#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g9o s MET 10 N 0.00 0.98 0.63 0.00 1.00 -1.26 -5.14 119.30 115.51 1g9o s MET 10 Ca 0.00 -1.27 -0.17 0.00 0.00 0.00 0.00 55.69 54.25 1g9o s MET 10 Cb 0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 34.83 34.09 1g9o s MET 10 CO 0.00 0.12 1.16 -0.51 0.00 0.00 0.00 175.02 175.79 1g9o s LEU 11 N -2.64 3.53 0.70 -0.03 1.43 -1.26 -4.91 118.68 115.50 1g9o s LEU 11 Ca 0.10 2.21 -0.15 0.00 -1.03 0.00 0.00 54.13 55.26 1g9o s LEU 11 Cb -0.02 -4.58 0.02 0.00 0.03 0.00 0.00 46.19 41.64 1g9o s LEU 11 CO 0.02 -1.65 1.18 -2.84 0.23 0.00 0.00 176.35 173.28 1g9o s PRO 12 N -3.68 2.36 -0.01 1.29 0.02 -1.26 -4.76 135.00 128.97 1g9o s PRO 12 Ca 0.72 1.65 0.04 0.00 0.02 0.00 0.00 61.00 63.43 1g9o s PRO 12 Cb -0.25 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.38 1g9o s PRO 12 CO 0.37 -1.64 -0.13 0.50 -0.33 0.00 0.00 177.00 175.77 1g9o s ARG 13 N -3.94 1.04 -0.19 5.54 3.52 0.74 -4.93 118.95 120.73 1g9o s ARG 13 Ca 0.72 -0.45 -0.14 0.00 -0.13 0.00 0.00 55.73 55.74 1g9o s ARG 13 Cb -0.26 -1.00 -0.05 0.00 -1.56 0.00 0.00 34.95 32.08 1g9o s ARG 13 CO 0.43 0.27 0.29 -1.17 -0.81 0.00 0.00 175.30 174.31 1g9o s LEU 14 N -0.28 4.19 -0.17 -0.88 2.96 -1.26 -0.52 118.68 122.72 1g9o s LEU 14 Ca 0.05 0.42 -0.00 0.00 -0.22 0.00 0.00 54.13 54.37 1g9o s LEU 14 Cb -0.05 -2.34 0.00 0.00 0.50 0.00 0.00 46.19 44.30 1g9o s LEU 14 CO -0.00 0.05 -0.14 0.00 -1.32 0.00 0.00 176.35 174.94 1g9o s LEU 17 N 1.39 4.38 -0.27 0.00 1.02 -0.19 -4.73 118.68 120.29 1g9o s LEU 17 Ca 0.01 0.58 -0.09 0.00 0.02 0.00 0.00 54.13 54.65 1g9o s LEU 17 Cb -0.21 -2.23 -0.03 0.00 0.02 0.00 0.00 46.19 43.74 1g9o s LEU 17 CO 0.02 0.34 0.12 -0.70 0.02 0.00 0.00 176.35 176.15 1g9o s GLU 18 N -0.78 3.72 0.31 1.70 2.12 -1.26 -1.59 118.70 122.92 1g9o s GLU 18 Ca 0.17 -0.45 -0.30 0.00 0.36 0.00 0.00 54.97 54.75 1g9o s GLU 18 Cb -0.13 -3.46 -0.12 0.00 0.26 0.00 0.00 34.13 30.68 1g9o s GLU 18 CO 0.06 -0.21 1.56 1.17 -0.54 0.00 0.00 175.26 177.29 1g9o n LYS 19 N 4.98 2.64 -2.13 4.30 4.81 -0.23 -4.70 118.16 127.83 1g9o n LYS 19 Ca -0.15 0.94 -0.09 0.00 -0.87 0.00 0.00 58.31 58.14 1g9o n LYS 19 Cb 0.51 -2.70 0.01 0.00 0.02 0.00 0.00 35.03 32.88 1g9o n LYS 19 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1g9o n GLY 20 N 1.79 2.59 0.43 3.14 0.00 -0.52 -4.95 105.19 107.68 1g9o n GLY 20 Ca 0.07 -2.20 0.25 0.00 0.00 0.00 0.00 46.02 44.14 1g9o n GLY 20 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1g9o h PRO 21 N 0.00 0.29 -0.07 1.61 0.13 -2.01 -1.75 132.00 130.21 1g9o h PRO 21 Ca -0.12 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1g9o h PRO 21 Cb 0.46 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.53 1g9o h PRO 21 CO 0.18 0.19 0.00 0.09 -0.23 0.00 0.00 178.00 178.23 1g9o n ASN 22 N -4.51 2.39 0.00 1.44 5.03 -1.26 -5.11 115.26 113.24 1g9o n ASN 22 Ca 0.24 -2.43 0.00 0.00 0.87 0.00 0.00 54.58 53.26 1g9o n ASN 22 Cb 0.91 -0.21 0.00 0.00 -1.02 0.00 0.00 39.78 39.46 1g9o n ASN 22 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1g9o n GLY 23 N -0.67 0.18 0.09 7.41 0.00 -0.66 -4.71 105.19 106.83 1g9o n GLY 23 Ca 0.08 -2.16 -0.03 0.00 0.00 0.00 0.00 46.02 43.91 1g9o n GLY 23 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1g9o h TYR 24 N 0.00 0.00 -0.39 1.61 0.05 -1.92 -1.38 116.97 114.94 1g9o h TYR 24 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1g9o h TYR 24 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1g9o h TYR 24 CO 0.00 0.72 0.00 0.41 -1.05 0.00 0.00 178.16 178.24 1g9o n GLY 25 N 1.42 0.63 3.24 3.88 0.00 -1.26 -1.82 105.19 111.28 1g9o n GLY 25 Ca -0.10 -0.79 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 1g9o n GLY 25 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1g9o s PHE 26 N -2.39 1.34 0.02 1.61 -0.71 -1.26 -0.87 117.98 115.72 1g9o s PHE 26 Ca 0.00 -1.38 0.04 0.00 -1.04 0.00 0.00 56.93 54.55 1g9o s PHE 26 Cb 0.00 -0.67 -0.02 0.00 -1.21 0.00 0.00 43.02 41.13 1g9o s PHE 26 CO 0.00 -0.61 -0.11 -1.01 -1.34 0.00 0.00 175.22 172.15 1g9o s HIS 27 N -3.95 1.01 0.15 3.49 3.76 -0.60 -4.99 115.29 114.16 1g9o s HIS 27 Ca 0.39 -0.28 0.10 0.00 -0.15 0.00 0.00 55.06 55.11 1g9o s HIS 27 Cb 0.06 -0.62 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 1g9o s HIS 27 CO 0.15 -0.00 -0.19 -0.51 -0.85 0.00 0.00 174.74 173.34 1g9o s LEU 28 N -0.77 2.64 0.16 0.89 1.43 -1.26 -0.15 118.68 121.62 1g9o s LEU 28 Ca 0.01 -0.66 -0.24 0.00 -1.03 0.00 0.00 54.13 52.21 1g9o s LEU 28 Cb -0.06 -1.44 0.06 0.00 0.03 0.00 0.00 46.19 44.78 1g9o s LEU 28 CO 0.00 0.15 0.77 -1.38 0.23 0.00 0.00 176.35 176.12 1g9o s HIS 29 N -1.36 -0.32 0.88 0.29 -3.43 -0.60 -4.82 115.29 105.94 1g9o s HIS 29 Ca 0.19 0.03 -0.10 0.00 -0.80 0.00 0.00 55.06 54.39 1g9o s HIS 29 Cb -0.10 0.61 0.18 0.00 -1.43 0.00 0.00 32.58 31.85 1g9o s HIS 29 CO 0.10 -0.89 1.20 0.20 -2.00 0.00 0.00 174.74 173.35 1g9o s GLY 30 N -2.78 1.78 0.09 -1.38 0.00 -1.26 -0.03 107.32 103.74 1g9o s GLY 30 Ca 0.07 -1.51 0.05 0.00 0.00 0.00 0.00 44.72 43.33 1g9o s GLY 30 CO -0.03 -0.79 -0.14 -0.54 0.00 0.00 0.00 173.10 171.59 1g9o s GLU 31 N -5.60 0.90 0.10 2.90 2.02 -1.26 -4.78 118.70 112.98 1g9o s GLU 31 Ca 0.72 -1.07 -0.31 0.00 0.02 0.00 0.00 54.97 54.33 1g9o s GLU 31 Cb -0.04 -0.84 -0.11 0.00 0.10 0.00 0.00 34.13 33.25 1g9o s GLU 31 CO 0.50 0.18 1.86 1.17 0.02 0.00 0.00 175.26 178.98 1g9o n LYS 32 N 0.97 2.78 -0.99 1.61 4.81 -1.26 -1.66 118.16 124.41 1g9o n LYS 32 Ca -0.19 1.01 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 1g9o n LYS 32 Cb 0.55 -2.91 0.00 0.00 0.02 0.00 0.00 35.03 32.69 1g9o n LYS 32 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1g9o n GLY 33 N 4.28 0.92 3.53 3.14 0.00 -1.26 -5.02 105.19 110.78 1g9o n GLY 33 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 1g9o n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g9o s LYS 34 N -0.02 1.89 -0.04 1.61 1.02 -0.66 -5.07 119.74 118.47 1g9o s LYS 34 Ca 0.00 -1.54 -0.04 0.00 0.02 0.00 0.00 55.97 54.40 1g9o s LYS 34 Cb 0.00 -1.96 -0.28 0.00 -0.52 0.00 0.00 37.83 35.07 1g9o s LYS 34 CO 0.00 0.37 0.70 -0.07 -0.92 0.00 0.00 175.35 175.43 1g9o h LEU 35 N 2.44 0.42 0.00 3.17 3.38 -1.86 -3.41 115.31 119.46 1g9o h LEU 35 Ca -0.43 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 56.86 1g9o h LEU 35 Cb 1.24 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1g9o h LEU 35 CO 0.57 1.58 0.00 0.61 0.09 0.00 0.00 178.44 181.29 1g9o n GLY 36 N 1.77 0.52 3.82 0.83 0.00 -1.19 -4.75 105.19 106.18 1g9o n GLY 36 Ca -0.22 -1.91 -0.35 0.00 0.00 0.00 0.00 46.02 43.54 1g9o n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1g9o s GLN 37 N -2.30 3.24 0.15 1.61 -1.52 -1.26 -4.00 119.66 115.57 1g9o s GLN 37 Ca 0.00 -0.33 0.07 0.00 -1.95 0.00 0.00 55.36 53.15 1g9o s GLN 37 Cb 0.00 -3.00 -0.04 0.00 -0.22 0.00 0.00 33.01 29.75 1g9o s GLN 37 CO 0.00 0.70 -0.15 0.71 -0.25 0.00 0.00 175.29 176.31 1g9o s TYR 38 N -1.11 1.54 -0.33 0.91 1.51 0.96 -1.53 117.35 119.29 1g9o s TYR 38 Ca 0.20 -0.55 -0.29 0.00 -1.01 0.00 0.00 57.07 55.41 1g9o s TYR 38 Cb -0.12 -0.78 0.01 0.00 -0.11 0.00 0.00 41.96 40.96 1g9o s TYR 38 CO 0.10 0.22 1.15 0.42 -1.11 0.00 0.00 175.55 176.33 1g9o s ILE 39 N -2.32 4.36 0.08 2.71 -1.09 0.14 -1.55 121.20 123.53 1g9o s ILE 39 Ca 0.13 1.54 -0.09 0.00 -2.23 0.00 0.00 60.65 60.01 1g9o s ILE 39 Cb -0.04 -4.35 -0.26 0.00 -1.58 0.00 0.00 42.46 36.23 1g9o s ILE 39 CO 0.04 -0.53 1.17 -0.09 -1.23 0.00 0.00 174.94 174.30 1g9o h ARG 40 N 8.58 0.45 -1.80 2.79 2.43 -0.86 0.14 114.38 126.11 1g9o h ARG 40 Ca -0.23 -0.61 0.01 0.00 -0.81 0.00 0.00 59.98 58.34 1g9o h ARG 40 Cb 1.07 0.20 -0.23 0.00 -0.42 0.00 0.00 29.97 30.59 1g9o h ARG 40 CO 1.04 1.25 0.29 -1.17 -1.51 0.00 0.00 179.97 179.88 1g9o s LEU 41 N -7.61 -0.60 -0.19 3.80 2.96 -1.24 -4.76 118.68 111.05 1g9o s LEU 41 Ca -0.07 1.12 -0.04 0.00 -0.22 0.00 0.00 54.13 54.92 1g9o s LEU 41 Cb 0.07 2.18 -0.02 0.00 0.50 0.00 0.00 46.19 48.92 1g9o s LEU 41 CO 0.90 -0.22 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.98 1g9o s VAL 42 N 0.19 3.68 0.11 1.68 1.01 -1.26 -1.56 120.40 124.25 1g9o s VAL 42 Ca 0.01 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1g9o s VAL 42 Cb -0.05 -2.65 -0.06 0.00 0.00 0.00 0.00 36.38 33.63 1g9o s VAL 42 CO -0.02 0.45 1.08 -1.61 0.00 0.00 0.00 175.10 175.00 1g9o s GLU 43 N 0.98 4.56 0.32 2.72 2.02 -0.05 -4.98 118.70 124.28 1g9o s GLU 43 Ca 0.01 1.64 -0.29 0.00 0.02 0.00 0.00 54.97 56.34 1g9o s GLU 43 Cb -0.15 -3.34 -0.12 0.00 0.10 0.00 0.00 34.13 30.62 1g9o s GLU 43 CO 0.01 -0.01 1.36 -2.30 0.02 0.00 0.00 175.26 174.34 1g9o n PRO 44 N 3.11 2.22 -0.83 0.39 -0.02 -1.26 -2.07 135.00 136.53 1g9o n PRO 44 Ca 0.05 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1g9o n PRO 44 Cb 0.48 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1g9o n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1g9o n GLY 45 N 1.13 1.14 3.85 -1.23 0.00 -1.26 -5.02 105.19 103.80 1g9o n GLY 45 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1g9o n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1g9o s SER 46 N -3.03 5.17 0.46 1.61 1.04 -0.88 -4.87 113.70 113.21 1g9o s SER 46 Ca 0.00 1.27 0.12 0.00 0.48 0.00 0.00 55.95 57.82 1g9o s SER 46 Cb 0.00 -2.08 1.04 0.00 0.10 0.00 0.00 66.02 65.08 1g9o s SER 46 CO 0.00 -1.53 2.08 -0.65 0.98 0.00 0.00 173.24 174.12 1g9o h PRO 47 N -0.79 0.24 -0.48 4.02 0.11 -1.80 -1.02 132.00 132.28 1g9o h PRO 47 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1g9o h PRO 47 Cb 1.25 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1g9o h PRO 47 CO 0.61 0.19 0.24 0.00 -0.21 0.00 0.00 178.00 178.84 1g9o h ALA 48 N 1.85 0.62 -0.48 -0.75 0.00 -1.65 -0.91 119.26 117.95 1g9o h ALA 48 Ca 0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1g9o h ALA 48 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1g9o h ALA 48 CO -0.01 0.17 0.07 1.49 0.00 0.00 0.00 179.25 180.97 1g9o h GLU 49 N 0.64 0.80 0.00 0.00 4.81 -1.52 -1.23 114.58 118.08 1g9o h GLU 49 Ca 0.17 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1g9o h GLU 49 Cb 0.10 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 1g9o h GLU 49 CO -0.02 0.81 -0.08 0.87 -0.73 0.00 0.00 179.01 179.85 1g9o h LYS 50 N 0.67 0.00 -0.01 1.92 1.79 -0.91 -1.23 116.57 118.79 1g9o h LYS 50 Ca 0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 1g9o h LYS 50 Cb 0.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.05 1g9o h LYS 50 CO 0.01 0.08 -0.00 0.00 -1.08 0.00 0.00 179.45 178.46 1g9o n ALA 51 N -2.46 2.58 -0.61 3.86 0.00 -0.37 -4.95 120.51 118.56 1g9o n ALA 51 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1g9o n ALA 51 Cb 0.16 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1g9o n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g9o n GLY 52 N 1.17 0.66 3.78 0.00 0.00 -0.46 -4.50 105.19 105.83 1g9o n GLY 52 Ca 0.19 -0.36 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 1g9o n GLY 52 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1g9o s LEU 53 N 0.00 3.99 0.06 0.99 2.96 -0.49 -5.03 118.68 121.16 1g9o s LEU 53 Ca 0.00 2.17 0.05 0.00 -0.22 0.00 0.00 54.13 56.13 1g9o s LEU 53 Cb 0.00 -4.31 -0.03 0.00 0.50 0.00 0.00 46.19 42.35 1g9o s LEU 53 CO 0.00 -0.83 -0.15 -0.76 -1.32 0.00 0.00 176.35 173.29 1g9o s LEU 54 N -3.08 2.23 0.39 -0.68 1.43 -1.26 -4.65 118.68 113.05 1g9o s LEU 54 Ca 0.64 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.91 1g9o s LEU 54 Cb -0.25 -0.60 -0.10 0.00 0.03 0.00 0.00 46.19 45.27 1g9o s LEU 54 CO 0.30 -0.01 1.45 0.00 0.23 0.00 0.00 176.35 178.32 1g9o s ALA 55 N -1.08 3.49 0.00 4.21 0.00 -1.26 -1.94 121.76 125.18 1g9o s ALA 55 Ca 0.01 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1g9o s ALA 55 Cb -0.09 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1g9o s ALA 55 CO 0.02 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.15 1g9o n GLY 56 N 0.52 1.87 3.78 0.00 0.00 0.48 -4.80 105.19 107.04 1g9o n GLY 56 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1g9o n GLY 56 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1g9o s ASP 57 N -1.77 6.35 -0.17 1.61 1.01 -0.82 -4.13 116.67 118.76 1g9o s ASP 57 Ca 0.00 3.03 -0.12 0.00 0.71 0.00 0.00 52.55 56.17 1g9o s ASP 57 Cb 0.00 -2.66 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 1g9o s ASP 57 CO 0.00 -0.87 0.21 -0.60 0.21 0.00 0.00 175.17 174.12 1g9o s ARG 58 N -1.87 4.18 -0.20 8.23 3.52 -0.06 -0.69 118.95 132.06 1g9o s ARG 58 Ca 0.54 -0.05 -0.24 0.00 -0.13 0.00 0.00 55.73 55.85 1g9o s ARG 58 Cb -0.47 -3.41 -0.01 0.00 -1.56 0.00 0.00 34.95 29.50 1g9o s ARG 58 CO 0.61 0.30 0.79 -0.51 -0.81 0.00 0.00 175.30 175.68 1g9o s LEU 59 N 0.32 4.13 -0.26 -0.88 1.02 -0.58 -1.21 118.68 121.22 1g9o s LEU 59 Ca 0.13 1.05 -0.08 0.00 0.02 0.00 0.00 54.13 55.25 1g9o s LEU 59 Cb -0.12 -3.14 -0.14 0.00 0.02 0.00 0.00 46.19 42.81 1g9o s LEU 59 CO 0.01 -0.42 -0.30 0.52 0.02 0.00 0.00 176.35 176.18 1g9o n VAL 60 N 4.93 1.47 -4.02 -1.59 0.31 0.22 -4.37 118.33 115.28 1g9o n VAL 60 Ca 0.04 -0.45 -0.11 0.00 -0.01 0.00 0.00 64.34 63.81 1g9o n VAL 60 Cb 0.48 -1.69 -0.11 0.00 -0.91 0.00 0.00 33.84 31.62 1g9o n VAL 60 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1g9o s GLU 61 N -2.50 0.42 -0.16 5.55 2.02 -1.03 -0.74 118.70 122.27 1g9o s GLU 61 Ca -0.36 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 53.92 1g9o s GLU 61 Cb 0.12 -0.07 0.03 0.00 0.10 0.00 0.00 34.13 34.31 1g9o s GLU 61 CO 0.52 -0.01 -0.11 0.08 0.02 0.00 0.00 175.26 175.77 1g9o s VAL 62 N -1.53 1.41 -1.49 2.63 1.01 -0.39 -1.32 120.40 120.71 1g9o s VAL 62 Ca -0.12 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 1g9o s VAL 62 Cb -0.09 -1.42 0.05 0.00 0.00 0.00 0.00 36.38 34.92 1g9o s VAL 62 CO -0.01 0.32 0.58 0.59 0.00 0.00 0.00 175.10 176.58 1g9o n ASN 63 N 4.80 -1.56 0.00 3.32 5.03 0.36 -1.70 115.26 125.51 1g9o n ASN 63 Ca -0.15 -0.98 0.00 0.00 0.87 0.00 0.00 54.58 54.32 1g9o n ASN 63 Cb 0.49 -3.09 0.00 0.00 -1.02 0.00 0.00 39.78 36.16 1g9o n ASN 63 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1g9o n GLY 64 N -1.79 0.98 3.64 7.41 0.00 -1.26 -5.02 105.19 109.15 1g9o n GLY 64 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 1g9o n GLY 64 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1g9o s GLU 65 N -0.04 3.85 0.10 1.61 0.41 -0.69 -5.05 118.70 118.89 1g9o s GLU 65 Ca 0.00 -0.35 -0.31 0.00 -0.41 0.00 0.00 54.97 53.90 1g9o s GLU 65 Cb 0.00 -3.16 -0.08 0.00 -1.78 0.00 0.00 34.13 29.12 1g9o s GLU 65 CO 0.00 0.34 1.44 1.21 -0.49 0.00 0.00 175.26 177.76 1g9o s ASN 66 N 0.19 6.77 -0.07 -0.19 2.47 -1.26 -1.26 114.94 121.58 1g9o s ASN 66 Ca 0.04 2.35 0.11 0.00 0.42 0.00 0.00 52.86 55.78 1g9o s ASN 66 Cb -0.12 -2.58 0.16 0.00 -1.45 0.00 0.00 41.25 37.26 1g9o s ASN 66 CO 0.01 -0.71 1.07 1.33 -3.72 0.00 0.00 177.10 175.07 1g9o n VAL 67 N 4.13 1.42 0.29 -5.21 0.24 0.09 -4.78 118.33 114.50 1g9o n VAL 67 Ca 0.12 -1.63 0.13 0.00 -2.04 0.00 0.00 64.34 60.93 1g9o n VAL 67 Cb 0.42 0.10 0.85 0.00 -1.47 0.00 0.00 33.84 33.73 1g9o n VAL 67 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1g9o h GLU 68 N 0.00 0.00 -0.12 7.34 5.08 -1.76 -2.68 114.58 122.44 1g9o h GLU 68 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1g9o h GLU 68 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1g9o h GLU 68 CO 0.00 0.01 0.00 1.63 -1.00 0.00 0.00 179.01 179.65 1g9o n LYS 69 N -3.99 1.81 -2.25 2.33 5.02 -1.26 -3.15 118.16 116.67 1g9o n LYS 69 Ca -0.03 -1.44 -0.29 0.00 -2.02 0.00 0.00 58.31 54.53 1g9o n LYS 69 Cb 0.09 -1.13 0.01 0.00 -0.02 0.00 0.00 35.03 33.99 1g9o n LYS 69 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1g9o s GLU 70 N -0.81 3.38 0.71 1.97 2.02 -1.01 -4.99 118.70 119.97 1g9o s GLU 70 Ca 0.10 0.38 -0.11 0.00 0.02 0.00 0.00 54.97 55.36 1g9o s GLU 70 Cb 0.06 -2.22 0.02 0.00 0.10 0.00 0.00 34.13 32.09 1g9o s GLU 70 CO 0.08 -0.51 1.09 0.95 0.02 0.00 0.00 175.26 176.89 1g9o s THR 71 N -3.01 3.49 0.16 3.63 -4.23 -1.26 -4.73 115.64 109.69 1g9o s THR 71 Ca 0.52 0.48 -0.18 0.00 -1.18 0.00 0.00 61.69 61.34 1g9o s THR 71 Cb -0.11 -3.44 0.08 0.00 1.34 0.00 0.00 72.50 70.38 1g9o s THR 71 CO 0.49 -0.63 1.67 -0.74 -0.54 0.00 0.00 174.62 174.86 1g9o h HIS 72 N -0.70 -0.25 -0.86 3.99 -0.00 -1.96 -1.19 115.15 114.19 1g9o h HIS 72 Ca -0.45 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 59.94 1g9o h HIS 72 Cb 1.25 0.17 -0.04 0.00 -0.00 0.00 0.00 27.41 28.79 1g9o h HIS 72 CO 0.51 -0.18 0.47 0.37 -0.00 0.00 0.00 177.93 179.09 1g9o h GLN 73 N -0.03 1.19 -0.57 5.26 5.75 -1.99 -0.46 115.11 124.27 1g9o h GLN 73 Ca 0.18 -0.14 -0.03 0.00 -0.15 0.00 0.00 58.65 58.51 1g9o h GLN 73 Cb 0.30 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.59 1g9o h GLN 73 CO -0.40 0.87 0.22 1.96 -2.65 0.00 0.00 178.83 178.84 1g9o h GLN 74 N 1.20 0.85 -0.23 1.69 4.20 -1.75 -0.07 115.11 121.01 1g9o h GLN 74 Ca 0.30 -0.16 -0.08 0.00 0.06 0.00 0.00 58.65 58.77 1g9o h GLN 74 Cb 0.03 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.67 1g9o h GLN 74 CO -0.05 0.74 -0.17 0.28 -0.67 0.00 0.00 178.83 178.96 1g9o h VAL 75 N 0.78 1.31 -0.68 -0.54 2.07 -0.90 -2.46 116.25 115.82 1g9o h VAL 75 Ca 0.19 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.45 1g9o h VAL 75 Cb 0.21 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.58 1g9o h VAL 75 CO -0.01 0.40 0.41 0.58 0.02 0.00 0.00 177.57 178.97 1g9o h VAL 76 N 0.23 1.05 -0.27 2.57 2.07 -0.94 -2.15 116.25 118.81 1g9o h VAL 76 Ca 0.04 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.24 1g9o h VAL 76 Cb 0.70 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1g9o h VAL 76 CO 0.05 0.14 -0.07 0.28 0.02 0.00 0.00 177.57 177.99 1g9o h SER 77 N 0.79 0.41 -0.08 0.57 0.02 -0.90 0.10 113.55 114.46 1g9o h SER 77 Ca 0.29 -0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 61.09 1g9o h SER 77 Cb 0.08 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1g9o h SER 77 CO -0.13 0.53 -0.10 0.03 -1.14 0.00 0.00 176.83 176.01 1g9o h ARG 78 N 0.41 0.38 0.13 3.45 3.08 -0.91 -1.81 114.38 119.11 1g9o h ARG 78 Ca 0.08 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 1g9o h ARG 78 Cb 0.38 -0.05 0.02 0.00 0.08 0.00 0.00 29.97 30.40 1g9o h ARG 78 CO 0.02 0.49 -0.75 0.82 -1.07 0.00 0.00 179.97 179.48 1g9o h ILE 79 N 0.36 1.54 -0.39 2.04 2.04 -1.06 -3.26 117.51 118.77 1g9o h ILE 79 Ca 0.07 -2.52 -0.03 0.00 1.00 0.00 0.00 64.86 63.39 1g9o h ILE 79 Cb 0.41 3.21 -0.02 0.00 -0.74 0.00 0.00 36.82 39.68 1g9o h ILE 79 CO 0.02 0.71 0.13 -0.09 0.00 0.00 0.00 178.15 178.92 1g9o h ARG 80 N -0.41 0.56 0.00 2.37 2.43 -0.76 -1.50 114.38 117.08 1g9o h ARG 80 Ca -0.13 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1g9o h ARG 80 Cb 1.59 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 31.04 1g9o h ARG 80 CO 0.14 0.49 0.00 0.00 -1.51 0.00 0.00 179.97 179.09 1g9o n ALA 81 N -2.47 2.48 -3.00 2.80 0.00 -0.69 -4.43 120.51 115.21 1g9o n ALA 81 Ca 0.03 -0.15 -0.44 0.00 0.00 0.00 0.00 53.44 52.87 1g9o n ALA 81 Cb 0.16 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.11 1g9o n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g9o s ALA 82 N -2.37 3.36 -0.40 0.00 0.00 -0.57 -4.90 121.76 116.90 1g9o s ALA 82 Ca 0.33 -2.37 0.27 0.00 0.00 0.00 0.00 51.96 50.19 1g9o s ALA 82 Cb 0.20 -3.79 0.83 0.00 0.00 0.00 0.00 23.12 20.36 1g9o s ALA 82 CO 0.40 -2.67 1.76 -0.07 0.00 0.00 0.00 175.76 175.19 1g9o h LEU 83 N 10.35 0.00 0.00 0.00 3.38 -1.83 -3.39 115.31 123.82 1g9o h LEU 83 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1g9o h LEU 83 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1g9o h LEU 83 CO 1.10 0.00 -0.92 0.59 0.09 0.00 0.00 178.44 179.30 1g9o n ASN 84 N -2.71 3.51 -3.66 -0.43 4.13 -1.26 -4.83 115.26 110.00 1g9o n ASN 84 Ca 0.03 0.00 -0.15 0.00 1.68 0.00 0.00 54.58 56.15 1g9o n ASN 84 Cb 0.39 0.00 -0.07 0.00 -1.54 0.00 0.00 39.78 38.56 1g9o n ASN 84 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1g9o s ALA 85 N -1.93 -1.14 -0.02 5.41 0.00 -1.26 -1.07 121.76 121.76 1g9o s ALA 85 Ca 0.00 0.62 -0.01 0.00 0.00 0.00 0.00 51.96 52.57 1g9o s ALA 85 Cb 0.00 0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.27 1g9o s ALA 85 CO 0.00 -0.35 0.03 0.54 0.00 0.00 0.00 175.76 175.98 1g9o s VAL 86 N -1.61 -0.02 -0.26 0.00 0.11 -0.62 -4.83 120.40 113.15 1g9o s VAL 86 Ca -0.10 0.08 -0.09 0.00 -2.93 0.00 0.00 61.98 58.94 1g9o s VAL 86 Cb -0.02 -0.06 -0.04 0.00 -1.53 0.00 0.00 36.38 34.72 1g9o s VAL 86 CO 0.04 0.03 0.12 -0.13 -3.33 0.00 0.00 175.10 171.84 1g9o s ARG 87 N 0.43 3.78 -0.20 1.54 0.52 -1.26 -1.02 118.95 122.74 1g9o s ARG 87 Ca -0.03 -0.41 -0.02 0.00 -0.52 0.00 0.00 55.73 54.75 1g9o s ARG 87 Cb -0.05 -3.47 0.00 0.00 0.52 0.00 0.00 34.95 31.95 1g9o s ARG 87 CO -0.01 -0.19 -0.11 -0.51 0.02 0.00 0.00 175.30 174.51 1g9o s LEU 88 N 1.68 2.59 -0.26 2.53 1.43 0.17 -0.49 118.68 126.33 1g9o s LEU 88 Ca 0.07 -0.50 -0.17 0.00 -1.03 0.00 0.00 54.13 52.50 1g9o s LEU 88 Cb -0.15 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 1g9o s LEU 88 CO 0.07 -0.01 0.45 -0.22 0.23 0.00 0.00 176.35 176.86 1g9o s LEU 89 N 1.40 4.06 0.21 1.79 2.96 -0.44 -0.67 118.68 128.00 1g9o s LEU 89 Ca 0.05 0.44 0.06 0.00 -0.22 0.00 0.00 54.13 54.45 1g9o s LEU 89 Cb -0.14 -2.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.95 1g9o s LEU 89 CO -0.07 -0.22 -0.08 0.68 -1.32 0.00 0.00 176.35 175.34 1g9o s VAL 90 N 2.09 1.38 -0.17 1.68 -7.23 0.33 -0.61 120.40 117.87 1g9o s VAL 90 Ca 0.19 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.26 1g9o s VAL 90 Cb -0.16 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.64 1g9o s VAL 90 CO 0.09 -0.50 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.50 1g9o s VAL 91 N -3.19 2.21 0.58 1.32 1.01 -0.35 -0.19 120.40 121.79 1g9o s VAL 91 Ca 0.24 -0.90 -0.18 0.00 0.00 0.00 0.00 61.98 61.14 1g9o s VAL 91 Cb 0.03 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 1g9o s VAL 91 CO 0.07 0.53 1.12 -1.81 0.00 0.00 0.00 175.10 175.01 1g9o s ASP 92 N 1.10 5.56 0.45 3.32 1.01 -1.26 -0.88 116.67 125.97 1g9o s ASP 92 Ca 0.00 2.11 -0.24 0.00 0.71 0.00 0.00 52.55 55.13 1g9o s ASP 92 Cb -0.14 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.14 1g9o s ASP 92 CO -0.08 -1.32 1.25 -2.16 0.21 0.00 0.00 175.17 173.07 1g9o s PRO 93 N -3.54 3.75 0.11 8.23 0.04 -1.26 -4.88 135.00 137.46 1g9o s PRO 93 Ca 0.71 1.99 0.03 0.00 0.04 0.00 0.00 61.00 63.76 1g9o s PRO 93 Cb -0.22 -2.53 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 1g9o s PRO 93 CO 0.31 -0.62 -0.08 -1.21 0.04 0.00 0.00 177.00 175.45 1g9o s GLU 94 N -2.53 0.90 -0.21 4.56 0.41 -1.26 -5.07 118.70 115.50 1g9o s GLU 94 Ca 0.62 -1.37 -0.32 0.00 -0.41 0.00 0.00 54.97 53.49 1g9o s GLU 94 Cb -0.34 -0.33 0.15 0.00 -1.78 0.00 0.00 34.13 31.84 1g9o s GLU 94 CO 0.42 0.01 1.21 -0.08 -0.49 0.00 0.00 175.26 176.33 1g9o s THR 95 N -3.53 0.00 -1.16 3.63 -1.32 -1.26 -5.01 115.64 106.98 1g9o s THR 95 Ca 0.13 0.00 0.13 0.00 -1.21 0.00 0.00 61.69 60.74 1g9o s THR 95 Cb 0.04 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.36 1g9o s THR 95 CO -0.03 0.00 1.25 0.47 -2.21 0.00 0.00 174.62 174.09 1g9o n ASP 96 N 0.29 2.95 -4.51 8.08 8.00 -1.26 -4.91 116.55 125.19 1g9o n ASP 96 Ca -0.02 -1.94 -0.43 0.00 0.71 0.00 0.00 54.79 53.11 1g9o n ASP 96 Cb 0.58 -0.23 -0.07 0.00 -0.02 0.00 0.00 41.12 41.38 1g9o n ASP 96 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1g9o s GLU 97 N -1.01 3.24 -0.29 -1.24 2.12 -1.26 -5.03 118.70 115.22 1g9o s GLU 97 Ca 0.26 -0.48 -0.07 0.00 0.36 0.00 0.00 54.97 55.04 1g9o s GLU 97 Cb 0.14 -3.97 0.00 0.00 0.26 0.00 0.00 34.13 30.56 1g9o s GLU 97 CO 0.18 -1.03 0.07 -1.14 -0.54 0.00 0.00 175.26 172.81 1g9o s GLN 98 N 2.75 3.15 0.00 4.30 0.74 -1.26 -5.22 119.66 124.12 1g9o s GLN 98 Ca 0.21 -0.81 0.12 0.00 0.05 0.00 0.00 55.36 54.93 1g9o s GLN 98 Cb -0.15 -3.35 0.10 0.00 1.10 0.00 0.00 33.01 30.71 1g9o s GLN 98 CO 0.18 -0.41 0.89 1.28 -0.55 0.00 0.00 175.29 176.67