179.01 177.12 2giw h TYR 67 N 0.27 -0.94 -0.32 0.92 3.20 -0.94 0.25 116.97 119.41 2giw h TYR 67 Ca 0.21 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 2giw h TYR 67 Cb 0.23 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 2giw h TYR 67 CO -0.18 -0.47 0.18 -0.07 -1.64 0.00 0.00 178.16 175.98 2giw h LEU 68 N -0.73 0.37 -0.96 2.82 -0.00 -0.92 0.26 115.31 116.15 2giw h LEU 68 Ca -0.05 -0.02 -0.09 0.00 -0.00 0.00 0.00 57.88 57.72 2giw h LEU 68 Cb 0.62 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 41.17 2giw h LEU 68 CO -0.00 0.30 -0.17 -0.08 -0.00 0.00 0.00 178.44 178.48 2giw h GLU 69 N 0.43 0.56 -0.15 1.13 4.57 -0.89 -3.41 114.58 116.82 2giw h GLU 69 Ca 0.11 -0.19 -0.21 0.00 -1.18 0.00 0.00 59.36 57.90 2giw h GLU 69 Cb 0.00 -0.05 -0.14 0.00 -0.16 0.00 0.00 28.75 28.40 2giw h GLU 69 CO -0.02 0.71 -0.48 -1.71 -1.18 0.00 0.00 179.01 176.33 2giw n ASN 70 N -4.16 -2.97 0.00 1.04 2.85 0.06 -4.67 115.26 107.42 2giw n ASN 70 Ca 0.00 -3.23 -0.17 0.00 -0.11 0.00 0.00 54.58 51.07 2giw n ASN 70 Cb 0.37 1.81 -0.10 0.00 1.24 0.00 0.00 39.78 43.09 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 4.14 0.47 0.00 1.20 0.13 -0.75 -0.14 132.00 137.05 2giw h PRO 71 Ca -0.12 -0.48 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 2giw h PRO 71 Cb 1.04 0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2giw h PRO 71 CO 0.27 1.12 0.01 0.87 -0.23 0.00 0.00 178.00 180.05 2giw h LYS 72 N 0.01 0.00 0.01 0.86 1.57 -1.76 -0.73 116.57 116.53 2giw h LYS 72 Ca -0.07 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.43 2giw h LYS 72 Cb 1.33 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.60 2giw h LYS 72 CO 0.13 0.00 -1.49 1.17 -0.57 0.00 0.00 179.45 178.69 2giw n LYS 73 N -2.48 0.58 -0.33 3.15 3.00 -0.82 -4.32 118.16 116.94 2giw n LYS 73 Ca -0.02 0.51 0.11 0.00 -0.00 0.00 0.00 58.31 58.92 2giw n LYS 73 Cb 0.06 -1.71 0.32 0.00 0.00 0.00 0.00 35.03 33.70 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 -0.93 1.01 -3.20 5.64 3.20 -0.50 -3.38 116.97 118.82 2giw h TYR 74 Ca -0.40 0.03 -0.56 0.00 3.14 0.00 0.00 58.73 60.94 2giw h TYR 74 Cb 1.40 -0.31 -0.36 0.00 1.54 0.00 0.00 36.73 38.99 2giw h TYR 74 CO 0.07 0.32 -0.82 0.42 -1.64 0.00 0.00 178.16 176.51 2giw s ILE 75 N -5.83 1.30 -1.22 1.81 1.01 -0.33 -5.07 121.20 112.88 2giw s ILE 75 Ca -0.11 -0.48 -0.20 0.00 0.00 0.00 0.00 60.65 59.86 2giw s ILE 75 Cb 0.23 -1.24 -0.02 0.00 0.01 0.00 0.00 42.46 41.44 2giw s ILE 75 CO 0.80 0.41 1.88 -0.81 0.00 0.00 0.00 174.94 177.22 2giw n PRO 76 N 4.65 2.34 0.00 2.79 -0.04 -1.26 -3.72 135.00 139.76 2giw n PRO 76 Ca -0.16 -2.75 0.00 0.00 -0.04 0.00 0.00 63.50 60.55 2giw n PRO 76 Cb 0.50 -3.53 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 5.37 0.83 3.80 0.55 0.00 -1.26 -4.81 105.19 109.67 2giw n GLY 77 Ca 0.48 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.73 3.90 -1.82 2.61 -1.32 -1.24 -4.65 115.64 111.38 2giw s THR 78 Ca 0.00 1.12 0.29 0.00 -1.21 0.00 0.00 61.69 61.89 2giw s THR 78 Cb 0.00 -3.47 0.72 0.00 -1.51 0.00 0.00 72.50 68.24 2giw s THR 78 CO 0.00 -0.31 2.04 1.17 -2.21 0.00 0.00 174.62 175.31 2giw n LYS 79 N -1.12 0.75 0.17 7.08 3.00 -1.26 -4.09 118.16 122.68 2giw n LYS 79 Ca 0.09 0.01 0.04 0.00 -0.00 0.00 0.00 58.31 58.45 2giw n LYS 79 Cb 0.53 -1.50 0.47 0.00 0.00 0.00 0.00 35.03 34.52 2giw n LYS 79 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.40 179.38 2giw h MET 80 N 0.00 0.14 -6.05 1.64 4.05 -1.92 -3.48 114.93 109.32 2giw h MET 80 Ca 0.00 -0.03 -0.29 0.00 -0.28 0.00 0.00 59.70 59.10 2giw h MET 80 Cb 0.08 -0.02 0.04 0.00 -0.80 0.00 0.00 31.60 30.90 2giw h MET 80 CO 0.00 0.26 -0.66 -0.89 0.23 0.00 0.00 176.91 175.84 2giw n ILE 81 N -4.34 -6.79 -3.83 1.77 2.08 -1.26 -5.02 119.36 101.97 2giw n ILE 81 Ca -0.01 -0.47 -0.09 0.00 0.56 0.00 0.00 62.75 62.73 2giw n ILE 81 Cb 0.22 -4.94 -0.06 0.00 -0.75 0.00 0.00 39.64 34.11 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 -3.17 0.12 0.00 1.39 5.36 -1.26 -5.10 117.98 115.32 2giw s PHE 82 Ca 0.18 -0.50 0.00 0.00 -0.96 0.00 0.00 56.93 55.65 2giw s PHE 82 Cb -0.06 0.05 0.00 0.00 -0.34 0.00 0.00 43.02 42.67 2giw s PHE 82 CO 0.83 -0.67 0.00 0.00 -1.46 0.00 0.00 175.22 173.92 2giw n ALA 83 N -0.17 1.66 -3.18 11.12 0.00 -1.26 -4.05 120.51 124.63 2giw n ALA 83 Ca -0.13 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 2giw n ALA 83 Cb 0.63 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.04 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 -3.53 0.78 0.14 0.00 0.00 -1.26 -4.24 107.32 99.21 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 -0.69 0.00 4.51 0.00 0.00 0.00 173.10 176.92 2giw n ILE 85 N -0.45 0.48 0.00 0.90 3.06 -1.26 -5.09 119.36 116.99 2giw n ILE 85 Ca -0.02 0.16 0.00 0.00 -2.50 0.00 0.00 62.75 60.39 2giw n ILE 85 Cb 0.61 -0.93 0.00 0.00 0.54 0.00 0.00 39.64 39.87 2giw n ILE 85 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2giw n LYS 86 N -3.23 0.00 0.05 9.51 4.76 -1.26 -5.06 118.16 122.94 2giw n LYS 86 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2giw n LYS 86 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2giw n LYS 86 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2giw n LYS 87 N -2.18 0.00 0.01 1.97 3.00 -1.26 -5.05 118.16 114.65 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 -2.64 0.00 -0.25 1.64 2.85 -1.26 -4.99 118.16 113.51 2giw n LYS 88 Ca 0.00 0.00 -0.01 0.00 -1.05 0.00 0.00 58.31 57.25 2giw n LYS 88 Cb 0.00 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.43 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 0.19 -0.92 0.58 2.02 -1.99 0.21 112.91 113.01 2giw h THR 89 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2giw h THR 89 Cb 0.00 0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 66.56 2giw h THR 89 CO 0.00 0.00 0.54 -0.08 0.37 0.00 0.00 175.52 176.35 2giw h GLU 90 N -0.06 1.26 -0.89 6.66 4.81 -1.97 0.17 114.58 124.55 2giw h GLU 90 Ca 0.31 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2giw h GLU 90 Cb 0.56 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2giw h GLU 90 CO -0.76 0.89 0.00 -2.13 -0.73 0.00 0.00 179.01 176.28 2giw n ARG 91 N -4.36 0.93 0.00 1.92 0.00 0.70 -0.80 116.66 115.05 2giw n ARG 91 Ca 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 2giw n ARG 91 Cb 0.07 -1.45 0.00 0.00 0.00 0.00 0.00 32.46 31.08 2giw n ARG 91 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2giw n GLU 92 N 0.01 0.00 0.51 -0.14 4.07 0.21 -4.49 120.64 120.81 2giw n GLU 92 Ca 0.00 0.00 -0.20 0.00 -0.06 0.00 0.00 57.16 56.90 2giw n GLU 92 Cb 0.22 -0.54 -0.10 0.00 -0.06 0.00 0.00 31.44 30.96 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 -1.09 -0.29 4.31 3.32 -0.68 0.34 116.42 122.32 2giw h ASP 93 Ca 0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2giw h ASP 93 Cb 0.78 0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 2giw h ASP 93 CO 0.00 -0.78 0.19 0.25 -1.72 0.00 0.00 179.24 177.19 2giw h LEU 94 N -1.30 0.34 -0.56 1.55 6.46 -1.19 0.25 115.31 120.85 2giw h LEU 94 Ca -0.13 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.62 2giw h LEU 94 Cb 0.99 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.84 2giw h LEU 94 CO 0.22 0.25 0.00 -0.38 -0.62 0.00 0.00 178.44 177.90 2giw n ILE 95 N -4.88 1.06 -0.05 4.05 2.08 -1.24 -1.13 119.36 119.24 2giw n ILE 95 Ca -0.02 0.36 -0.21 0.00 0.56 0.00 0.00 62.75 63.44 2giw n ILE 95 Cb 0.03 -1.26 -0.13 0.00 -0.75 0.00 0.00 39.64 37.53 2giw n ILE 95 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2giw h ALA 96 N 2.25 0.28 -0.33 -1.39 0.00 -0.57 -3.25 119.26 116.24 2giw h ALA 96 Ca 0.00 -1.20 0.07 0.00 0.00 0.00 0.00 54.91 53.78 2giw h ALA 96 Cb 0.22 0.64 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 2giw h ALA 96 CO 0.00 0.85 -0.30 -0.92 0.00 0.00 0.00 179.25 178.88 2giw h TYR 97 N -0.58 -0.83 0.00 0.00 3.20 -0.29 -1.03 116.97 117.44 2giw h TYR 97 Ca -0.34 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.58 2giw h TYR 97 Cb 1.58 0.41 -0.00 0.00 1.54 0.00 0.00 36.73 40.26 2giw h TYR 97 CO 0.11 -0.37 -0.00 -0.07 -1.64 0.00 0.00 178.16 176.18 2giw h LEU 98 N -0.27 0.00 0.00 2.82 3.38 -1.25 0.14 115.31 120.13 2giw h LEU 98 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2giw h LEU 98 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2giw h LEU 98 CO -0.48 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.35 2giw n LYS 99 N -3.48 0.41 0.00 1.13 5.02 -0.39 -2.30 118.16 118.55 2giw n LYS 99 Ca -0.03 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2giw n LYS 99 Cb 0.09 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2giw n LYS 99 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2giw n LYS 100 N -1.17 2.47 -0.28 1.97 -0.00 0.27 -4.72 118.16 116.69 2giw n LYS 100 Ca 0.11 0.00 0.08 0.00 -0.00 0.00 0.00 58.31 58.50 2giw n LYS 100 Cb 0.12 -0.96 0.23 0.00 -0.00 0.00 0.00 35.03 34.41 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 0.00 1.21 0.00 0.58 0.00 -0.81 0.52 119.26 120.76 2giw h ALA 101 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2giw h ALA 101 Cb 0.93 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2giw h ALA 101 CO 0.00 -0.21 0.00 0.25 0.00 0.00 0.00 179.25 179.29 2giw n THR 102 N -4.98 0.16 -0.02 0.00 -2.24 -0.97 -3.33 114.28 102.90 2giw n THR 102 Ca 0.17 0.04 -0.02 0.00 -2.27 0.00 0.00 64.05 61.97 2giw n THR 102 Cb 0.48 -0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 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 -1.14 3.99 0.00 3.42 5.15 0.01 -4.47 115.26 122.22 2giw n ASN 103 Ca 0.14 -0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.19 2giw n ASN 103 Cb 0.12 0.55 0.42 0.00 -0.53 0.00 0.00 39.78 40.34 2giw n ASN 103 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82