#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f9r h ASP 7 N 0.00 0.00 -2.36 1.61 5.19 -2.02 -3.47 116.42 115.37 1f9r h ASP 7 Ca 0.00 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 55.91 1f9r h ASP 7 Cb 0.00 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 1f9r h ASP 7 CO 0.00 0.57 -0.46 -0.76 -3.12 0.00 0.00 179.24 175.47 1f9r s LEU 8 N -6.55 4.27 0.28 1.55 1.43 -1.26 -5.13 118.68 113.28 1f9r s LEU 8 Ca 0.03 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1f9r s LEU 8 Cb 0.08 -2.83 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 1f9r s LEU 8 CO 0.75 -0.01 0.17 0.00 0.23 0.00 0.00 176.35 177.49 1f9r s GLN 9 N -3.63 1.51 0.54 1.70 -2.07 -1.24 -4.48 119.66 112.00 1f9r s GLN 9 Ca 0.34 -1.85 -0.21 0.00 -1.82 0.00 0.00 55.36 51.82 1f9r s GLN 9 Cb -0.10 0.06 -0.06 0.00 -1.09 0.00 0.00 33.01 31.83 1f9r s GLN 9 CO 0.28 -0.46 1.19 0.00 -1.32 0.00 0.00 175.29 174.98 1f9r h LEU 11 N 1.17 0.41 -9.46 0.00 5.85 -1.99 -3.46 115.31 107.83 1f9r h LEU 11 Ca -0.49 -0.68 -0.54 0.00 0.84 0.00 0.00 57.88 57.01 1f9r h LEU 11 Cb 1.33 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 1f9r h LEU 11 CO 0.55 1.58 0.23 0.00 -0.34 0.00 0.00 178.44 180.47 1f9r n VAL 13 N 3.34 1.49 -3.92 0.00 0.31 -1.26 -5.04 118.33 113.25 1f9r n VAL 13 Ca 0.01 -0.55 -0.08 0.00 -0.01 0.00 0.00 64.34 63.70 1f9r n VAL 13 Cb 0.51 -1.47 -0.04 0.00 -0.91 0.00 0.00 33.84 31.93 1f9r n VAL 13 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1f9r s LYS 14 N -2.52 1.60 0.25 5.55 -2.85 -1.26 -5.19 119.74 115.33 1f9r s LYS 14 Ca -0.35 -1.11 0.09 0.00 -1.00 0.00 0.00 55.97 53.59 1f9r s LYS 14 Cb 0.10 0.52 -0.04 0.00 -2.06 0.00 0.00 37.83 36.35 1f9r s LYS 14 CO 0.59 -0.69 0.03 0.95 0.10 0.00 0.00 175.35 176.32 1f9r s THR 15 N -3.97 3.65 -0.05 3.79 -4.23 -1.26 -4.43 115.64 109.14 1f9r s THR 15 Ca 0.17 -1.77 0.01 0.00 -1.18 0.00 0.00 61.69 58.92 1f9r s THR 15 Cb -0.02 -2.94 -0.03 0.00 1.34 0.00 0.00 72.50 70.85 1f9r s THR 15 CO 0.07 -0.34 -0.06 -0.89 -0.54 0.00 0.00 174.62 172.86 1f9r s THR 16 N -2.21 3.76 -0.05 3.99 2.01 0.23 -4.93 115.64 118.43 1f9r s THR 16 Ca 0.31 -0.53 0.03 0.00 0.31 0.00 0.00 61.69 61.81 1f9r s THR 16 Cb -0.07 -2.57 -0.04 0.00 0.01 0.00 0.00 72.50 69.83 1f9r s THR 16 CO 0.21 0.54 0.09 -1.54 -0.69 0.00 0.00 174.62 173.23 1f9r n SER 17 N 2.02 3.01 -4.26 3.53 3.41 -1.26 -4.23 113.62 115.85 1f9r n SER 17 Ca -0.17 -0.18 -0.44 0.00 -0.26 0.00 0.00 58.87 57.82 1f9r n SER 17 Cb 0.53 1.10 -0.04 0.00 -0.26 0.00 0.00 64.21 65.54 1f9r n SER 17 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1f9r s GLN 18 N -1.94 3.31 -0.02 4.33 -1.52 -1.26 -4.99 119.66 117.58 1f9r s GLN 18 Ca -0.00 -2.51 -0.24 0.00 -1.95 0.00 0.00 55.36 50.66 1f9r s GLN 18 Cb 0.02 -4.23 0.05 0.00 -0.22 0.00 0.00 33.01 28.64 1f9r s GLN 18 CO 0.13 -1.26 0.52 0.54 -0.25 0.00 0.00 175.29 174.98 1f9r s VAL 19 N 0.05 0.03 -0.17 1.09 0.11 -1.26 -5.15 120.40 115.10 1f9r s VAL 19 Ca 0.18 -0.21 -0.18 0.00 -2.93 0.00 0.00 61.98 58.84 1f9r s VAL 19 Cb -0.13 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 33.81 1f9r s VAL 19 CO -0.07 -0.12 0.47 -0.13 -3.33 0.00 0.00 175.10 171.92 1f9r s ARG 20 N -1.53 4.24 0.38 1.54 1.81 -1.26 -4.94 118.95 119.19 1f9r s ARG 20 Ca -0.10 0.37 0.16 0.00 -1.72 0.00 0.00 55.73 54.43 1f9r s ARG 20 Cb -0.02 -3.51 1.04 0.00 -0.45 0.00 0.00 34.95 32.02 1f9r s ARG 20 CO 0.05 -0.00 1.78 -1.35 -0.68 0.00 0.00 175.30 175.10 1f9r h PRO 21 N 7.16 0.44 -0.80 3.54 0.11 -1.95 0.88 132.00 141.38 1f9r h PRO 21 Ca -0.37 -0.03 0.17 0.00 0.11 0.00 0.00 66.00 65.88 1f9r h PRO 21 Cb 1.16 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.12 1f9r h PRO 21 CO 0.74 0.29 0.53 0.00 -0.21 0.00 0.00 178.00 179.36 1f9r h ARG 22 N 0.45 0.39 -0.00 1.05 -0.00 -1.97 -2.53 114.38 111.77 1f9r h ARG 22 Ca 0.57 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 60.03 1f9r h ARG 22 Cb 1.35 -0.09 0.00 0.00 0.00 0.00 0.00 29.97 31.24 1f9r h ARG 22 CO -0.30 0.25 -0.06 0.72 0.00 0.00 0.00 179.97 180.59 1f9r n HIS 23 N -4.48 0.00 -2.83 3.04 8.25 0.30 -4.83 115.22 114.68 1f9r n HIS 23 Ca 0.16 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.20 1f9r n HIS 23 Cb 0.59 -0.45 -0.04 0.00 1.12 0.00 0.00 29.99 31.21 1f9r n HIS 23 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1f9r s ILE 24 N -2.96 4.85 -0.13 1.59 1.01 -0.95 -0.52 121.20 124.09 1f9r s ILE 24 Ca 0.15 1.77 0.18 0.00 0.00 0.00 0.00 60.65 62.75 1f9r s ILE 24 Cb 0.19 -4.19 -0.25 0.00 0.01 0.00 0.00 42.46 38.22 1f9r s ILE 24 CO 0.54 0.02 0.37 1.07 0.00 0.00 0.00 174.94 176.95 1f9r n THR 25 N 4.65 1.00 -3.68 2.92 5.66 0.73 -4.90 114.28 120.65 1f9r n THR 25 Ca 0.06 -0.73 -0.14 0.00 -3.05 0.00 0.00 64.05 60.19 1f9r n THR 25 Cb 0.49 -0.43 -0.08 0.00 -1.55 0.00 0.00 70.33 68.75 1f9r n THR 25 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1f9r s SER 26 N -5.34 -0.47 -0.09 1.09 0.15 -1.17 -4.99 113.70 102.87 1f9r s SER 26 Ca -0.08 0.75 0.01 0.00 0.70 0.00 0.00 55.95 57.33 1f9r s SER 26 Cb 0.09 0.78 0.02 0.00 -1.71 0.00 0.00 66.02 65.20 1f9r s SER 26 CO 0.85 -0.31 -0.10 -0.22 1.20 0.00 0.00 173.24 174.65 1f9r s LEU 27 N -0.35 1.41 -0.25 3.45 2.96 -1.26 0.29 118.68 124.93 1f9r s LEU 27 Ca -0.05 -0.31 -0.06 0.00 -0.22 0.00 0.00 54.13 53.49 1f9r s LEU 27 Cb -0.03 -0.85 -0.02 0.00 0.50 0.00 0.00 46.19 45.79 1f9r s LEU 27 CO 0.03 -0.05 0.03 -0.70 -1.32 0.00 0.00 176.35 174.34 1f9r s GLU 28 N 1.25 3.47 -0.40 1.98 2.12 0.62 -4.95 118.70 122.78 1f9r s GLU 28 Ca -0.03 -0.59 -0.13 0.00 0.36 0.00 0.00 54.97 54.57 1f9r s GLU 28 Cb -0.14 -3.22 0.02 0.00 0.26 0.00 0.00 34.13 31.06 1f9r s GLU 28 CO -0.03 -0.23 0.26 0.08 -0.54 0.00 0.00 175.26 174.80 1f9r s VAL 29 N 1.55 4.97 -0.33 3.70 1.01 -1.26 -1.27 120.40 128.76 1f9r s VAL 29 Ca 0.06 -0.76 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 1f9r s VAL 29 Cb -0.15 -3.78 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 1f9r s VAL 29 CO 0.01 -0.29 0.19 -0.63 0.00 0.00 0.00 175.10 174.38 1f9r s ILE 30 N 1.62 4.79 0.54 2.22 1.01 0.12 -4.94 121.20 126.56 1f9r s ILE 30 Ca 0.04 -0.47 -0.21 0.00 0.00 0.00 0.00 60.65 60.01 1f9r s ILE 30 Cb -0.19 -3.50 -0.06 0.00 0.01 0.00 0.00 42.46 38.72 1f9r s ILE 30 CO 0.09 -0.03 1.23 1.17 0.00 0.00 0.00 174.94 177.40 1f9r n LYS 31 N 5.02 1.47 -1.14 2.79 4.81 -1.26 -1.38 118.16 128.47 1f9r n LYS 31 Ca -0.13 0.54 -0.31 0.00 -0.87 0.00 0.00 58.31 57.55 1f9r n LYS 31 Cb 0.49 -2.42 0.12 0.00 0.02 0.00 0.00 35.03 33.24 1f9r n LYS 31 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1f9r s ALA 32 N -1.33 1.87 0.00 3.14 0.00 -1.26 -4.82 121.76 119.35 1f9r s ALA 32 Ca 0.72 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1f9r s ALA 32 Cb -0.43 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1f9r s ALA 32 CO 0.50 -2.13 0.00 0.41 0.00 0.00 0.00 175.76 174.53 1f9r n GLY 33 N -0.92 -0.54 0.26 0.00 0.00 0.26 -4.96 105.19 99.30 1f9r n GLY 33 Ca 0.09 -0.75 0.04 0.00 0.00 0.00 0.00 46.02 45.40 1f9r n GLY 33 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1f9r h PRO 34 N 0.00 0.38 -0.54 1.61 0.11 -1.97 -1.99 132.00 129.59 1f9r h PRO 34 Ca 0.00 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 1f9r h PRO 34 Cb 0.00 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.00 1f9r h PRO 34 CO 0.00 0.25 0.23 1.12 -0.21 0.00 0.00 178.00 179.39 1f9r h HIS 35 N 0.39 0.78 -2.00 0.65 2.07 -1.93 -3.45 115.15 111.66 1f9r h HIS 35 Ca 0.39 -0.03 -0.01 0.00 -2.85 0.00 0.00 60.37 57.87 1f9r h HIS 35 Cb 0.59 -0.24 -0.21 0.00 2.57 0.00 0.00 27.41 30.12 1f9r h HIS 35 CO -0.19 0.59 0.07 0.00 -3.07 0.00 0.00 177.93 175.33 1f9r n ALA 37 N 3.59 2.17 -2.47 0.00 0.00 -1.24 0.91 120.51 123.46 1f9r n ALA 37 Ca -0.17 -0.09 -0.23 0.00 0.00 0.00 0.00 53.44 52.95 1f9r n ALA 37 Cb 0.57 -1.41 -0.12 0.00 0.00 0.00 0.00 19.45 18.50 1f9r n ALA 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1f9r s VAL 38 N -2.93 1.84 0.65 0.00 -7.23 -1.26 -4.74 120.40 106.74 1f9r s VAL 38 Ca 0.14 -1.83 -0.16 0.00 -1.81 0.00 0.00 61.98 58.33 1f9r s VAL 38 Cb 0.16 -1.80 -0.00 0.00 0.56 0.00 0.00 36.38 35.31 1f9r s VAL 38 CO 0.44 -0.22 1.13 -2.84 -0.31 0.00 0.00 175.10 173.30 1f9r s PRO 39 N -2.54 2.76 0.01 4.82 0.02 -1.26 -4.32 135.00 134.48 1f9r s PRO 39 Ca 0.14 1.50 0.06 0.00 0.02 0.00 0.00 61.00 62.72 1f9r s PRO 39 Cb -0.07 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.50 1f9r s PRO 39 CO 0.06 -1.30 -0.18 -0.65 -0.33 0.00 0.00 177.00 174.61 1f9r s GLN 40 N -3.92 1.33 -0.41 5.54 -0.21 -0.48 -4.96 119.66 116.55 1f9r s GLN 40 Ca 0.69 -0.71 0.03 0.00 0.02 0.00 0.00 55.36 55.39 1f9r s GLN 40 Cb -0.23 -1.33 0.12 0.00 1.00 0.00 0.00 33.01 32.57 1f9r s GLN 40 CO 0.40 0.36 0.16 -0.51 -2.12 0.00 0.00 175.29 173.57 1f9r s LEU 41 N -0.68 3.94 -0.42 2.90 1.02 -1.26 -0.70 118.68 123.48 1f9r s LEU 41 Ca 0.06 -2.46 -0.19 0.00 0.02 0.00 0.00 54.13 51.56 1f9r s LEU 41 Cb -0.07 -1.44 0.02 0.00 0.02 0.00 0.00 46.19 44.72 1f9r s LEU 41 CO 0.00 -0.32 0.56 -0.63 0.02 0.00 0.00 176.35 175.98 1f9r s ILE 42 N 0.50 4.94 -0.17 -0.59 -1.09 -0.40 -0.78 121.20 123.61 1f9r s ILE 42 Ca 0.14 -0.01 -0.08 0.00 -2.23 0.00 0.00 60.65 58.46 1f9r s ILE 42 Cb -0.22 -4.12 -0.04 0.00 -1.58 0.00 0.00 42.46 36.50 1f9r s ILE 42 CO -0.06 -0.49 0.11 0.00 -1.23 0.00 0.00 174.94 173.27 1f9r s ALA 43 N 2.53 3.64 -0.14 9.38 0.00 -0.12 -0.28 121.76 136.78 1f9r s ALA 43 Ca 0.18 -0.70 -0.06 0.00 0.00 0.00 0.00 51.96 51.38 1f9r s ALA 43 Cb -0.15 -2.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 1f9r s ALA 43 CO 0.16 0.30 0.09 0.99 0.00 0.00 0.00 175.76 177.30 1f9r s THR 44 N -0.04 5.04 0.28 0.00 2.01 0.15 -1.44 115.64 121.63 1f9r s THR 44 Ca 0.09 0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.19 1f9r s THR 44 Cb -0.12 -3.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 1f9r s THR 44 CO 0.00 0.55 0.37 -0.76 -0.69 0.00 0.00 174.62 174.09 1f9r s LEU 45 N -0.42 4.12 0.48 4.42 1.43 0.21 -0.19 118.68 128.72 1f9r s LEU 45 Ca 0.10 -0.08 0.32 0.00 -1.03 0.00 0.00 54.13 53.45 1f9r s LEU 45 Cb -0.12 -2.73 1.43 0.00 0.03 0.00 0.00 46.19 44.80 1f9r s LEU 45 CO 0.02 -0.19 1.70 0.11 0.23 0.00 0.00 176.35 178.22 1f9r h LYS 46 N 1.13 0.12 0.00 1.70 1.57 -1.13 0.33 116.57 120.29 1f9r h LYS 46 Ca -0.49 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1f9r h LYS 46 Cb 1.24 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1f9r h LYS 46 CO 0.58 0.08 -0.28 0.27 -0.57 0.00 0.00 179.45 179.53 1f9r n ASN 47 N -4.41 0.33 0.00 0.86 2.04 -1.26 -4.94 115.26 107.88 1f9r n ASN 47 Ca 0.32 0.13 0.00 0.00 -0.44 0.00 0.00 54.58 54.59 1f9r n ASN 47 Cb 1.33 -0.12 0.00 0.00 -2.53 0.00 0.00 39.78 38.46 1f9r n ASN 47 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1f9r n GLY 48 N 1.47 2.04 3.75 4.83 0.00 0.12 -5.08 105.19 112.32 1f9r n GLY 48 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1f9r n GLY 48 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f9r s ARG 49 N -0.54 3.10 0.05 1.61 3.52 -1.26 -4.67 118.95 120.76 1f9r s ARG 49 Ca 0.00 2.00 0.08 0.00 -0.13 0.00 0.00 55.73 57.68 1f9r s ARG 49 Cb 0.00 -2.11 -0.03 0.00 -1.56 0.00 0.00 34.95 31.25 1f9r s ARG 49 CO 0.00 -1.15 -0.23 0.15 -0.81 0.00 0.00 175.30 173.26 1f9r s LYS 50 N -3.08 1.55 0.25 5.12 1.02 -1.26 -0.62 119.74 122.72 1f9r s LYS 50 Ca 0.74 -1.02 -0.00 0.00 0.02 0.00 0.00 55.97 55.71 1f9r s LYS 50 Cb -0.35 -1.70 -0.03 0.00 -0.52 0.00 0.00 37.83 35.23 1f9r s LYS 50 CO 0.39 0.44 0.24 0.96 -0.92 0.00 0.00 175.35 176.46 1f9r s ILE 51 N -0.81 0.00 0.04 2.17 -4.36 -0.52 -4.99 121.20 112.74 1f9r s ILE 51 Ca 0.09 -1.90 0.09 0.00 -0.26 0.00 0.00 60.65 58.67 1f9r s ILE 51 Cb -0.09 -2.48 -0.03 0.00 1.25 0.00 0.00 42.46 41.11 1f9r s ILE 51 CO 0.02 0.00 -0.25 0.00 0.24 0.00 0.00 174.94 174.95 1f9r s LEU 53 N -1.26 3.96 -0.01 0.00 1.43 0.04 0.75 118.68 123.59 1f9r s LEU 53 Ca 0.12 0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.95 1f9r s LEU 53 Cb -0.10 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 1f9r s LEU 53 CO 0.02 0.13 1.12 -0.62 0.23 0.00 0.00 176.35 177.23 1f9r s ASP 54 N -2.69 7.17 0.04 2.29 3.68 -1.26 -4.55 116.67 121.34 1f9r s ASP 54 Ca 0.31 1.80 -0.26 0.00 2.13 0.00 0.00 52.55 56.53 1f9r s ASP 54 Cb -0.12 -2.57 -0.17 0.00 -1.45 0.00 0.00 42.92 38.62 1f9r s ASP 54 CO 0.24 -0.45 1.48 -0.07 0.13 0.00 0.00 175.17 176.50 1f9r h LEU 55 N 7.41 -0.27 -0.45 -1.34 3.38 -1.98 -3.11 115.31 118.94 1f9r h LEU 55 Ca -0.38 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 57.54 1f9r h LEU 55 Cb 1.19 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.95 1f9r h LEU 55 CO 0.82 -0.04 0.13 1.56 0.09 0.00 0.00 178.44 181.01 1f9r h GLN 56 N -0.51 0.28 -6.65 1.13 7.50 -2.03 -3.42 115.11 111.41 1f9r h GLN 56 Ca -0.03 -0.02 -0.58 0.00 0.50 0.00 0.00 58.65 58.52 1f9r h GLN 56 Cb 0.38 -0.06 0.16 0.00 0.05 0.00 0.00 27.48 28.00 1f9r h GLN 56 CO 0.05 0.18 -0.09 0.00 -1.50 0.00 0.00 178.83 177.48 1f9r n ALA 57 N -2.43 -0.41 0.72 3.87 0.00 -1.18 -4.88 120.51 116.19 1f9r n ALA 57 Ca 0.04 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.65 1f9r n ALA 57 Cb 0.19 -1.98 0.19 0.00 0.00 0.00 0.00 19.45 17.85 1f9r n ALA 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1f9r n PRO 58 N -0.34 0.19 -0.36 0.00 -0.04 -1.26 -4.30 135.00 128.88 1f9r n PRO 58 Ca 0.12 0.05 0.31 0.00 -0.04 0.00 0.00 63.50 63.94 1f9r n PRO 58 Cb 0.45 -1.61 0.57 0.00 -0.04 0.00 0.00 33.50 32.88 1f9r n PRO 58 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1f9r h LEU 59 N 0.00 0.36 -0.35 1.53 6.46 -1.90 0.15 115.31 121.56 1f9r h LEU 59 Ca 0.00 0.20 -0.19 0.00 -0.12 0.00 0.00 57.88 57.77 1f9r h LEU 59 Cb 0.66 0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 1f9r h LEU 59 CO 0.00 -0.26 -0.82 0.10 -0.62 0.00 0.00 178.44 176.84 1f9r h TYR 60 N 0.13 0.38 0.00 1.25 -0.00 -1.84 -2.54 116.97 114.34 1f9r h TYR 60 Ca 0.81 -0.19 -0.01 0.00 -0.00 0.00 0.00 58.73 59.34 1f9r h TYR 60 Cb 2.18 -0.05 -0.00 0.00 -0.00 0.00 0.00 36.73 38.86 1f9r h TYR 60 CO -0.01 0.97 -0.05 0.87 -0.00 0.00 0.00 178.16 179.94 1f9r h LYS 61 N 0.16 0.00 0.02 0.10 1.57 -0.99 0.82 116.57 118.26 1f9r h LYS 61 Ca -0.04 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.48 1f9r h LYS 61 Cb 1.42 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.69 1f9r h LYS 61 CO 0.13 0.05 -1.41 0.87 -0.57 0.00 0.00 179.45 178.52 1f9r h LYS 62 N 0.00 0.05 -0.16 3.15 1.57 -1.36 -2.93 116.57 116.88 1f9r h LYS 62 Ca -0.00 -0.09 -0.18 0.00 -1.87 0.00 0.00 60.65 58.51 1f9r h LYS 62 Cb 0.16 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 1f9r h LYS 62 CO 0.01 0.81 -0.65 0.82 -0.57 0.00 0.00 179.45 179.87 1f9r h ILE 63 N 0.01 1.32 -0.34 1.86 2.04 -0.83 -0.86 117.51 120.72 1f9r h ILE 63 Ca -0.17 -1.92 -0.10 0.00 1.00 0.00 0.00 64.86 63.67 1f9r h ILE 63 Cb 1.92 1.89 -0.02 0.00 -0.74 0.00 0.00 36.82 39.88 1f9r h ILE 63 CO 0.11 0.60 -0.19 0.40 0.00 0.00 0.00 178.15 179.07 1f9r h ILE 64 N 0.44 1.26 0.37 -0.67 2.04 -0.98 -0.08 117.51 119.89 1f9r h ILE 64 Ca -0.01 -1.24 -0.02 0.00 1.00 0.00 0.00 64.86 64.59 1f9r h ILE 64 Cb 1.22 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 1f9r h ILE 64 CO 0.12 0.41 -0.18 0.50 0.00 0.00 0.00 178.15 179.00 1f9r h LYS 65 N 0.57 -0.48 -0.58 2.37 3.64 -1.30 0.18 116.57 120.97 1f9r h LYS 65 Ca 0.09 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.58 1f9r h LYS 65 Cb 0.65 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.54 1f9r h LYS 65 CO 0.05 -0.18 0.38 -0.22 -2.27 0.00 0.00 179.45 177.21 1f9r h LYS 66 N -0.79 0.44 -0.02 1.90 1.63 -1.08 -2.43 116.57 116.23 1f9r h LYS 66 Ca -0.05 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.63 1f9r h LYS 66 Cb 0.52 -0.10 0.01 0.00 -0.60 0.00 0.00 32.23 32.06 1f9r h LYS 66 CO 0.08 0.29 -0.35 -0.07 -3.45 0.00 0.00 179.45 175.96 1f9r h LEU 67 N 0.45 0.34 -0.17 5.20 3.38 -0.82 -3.30 115.31 120.40 1f9r h LEU 67 Ca 0.26 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1f9r h LEU 67 Cb 0.43 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1f9r h LEU 67 CO -0.07 1.03 0.00 0.18 0.09 0.00 0.00 178.44 179.66 1f9r n LEU 68 N -4.42 0.12 -4.16 1.67 4.77 0.61 -3.98 117.00 111.62 1f9r n LEU 68 Ca -0.10 0.54 -0.39 0.00 -0.03 0.00 0.00 56.01 56.03 1f9r n LEU 68 Cb 0.54 -0.53 -0.04 0.00 -2.33 0.00 0.00 43.42 41.06 1f9r n LEU 68 CO 0.41 -0.39 0.54 -0.62 -1.33 0.00 0.00 177.39 176.01 1f9r n GLU 69 N -1.64 3.06 0.00 3.23 1.02 -0.97 -5.08 120.64 120.26 1f9r n GLU 69 Ca 0.02 -4.49 0.00 0.00 -0.02 0.00 0.00 57.16 52.68 1f9r n GLU 69 Cb 0.13 -2.46 0.00 0.00 -0.02 0.00 0.00 31.44 29.09 1f9r n GLU 69 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76