#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a7o s ILE 2 N 0.00 5.17 0.20 0.53 1.01 -1.26 -5.01 121.20 121.83 1a7o s ILE 2 Ca 0.00 0.83 0.04 0.00 0.00 0.00 0.00 60.65 61.52 1a7o s ILE 2 Cb 0.00 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1a7o s ILE 2 CO 0.00 0.24 0.33 0.68 0.00 0.00 0.00 174.94 176.19 1a7o s VAL 3 N 1.30 5.29 -0.06 2.92 -7.23 -1.26 -4.69 120.40 116.67 1a7o s VAL 3 Ca 0.22 -0.82 0.06 0.00 -1.81 0.00 0.00 61.98 59.63 1a7o s VAL 3 Cb -0.15 -3.80 -0.01 0.00 0.56 0.00 0.00 36.38 32.98 1a7o s VAL 3 CO 0.09 -0.21 -0.25 -0.76 -0.31 0.00 0.00 175.10 173.66 1a7o s LEU 4 N -3.61 2.08 -0.17 1.32 1.43 -1.26 -1.33 118.68 117.15 1a7o s LEU 4 Ca 0.34 -0.51 -0.00 0.00 -1.03 0.00 0.00 54.13 52.93 1a7o s LEU 4 Cb -0.10 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.74 1a7o s LEU 4 CO 0.29 0.24 -0.15 -0.89 0.23 0.00 0.00 176.35 176.07 1a7o s THR 5 N -0.12 2.62 -0.06 5.49 2.01 0.71 -4.05 115.64 122.25 1a7o s THR 5 Ca -0.05 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.14 1a7o s THR 5 Cb -0.14 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 1a7o s THR 5 CO 0.04 0.51 0.09 -1.10 -0.69 0.00 0.00 174.62 173.47 1a7o s GLN 6 N 0.98 3.21 -0.03 4.92 -0.21 -1.26 0.30 119.66 127.57 1a7o s GLN 6 Ca -0.02 -0.33 -0.03 0.00 0.02 0.00 0.00 55.36 55.00 1a7o s GLN 6 Cb -0.15 -2.98 0.01 0.00 1.00 0.00 0.00 33.01 30.90 1a7o s GLN 6 CO -0.03 0.71 0.08 -1.12 -2.12 0.00 0.00 175.29 172.81 1a7o s SER 7 N -1.34 -0.08 0.77 5.90 0.01 -0.12 -4.41 113.70 114.44 1a7o s SER 7 Ca 0.19 0.17 -0.12 0.00 1.31 0.00 0.00 55.95 57.50 1a7o s SER 7 Cb -0.12 0.15 0.06 0.00 0.21 0.00 0.00 66.02 66.32 1a7o s SER 7 CO 0.09 -0.04 1.12 -2.84 0.41 0.00 0.00 173.24 171.97 1a7o s PRO 8 N 0.21 2.28 0.28 12.44 0.02 -1.26 -0.22 135.00 148.75 1a7o s PRO 8 Ca -0.01 0.43 0.09 0.00 0.02 0.00 0.00 61.00 61.53 1a7o s PRO 8 Cb -0.02 -1.96 0.40 0.00 0.02 0.00 0.00 34.50 32.94 1a7o s PRO 8 CO -0.01 -1.44 1.64 0.00 -0.33 0.00 0.00 177.00 176.87 1a7o h ALA 9 N -0.95 1.03 -2.41 -1.55 0.00 -1.82 -3.41 119.26 110.15 1a7o h ALA 9 Ca -0.46 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 53.84 1a7o h ALA 9 Cb 1.28 -0.09 -0.19 0.00 0.00 0.00 0.00 17.79 18.79 1a7o h ALA 9 CO 0.63 0.70 -0.13 -1.54 0.00 0.00 0.00 179.25 178.91 1a7o s SER 10 N -6.87 -0.31 -0.11 0.00 1.04 -1.26 -0.65 113.70 105.54 1a7o s SER 10 Ca -0.02 0.18 -0.12 0.00 0.48 0.00 0.00 55.95 56.47 1a7o s SER 10 Cb 0.13 0.39 0.03 0.00 0.10 0.00 0.00 66.02 66.67 1a7o s SER 10 CO 0.77 -0.55 0.32 -0.22 0.98 0.00 0.00 173.24 174.54 1a7o s LEU 11 N -1.52 0.78 -0.15 2.42 2.96 0.51 -4.90 118.68 118.79 1a7o s LEU 11 Ca -0.10 0.56 -0.05 0.00 -0.22 0.00 0.00 54.13 54.32 1a7o s LEU 11 Cb -0.03 1.13 -0.03 0.00 0.50 0.00 0.00 46.19 47.76 1a7o s LEU 11 CO 0.03 -0.16 0.01 -0.44 -1.32 0.00 0.00 176.35 174.47 1a7o s SER 12 N -0.06 5.22 0.09 3.68 0.01 -1.26 -0.93 113.70 120.46 1a7o s SER 12 Ca -0.02 0.02 -0.14 0.00 1.31 0.00 0.00 55.95 57.12 1a7o s SER 12 Cb -0.03 -1.78 0.02 0.00 0.21 0.00 0.00 66.02 64.44 1a7o s SER 12 CO 0.01 0.23 0.32 0.00 0.41 0.00 0.00 173.24 174.21 1a7o s ALA 13 N 0.04 -0.70 0.27 1.44 0.00 0.57 -4.83 121.76 118.56 1a7o s ALA 13 Ca 0.03 -0.16 0.03 0.00 0.00 0.00 0.00 51.96 51.86 1a7o s ALA 13 Cb -0.13 0.53 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 1a7o s ALA 13 CO 0.02 -0.54 0.42 -1.12 0.00 0.00 0.00 175.76 174.54 1a7o s SER 14 N -2.59 6.32 0.49 0.00 0.01 -1.26 -0.31 113.70 116.36 1a7o s SER 14 Ca 0.01 0.21 -0.24 0.00 1.31 0.00 0.00 55.95 57.24 1a7o s SER 14 Cb 0.02 -1.92 -0.07 0.00 0.21 0.00 0.00 66.02 64.26 1a7o s SER 14 CO -0.09 -0.14 1.42 0.52 0.41 0.00 0.00 173.24 175.36 1a7o n VAL 15 N -1.47 3.22 0.00 3.43 0.31 -1.26 -1.91 118.33 120.66 1a7o n VAL 15 Ca -0.07 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 1a7o n VAL 15 Cb 0.56 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.70 1a7o n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a7o n GLY 16 N 0.63 2.97 3.83 2.92 0.00 0.10 -4.84 105.19 110.81 1a7o n GLY 16 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1a7o n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a7o s GLU 17 N -0.32 3.26 -0.21 1.61 2.02 -0.80 -3.99 118.70 120.28 1a7o s GLU 17 Ca 0.00 0.97 -0.08 0.00 0.02 0.00 0.00 54.97 55.88 1a7o s GLU 17 Cb 0.00 -2.03 -0.04 0.00 0.10 0.00 0.00 34.13 32.16 1a7o s GLU 17 CO 0.00 -0.84 0.07 0.99 0.02 0.00 0.00 175.26 175.50 1a7o s THR 18 N -2.90 4.69 0.14 3.63 2.01 -1.26 0.98 115.64 122.92 1a7o s THR 18 Ca 0.59 -0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.58 1a7o s THR 18 Cb -0.13 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 1a7o s THR 18 CO 0.48 0.41 -0.12 0.68 -0.69 0.00 0.00 174.62 175.39 1a7o s VAL 19 N 0.80 1.25 -0.06 3.82 -7.23 -0.25 -4.94 120.40 113.79 1a7o s VAL 19 Ca 0.04 -1.92 0.02 0.00 -1.81 0.00 0.00 61.98 58.31 1a7o s VAL 19 Cb -0.13 -1.71 0.01 0.00 0.56 0.00 0.00 36.38 35.11 1a7o s VAL 19 CO 0.02 -0.61 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.20 1a7o s THR 20 N -2.82 1.04 0.05 5.32 2.01 -1.26 -0.28 115.64 119.70 1a7o s THR 20 Ca 0.14 -0.44 0.08 0.00 0.31 0.00 0.00 61.69 61.78 1a7o s THR 20 Cb -0.01 -0.95 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 1a7o s THR 20 CO 0.02 0.33 -0.24 0.27 -0.69 0.00 0.00 174.62 174.31 1a7o s ILE 21 N 0.58 1.93 0.06 1.82 -4.36 0.61 -4.79 121.20 117.04 1a7o s ILE 21 Ca -0.12 -1.32 0.05 0.00 -0.26 0.00 0.00 60.65 59.00 1a7o s ILE 21 Cb -0.14 -1.66 -0.04 0.00 1.25 0.00 0.00 42.46 41.87 1a7o s ILE 21 CO 0.03 0.28 -0.04 -0.89 0.24 0.00 0.00 174.94 174.55 1a7o s THR 22 N -0.82 3.76 -0.15 8.37 2.01 0.70 -1.26 115.64 128.25 1a7o s THR 22 Ca 0.10 -0.96 -0.01 0.00 0.31 0.00 0.00 61.69 61.13 1a7o s THR 22 Cb -0.09 -2.73 0.04 0.00 0.01 0.00 0.00 72.50 69.73 1a7o s THR 22 CO 0.02 0.22 -0.04 0.00 -0.69 0.00 0.00 174.62 174.13 1a7o s ARG 24 N 1.71 2.31 0.08 0.00 3.00 0.15 -1.00 118.95 125.20 1a7o s ARG 24 Ca 0.02 -0.82 0.02 0.00 0.00 0.00 0.00 55.73 54.94 1a7o s ARG 24 Cb -0.15 -2.28 -0.04 0.00 0.00 0.00 0.00 34.95 32.48 1a7o s ARG 24 CO -0.07 0.59 0.16 0.00 0.00 0.00 0.00 175.30 175.97 1a7o s ALA 25 N -0.81 3.80 -2.19 2.13 0.00 -0.29 -0.21 121.76 124.19 1a7o s ALA 25 Ca 0.13 -0.94 0.18 0.00 0.00 0.00 0.00 51.96 51.33 1a7o s ALA 25 Cb -0.11 -1.64 0.57 0.00 0.00 0.00 0.00 23.12 21.94 1a7o s ALA 25 CO 0.03 0.77 1.44 -1.13 0.00 0.00 0.00 175.76 176.86 1a7o n SER 26 N 0.29 2.01 -3.44 0.00 3.41 -0.44 -4.82 113.62 110.63 1a7o n SER 26 Ca -0.07 -1.84 -0.12 0.00 -0.26 0.00 0.00 58.87 56.58 1a7o n SER 26 Cb 0.52 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.26 1a7o n SER 26 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1a7o s GLY 27 N -1.35 -0.59 0.17 5.00 0.00 -1.26 -4.92 107.32 104.37 1a7o s GLY 27 Ca 0.31 0.67 -0.32 0.00 0.00 0.00 0.00 44.72 45.38 1a7o s GLY 27 CO 0.24 0.29 1.57 0.21 0.00 0.00 0.00 173.10 175.41 1a7o s ASN 28 N -2.51 6.57 0.00 1.64 3.84 -1.26 -4.67 114.94 118.55 1a7o s ASN 28 Ca -0.00 2.64 0.08 0.00 0.21 0.00 0.00 52.86 55.79 1a7o s ASN 28 Cb -0.01 -2.60 0.14 0.00 -0.55 0.00 0.00 41.25 38.24 1a7o s ASN 28 CO -0.10 -0.83 0.97 2.30 -2.79 0.00 0.00 177.10 176.65 1a7o n ILE 29 N 3.91 0.50 -4.05 -5.21 -5.35 -1.12 -5.02 119.36 103.01 1a7o n ILE 29 Ca 0.14 -0.75 -0.32 0.00 -0.27 0.00 0.00 62.75 61.55 1a7o n ILE 29 Cb 0.38 0.84 -0.01 0.00 -1.74 0.00 0.00 39.64 39.11 1a7o n ILE 29 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1a7o n HIS 30 N 0.35 -1.90 -0.85 4.28 8.25 -1.26 -2.00 115.22 122.09 1a7o n HIS 30 Ca 0.07 0.82 0.00 0.00 -0.26 0.00 0.00 57.72 58.35 1a7o n HIS 30 Cb 0.29 -3.49 0.00 0.00 1.12 0.00 0.00 29.99 27.91 1a7o n HIS 30 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1a7o n ASN 31 N -2.79 -2.24 -4.20 0.41 4.13 -1.26 -4.91 115.26 104.39 1a7o n ASN 31 Ca -0.03 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.80 1a7o n ASN 31 Cb 0.55 -1.83 0.00 0.00 -1.54 0.00 0.00 39.78 36.96 1a7o n ASN 31 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1a7o n TYR 32 N -2.20 4.13 -4.32 3.10 4.01 -0.85 -3.30 117.16 117.74 1a7o n TYR 32 Ca 0.00 -2.99 -0.23 0.00 -0.16 0.00 0.00 57.90 54.53 1a7o n TYR 32 Cb 0.14 -2.38 -0.17 0.00 -0.31 0.00 0.00 39.34 36.62 1a7o n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1a7o s LEU 33 N 2.26 1.44 0.20 7.72 2.96 -1.26 -1.89 118.68 130.11 1a7o s LEU 33 Ca 0.47 -0.22 0.10 0.00 -0.22 0.00 0.00 54.13 54.27 1a7o s LEU 33 Cb 0.06 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 46.06 1a7o s LEU 33 CO 0.01 -0.02 -0.16 0.00 -1.32 0.00 0.00 176.35 174.85 1a7o s ALA 34 N 0.89 2.76 -0.03 5.97 0.00 -0.08 -1.16 121.76 130.12 1a7o s ALA 34 Ca -0.11 -1.60 0.05 0.00 0.00 0.00 0.00 51.96 50.29 1a7o s ALA 34 Cb -0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.45 1a7o s ALA 34 CO 0.01 0.42 -0.17 -1.58 0.00 0.00 0.00 175.76 174.44 1a7o s TRP 35 N -1.82 1.60 0.06 0.00 0.52 0.11 -0.49 118.94 118.91 1a7o s TRP 35 Ca 0.24 -0.38 0.06 0.00 0.02 0.00 0.00 56.10 56.04 1a7o s TRP 35 Cb -0.08 -1.06 -0.03 0.00 -1.15 0.00 0.00 33.47 31.16 1a7o s TRP 35 CO 0.13 -0.09 -0.17 0.71 0.02 0.00 0.00 176.95 177.54 1a7o s TYR 36 N -0.18 1.51 -0.08 -1.98 1.51 0.26 -0.40 117.35 117.99 1a7o s TYR 36 Ca 0.01 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.69 1a7o s TYR 36 Cb -0.09 -0.87 -0.03 0.00 -0.11 0.00 0.00 41.96 40.86 1a7o s TYR 36 CO 0.01 0.09 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.31 1a7o s GLN 37 N -1.39 2.91 -0.08 -0.62 0.74 0.59 -1.55 119.66 120.25 1a7o s GLN 37 Ca 0.04 -0.59 0.00 0.00 0.05 0.00 0.00 55.36 54.86 1a7o s GLN 37 Cb -0.09 -2.60 0.02 0.00 1.10 0.00 0.00 33.01 31.45 1a7o s GLN 37 CO 0.02 0.54 -0.07 -1.14 -0.55 0.00 0.00 175.29 174.09 1a7o s GLN 38 N -0.49 1.35 0.26 1.67 0.74 0.17 -0.78 119.66 122.60 1a7o s GLN 38 Ca 0.07 -0.23 0.01 0.00 0.05 0.00 0.00 55.36 55.26 1a7o s GLN 38 Cb -0.12 -1.34 -0.04 0.00 1.10 0.00 0.00 33.01 32.61 1a7o s GLN 38 CO 0.02 -0.16 0.44 0.15 -0.55 0.00 0.00 175.29 175.19 1a7o s LYS 39 N 1.31 3.49 0.02 1.67 3.01 -1.26 -1.02 119.74 126.96 1a7o s LYS 39 Ca -0.03 -0.43 -0.36 0.00 -1.01 0.00 0.00 55.97 54.14 1a7o s LYS 39 Cb -0.14 -2.78 -0.15 0.00 -1.01 0.00 0.00 37.83 33.75 1a7o s LYS 39 CO -0.03 0.32 1.59 0.94 0.51 0.00 0.00 175.35 178.68 1a7o n GLN 40 N -1.23 1.68 -2.56 1.68 -0.06 -1.26 -1.92 117.38 113.71 1a7o n GLN 40 Ca -0.06 0.61 -0.18 0.00 -2.00 0.00 0.00 57.00 55.38 1a7o n GLN 40 Cb 0.55 -2.34 0.01 0.00 -4.06 0.00 0.00 30.24 24.40 1a7o n GLN 40 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1a7o n GLY 41 N 3.46 -0.32 3.27 1.69 0.00 -1.26 -5.02 105.19 107.01 1a7o n GLY 41 Ca 0.20 -0.11 -0.15 0.00 0.00 0.00 0.00 46.02 45.96 1a7o n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a7o s LYS 42 N -5.13 1.34 0.42 1.61 -0.14 -0.81 -5.15 119.74 111.89 1a7o s LYS 42 Ca 0.11 -1.72 -0.05 0.00 -1.36 0.00 0.00 55.97 52.94 1a7o s LYS 42 Cb -0.05 -0.03 -0.04 0.00 -1.68 0.00 0.00 37.83 36.03 1a7o s LYS 42 CO 0.13 -0.35 0.71 -1.54 -0.76 0.00 0.00 175.35 173.55 1a7o s SER 43 N -3.26 6.34 0.95 2.83 1.04 -1.26 -4.60 113.70 115.74 1a7o s SER 43 Ca 0.38 0.85 -0.12 0.00 0.48 0.00 0.00 55.95 57.55 1a7o s SER 43 Cb 0.07 -2.21 0.09 0.00 0.10 0.00 0.00 66.02 64.07 1a7o s SER 43 CO 0.13 -0.45 0.69 -2.65 0.98 0.00 0.00 173.24 171.95 1a7o n PRO 44 N -1.82 -0.47 -3.84 4.02 -0.02 -1.26 -4.58 135.00 127.03 1a7o n PRO 44 Ca -0.00 -0.09 -0.15 0.00 -2.02 0.00 0.00 63.50 61.24 1a7o n PRO 44 Cb 0.55 -2.06 -0.16 0.00 -0.02 0.00 0.00 33.50 31.82 1a7o n PRO 44 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1a7o s GLN 45 N -4.03 0.06 0.09 -0.52 1.11 0.04 -4.96 119.66 111.46 1a7o s GLN 45 Ca 0.61 0.12 -0.31 0.00 0.01 0.00 0.00 55.36 55.79 1a7o s GLN 45 Cb -0.22 -0.26 -0.08 0.00 -1.01 0.00 0.00 33.01 31.44 1a7o s GLN 45 CO 0.64 -0.12 1.55 -1.17 0.01 0.00 0.00 175.29 176.20 1a7o s LEU 46 N 0.82 4.36 -0.12 2.90 2.96 -1.26 -0.30 118.68 128.04 1a7o s LEU 46 Ca -0.07 2.44 -0.12 0.00 -0.22 0.00 0.00 54.13 56.16 1a7o s LEU 46 Cb -0.10 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 1a7o s LEU 46 CO -0.02 -0.81 -0.24 0.18 -1.32 0.00 0.00 176.35 174.14 1a7o n LEU 47 N 4.86 1.60 -4.11 -0.68 4.77 0.47 -4.74 117.00 119.16 1a7o n LEU 47 Ca 0.14 0.26 -0.20 0.00 -0.03 0.00 0.00 56.01 56.18 1a7o n LEU 47 Cb 0.41 -0.60 -0.14 0.00 -2.33 0.00 0.00 43.42 40.76 1a7o n LEU 47 CO 0.61 -0.21 -0.46 -0.69 -1.33 0.00 0.00 177.39 175.31 1a7o s VAL 48 N -2.55 1.04 0.06 4.08 1.01 -1.10 -0.03 120.40 122.91 1a7o s VAL 48 Ca -0.22 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 60.94 1a7o s VAL 48 Cb 0.05 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1a7o s VAL 48 CO 0.31 0.10 -0.04 -0.72 0.00 0.00 0.00 175.10 174.75 1a7o s TYR 49 N -0.64 0.57 -1.43 5.22 1.13 0.13 -0.72 117.35 121.62 1a7o s TYR 49 Ca 0.02 -1.04 -0.02 0.00 -1.41 0.00 0.00 57.07 54.63 1a7o s TYR 49 Cb -0.07 -0.41 0.02 0.00 -1.10 0.00 0.00 41.96 40.40 1a7o s TYR 49 CO 0.01 -0.34 0.48 0.98 -2.51 0.00 0.00 175.55 174.16 1a7o n TYR 50 N 0.11 -1.69 0.00 -3.49 9.36 -1.09 -0.73 117.16 119.64 1a7o n TYR 50 Ca -0.14 0.76 0.00 0.00 3.32 0.00 0.00 57.90 61.84 1a7o n TYR 50 Cb 0.61 -3.72 0.00 0.00 -0.63 0.00 0.00 39.34 35.60 1a7o n TYR 50 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1a7o n THR 51 N -4.40 0.00 0.01 2.97 -1.04 -0.31 -4.12 114.28 107.39 1a7o n THR 51 Ca -0.27 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 1a7o n THR 51 Cb 0.67 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 69.17 1a7o n THR 51 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1a7o n THR 52 N 0.00 0.00 -2.71 12.58 -2.24 -1.20 -3.64 114.28 117.07 1a7o n THR 52 Ca 0.00 -0.44 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 1a7o n THR 52 Cb 0.00 0.95 -0.03 0.00 -2.10 0.00 0.00 70.33 69.15 1a7o n THR 52 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a7o s THR 53 N -1.14 4.76 0.31 4.28 2.01 0.09 -4.64 115.64 121.31 1a7o s THR 53 Ca 0.00 1.97 -0.27 0.00 0.31 0.00 0.00 61.69 63.70 1a7o s THR 53 Cb 0.00 -4.29 -0.09 0.00 0.01 0.00 0.00 72.50 68.13 1a7o s THR 53 CO 0.01 -0.06 1.00 -0.76 -0.69 0.00 0.00 174.62 174.12 1a7o s LEU 54 N 2.47 4.43 0.76 4.42 1.43 -1.26 0.20 118.68 131.13 1a7o s LEU 54 Ca 0.45 2.00 -0.11 0.00 -1.03 0.00 0.00 54.13 55.44 1a7o s LEU 54 Cb -0.17 -3.86 0.05 0.00 0.03 0.00 0.00 46.19 42.24 1a7o s LEU 54 CO 0.13 -0.10 1.08 0.00 0.23 0.00 0.00 176.35 177.68 1a7o s ALA 55 N -1.41 2.38 0.44 4.21 0.00 0.96 -4.89 121.76 123.45 1a7o s ALA 55 Ca 0.48 -0.04 -0.25 0.00 0.00 0.00 0.00 51.96 52.15 1a7o s ALA 55 Cb -0.24 -3.15 -0.08 0.00 0.00 0.00 0.00 23.12 19.65 1a7o s ALA 55 CO 0.30 -1.57 1.34 -0.51 0.00 0.00 0.00 175.76 175.32 1a7o s ASP 56 N -3.79 6.05 0.00 0.00 1.11 -1.26 -2.20 116.67 116.58 1a7o s ASP 56 Ca 0.60 2.72 0.00 0.00 0.18 0.00 0.00 52.55 56.05 1a7o s ASP 56 Cb -0.15 -2.64 0.00 0.00 1.07 0.00 0.00 42.92 41.20 1a7o s ASP 56 CO 0.55 -1.04 0.00 0.61 1.18 0.00 0.00 175.17 176.47 1a7o n GLY 57 N 0.63 2.76 3.70 0.21 0.00 -1.26 -4.98 105.19 106.25 1a7o n GLY 57 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1a7o n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a7o s VAL 58 N -2.23 4.00 0.69 1.61 1.01 -0.94 -4.99 120.40 119.55 1a7o s VAL 58 Ca 0.00 1.39 -0.16 0.00 0.00 0.00 0.00 61.98 63.21 1a7o s VAL 58 Cb 0.00 -3.90 0.02 0.00 0.00 0.00 0.00 36.38 32.50 1a7o s VAL 58 CO 0.00 0.05 1.24 -2.16 0.00 0.00 0.00 175.10 174.23 1a7o s PRO 59 N 1.75 2.33 0.00 2.72 0.04 -1.26 -4.90 135.00 135.68 1a7o s PRO 59 Ca 0.59 1.88 0.23 0.00 0.04 0.00 0.00 61.00 63.75 1a7o s PRO 59 Cb -0.29 -1.84 1.39 0.00 0.04 0.00 0.00 34.50 33.80 1a7o s PRO 59 CO 0.26 -1.72 1.81 -1.13 0.04 0.00 0.00 177.00 176.27 1a7o n SER 60 N -2.35 0.00 0.01 6.66 3.41 -1.26 -3.01 113.62 117.07 1a7o n SER 60 Ca 0.14 -1.00 0.10 0.00 -0.26 0.00 0.00 58.87 57.85 1a7o n SER 60 Cb 0.49 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.88 1a7o n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1a7o n ARG 61 N -0.92 0.01 -3.54 4.33 1.85 -1.26 -4.67 116.66 112.46 1a7o n ARG 61 Ca 0.17 0.16 -0.37 0.00 -1.00 0.00 0.00 57.85 56.82 1a7o n ARG 61 Cb 0.08 -1.52 -0.07 0.00 -1.05 0.00 0.00 32.46 29.90 1a7o n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1a7o s PHE 62 N -3.01 3.54 -0.09 2.89 0.08 -1.16 -0.05 117.98 120.17 1a7o s PHE 62 Ca 0.10 0.71 -0.12 0.00 0.12 0.00 0.00 56.93 57.74 1a7o s PHE 62 Cb 0.13 -2.32 0.03 0.00 -0.57 0.00 0.00 43.02 40.29 1a7o s PHE 62 CO 0.38 0.36 0.30 -1.54 -0.10 0.00 0.00 175.22 174.62 1a7o s SER 63 N 0.02 -0.28 0.24 1.36 1.04 0.55 -5.00 113.70 111.63 1a7o s SER 63 Ca 0.19 0.46 0.10 0.00 0.48 0.00 0.00 55.95 57.18 1a7o s SER 63 Cb -0.14 0.54 -0.04 0.00 0.10 0.00 0.00 66.02 66.48 1a7o s SER 63 CO 0.07 -0.20 -0.07 -0.83 0.98 0.00 0.00 173.24 173.19 1a7o s GLY 64 N -0.25 1.72 0.27 7.32 0.00 -1.26 -0.07 107.32 115.04 1a7o s GLY 64 Ca -0.04 -1.63 -0.16 0.00 0.00 0.00 0.00 44.72 42.89 1a7o s GLY 64 CO 0.01 -1.68 0.59 -1.35 0.00 0.00 0.00 173.10 170.68 1a7o s SER 65 N -3.34 -0.15 0.00 1.64 1.04 -0.09 -4.43 113.70 108.37 1a7o s SER 65 Ca 0.29 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1a7o s SER 65 Cb -0.07 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.71 1a7o s SER 65 CO 0.17 -1.25 0.00 0.61 0.98 0.00 0.00 173.24 173.75 1a7o n GLY 66 N -0.42 2.76 3.69 7.32 0.00 -1.26 -0.68 105.19 116.60 1a7o n GLY 66 Ca -0.03 -1.84 -0.03 0.00 0.00 0.00 0.00 46.02 44.12 1a7o n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a7o s SER 67 N 0.00 -0.19 1.97 1.61 1.04 -0.79 -4.95 113.70 112.38 1a7o s SER 67 Ca 0.00 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.14 1a7o s SER 67 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1a7o s SER 67 CO 0.00 -0.75 0.00 0.61 0.98 0.00 0.00 173.24 174.08 1a7o n GLY 68 N -0.43 3.35 0.41 7.32 0.00 -1.26 -2.04 105.19 112.54 1a7o n GLY 68 Ca -0.07 0.22 0.04 0.00 0.00 0.00 0.00 46.02 46.22 1a7o n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a7o n THR 69 N 0.00 1.19 -3.92 2.61 -2.24 -1.26 -2.81 114.28 107.85 1a7o n THR 69 Ca 0.00 -1.17 -0.28 0.00 -2.27 0.00 0.00 64.05 60.33 1a7o n THR 69 Cb 0.00 0.37 -0.17 0.00 -2.10 0.00 0.00 70.33 68.44 1a7o n THR 69 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1a7o s GLN 70 N -1.31 1.60 0.09 -0.78 2.00 -0.87 -1.14 119.66 119.26 1a7o s GLN 70 Ca 0.18 -0.40 0.03 0.00 -2.00 0.00 0.00 55.36 53.17 1a7o s GLN 70 Cb 0.11 -1.82 -0.03 0.00 0.80 0.00 0.00 33.01 32.06 1a7o s GLN 70 CO 0.09 -0.33 -0.10 0.71 -0.50 0.00 0.00 175.29 175.17 1a7o s TYR 71 N 1.65 1.00 0.02 1.67 1.51 -0.17 -1.89 117.35 121.13 1a7o s TYR 71 Ca 0.03 -0.65 -0.02 0.00 -1.01 0.00 0.00 57.07 55.42 1a7o s TYR 71 Cb -0.14 -0.56 -0.02 0.00 -0.11 0.00 0.00 41.96 41.14 1a7o s TYR 71 CO -0.08 -0.02 0.01 -1.12 -1.11 0.00 0.00 175.55 173.22 1a7o s SER 72 N -2.35 0.22 -0.15 2.29 0.01 0.15 -0.52 113.70 113.35 1a7o s SER 72 Ca 0.04 -0.49 -0.00 0.00 1.31 0.00 0.00 55.95 56.80 1a7o s SER 72 Cb -0.03 0.14 0.03 0.00 0.21 0.00 0.00 66.02 66.36 1a7o s SER 72 CO -0.00 -0.35 -0.10 -0.22 0.41 0.00 0.00 173.24 172.98 1a7o s LEU 73 N -1.62 1.57 -0.16 2.44 2.96 -0.39 -0.91 118.68 122.57 1a7o s LEU 73 Ca -0.13 -0.51 -0.04 0.00 -0.22 0.00 0.00 54.13 53.23 1a7o s LEU 73 Cb -0.07 -1.02 -0.03 0.00 0.50 0.00 0.00 46.19 45.57 1a7o s LEU 73 CO -0.02 -0.11 -0.03 -0.75 -1.32 0.00 0.00 176.35 174.12 1a7o s LYS 74 N 1.58 3.69 -0.29 1.98 2.20 0.90 -0.28 119.74 129.52 1a7o s LYS 74 Ca 0.03 -0.51 0.01 0.00 -0.36 0.00 0.00 55.97 55.14 1a7o s LYS 74 Cb -0.14 -2.94 0.06 0.00 -1.51 0.00 0.00 37.83 33.30 1a7o s LYS 74 CO -0.09 0.24 -0.04 0.42 -0.36 0.00 0.00 175.35 175.52 1a7o s ILE 75 N 0.37 2.59 0.09 5.43 1.01 0.61 -0.33 121.20 130.97 1a7o s ILE 75 Ca -0.04 -1.58 -0.29 0.00 0.00 0.00 0.00 60.65 58.75 1a7o s ILE 75 Cb -0.14 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.74 1a7o s ILE 75 CO 0.03 -0.12 0.92 0.20 0.00 0.00 0.00 174.94 175.96 1a7o s ASN 76 N 1.18 7.43 -0.17 3.58 0.01 0.93 -1.09 114.94 126.81 1a7o s ASN 76 Ca -0.06 1.71 -0.15 0.00 -0.71 0.00 0.00 52.86 53.65 1a7o s ASN 76 Cb -0.20 -2.56 0.02 0.00 0.41 0.00 0.00 41.25 38.92 1a7o s ASN 76 CO -0.03 -0.06 0.25 -0.24 -1.51 0.00 0.00 177.10 175.51 1a7o n SER 77 N 2.84 -5.61 -4.61 -1.22 2.88 -0.90 -4.78 113.62 102.21 1a7o n SER 77 Ca 0.01 0.15 -0.46 0.00 -1.33 0.00 0.00 58.87 57.25 1a7o n SER 77 Cb 0.49 -1.45 -0.03 0.00 -0.75 0.00 0.00 64.21 62.48 1a7o n SER 77 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1a7o n LEU 78 N 0.66 2.11 -4.77 2.46 4.77 0.27 -4.46 117.00 118.04 1a7o n LEU 78 Ca -0.03 1.16 -0.25 0.00 -0.03 0.00 0.00 56.01 56.86 1a7o n LEU 78 Cb 0.53 -1.31 -0.06 0.00 -2.33 0.00 0.00 43.42 40.26 1a7o n LEU 78 CO 0.21 -1.11 -0.23 -1.10 -1.33 0.00 0.00 177.39 173.83 1a7o s GLN 79 N -0.95 2.76 0.48 3.23 -1.52 -1.26 0.02 119.66 122.41 1a7o s GLN 79 Ca 0.65 -1.02 0.16 0.00 -1.95 0.00 0.00 55.36 53.21 1a7o s GLN 79 Cb -0.73 -2.53 1.15 0.00 -0.22 0.00 0.00 33.01 30.69 1a7o s GLN 79 CO 0.55 0.44 2.04 -1.35 -0.25 0.00 0.00 175.29 176.73 1a7o h PRO 80 N 2.16 0.22 0.00 2.91 0.11 -1.99 -0.80 132.00 134.60 1a7o h PRO 80 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1a7o h PRO 80 Cb 1.22 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1a7o h PRO 80 CO 0.61 0.15 0.00 0.38 -0.21 0.00 0.00 178.00 178.93 1a7o h ASP 81 N 0.23 0.00 0.82 -2.05 2.03 -2.02 -3.11 116.42 112.33 1a7o h ASP 81 Ca 0.18 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.48 1a7o h ASP 81 Cb 0.42 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.92 1a7o h ASP 81 CO -0.03 0.00 -0.54 0.47 -1.03 0.00 0.00 179.24 178.11 1a7o n ASP 82 N -2.63 0.62 -4.77 4.15 8.00 -0.31 -4.94 116.55 116.68 1a7o n ASP 82 Ca 0.00 0.08 -0.35 0.00 0.71 0.00 0.00 54.79 55.24 1a7o n ASP 82 Cb 0.20 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 1a7o n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1a7o s PHE 83 N -3.12 2.66 -5.00 1.24 0.08 -1.18 -4.88 117.98 107.79 1a7o s PHE 83 Ca 0.08 1.54 0.00 0.00 0.12 0.00 0.00 56.93 58.67 1a7o s PHE 83 Cb 0.14 -3.31 0.00 0.00 -0.57 0.00 0.00 43.02 39.28 1a7o s PHE 83 CO 0.70 -1.62 0.00 0.41 -0.10 0.00 0.00 175.22 174.61 1a7o n GLY 84 N 0.21 0.39 3.61 4.36 0.00 -0.27 -4.88 105.19 108.61 1a7o n GLY 84 Ca 0.11 -1.61 -0.34 0.00 0.00 0.00 0.00 46.02 44.19 1a7o n GLY 84 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a7o s SER 85 N -4.00 4.83 -0.07 1.61 0.01 -0.19 -0.14 113.70 115.76 1a7o s SER 85 Ca 0.00 0.03 0.05 0.00 1.31 0.00 0.00 55.95 57.34 1a7o s SER 85 Cb 0.00 -1.27 -0.01 0.00 0.21 0.00 0.00 66.02 64.95 1a7o s SER 85 CO 0.00 0.36 -0.23 -0.31 0.41 0.00 0.00 173.24 173.48 1a7o s TYR 86 N -0.81 2.52 -0.03 2.43 1.51 0.32 0.46 117.35 123.74 1a7o s TYR 86 Ca 0.12 -0.69 0.04 0.00 -1.01 0.00 0.00 57.07 55.53 1a7o s TYR 86 Cb -0.11 -1.64 -0.00 0.00 -0.11 0.00 0.00 41.96 40.10 1a7o s TYR 86 CO 0.02 -0.19 -0.13 0.71 -1.11 0.00 0.00 175.55 174.84 1a7o s TYR 87 N -0.12 1.26 0.10 2.71 2.02 -0.59 -0.32 117.35 122.40 1a7o s TYR 87 Ca -0.04 -0.31 0.04 0.00 -0.37 0.00 0.00 57.07 56.38 1a7o s TYR 87 Cb -0.14 -0.85 -0.04 0.00 -0.40 0.00 0.00 41.96 40.53 1a7o s TYR 87 CO 0.04 -0.09 0.09 0.00 -1.57 0.00 0.00 175.55 174.02 1a7o s GLN 89 N -2.56 0.25 0.32 0.00 0.74 0.35 -0.90 119.66 117.86 1a7o s GLN 89 Ca 0.30 0.34 0.08 0.00 0.05 0.00 0.00 55.36 56.13 1a7o s GLN 89 Cb -0.12 0.08 -0.04 0.00 1.10 0.00 0.00 33.01 34.03 1a7o s GLN 89 CO 0.22 -0.05 0.12 -3.38 -0.55 0.00 0.00 175.29 171.65 1a7o s HIS 90 N 0.31 2.73 -0.21 1.67 -3.43 -0.97 -0.90 115.29 114.48 1a7o s HIS 90 Ca -0.02 -0.34 0.20 0.00 -0.80 0.00 0.00 55.06 54.10 1a7o s HIS 90 Cb -0.03 -1.55 0.48 0.00 -1.43 0.00 0.00 32.58 30.05 1a7o s HIS 90 CO -0.01 0.40 1.14 1.19 -2.00 0.00 0.00 174.74 175.46 1a7o n PHE 91 N -1.10 1.21 -3.38 0.38 3.01 -0.79 -3.46 117.46 113.33 1a7o n PHE 91 Ca -0.04 -1.79 -0.45 0.00 1.01 0.00 0.00 57.45 56.18 1a7o n PHE 91 Cb 0.61 -0.24 -0.05 0.00 -0.01 0.00 0.00 39.48 39.79 1a7o n PHE 91 CO 0.00 0.00 0.00 -0.46 1.01 0.00 0.00 176.76 177.31 1a7o s TRP 92 N -2.99 3.36 0.00 1.38 -0.11 -1.26 -4.91 118.94 114.41 1a7o s TRP 92 Ca 0.34 -1.55 0.00 0.00 1.22 0.00 0.00 56.10 56.11 1a7o s TRP 92 Cb 0.35 -3.72 0.00 0.00 -1.50 0.00 0.00 33.47 28.60 1a7o s TRP 92 CO -0.05 -1.01 0.00 -1.13 -4.62 0.00 0.00 176.95 170.14 1a7o n SER 93 N 4.96 0.00 -4.68 5.86 3.41 -1.26 -4.69 113.62 117.23 1a7o n SER 93 Ca -0.08 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.10 1a7o n SER 93 Cb 0.41 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 1a7o n SER 93 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1a7o s THR 94 N 0.00 3.58 0.43 6.66 2.01 -1.26 -4.94 115.64 122.11 1a7o s THR 94 Ca 0.00 0.89 -0.25 0.00 0.31 0.00 0.00 61.69 62.63 1a7o s THR 94 Cb 0.00 -3.57 -0.08 0.00 0.01 0.00 0.00 72.50 68.86 1a7o s THR 94 CO 0.00 -0.03 1.33 -2.16 -0.69 0.00 0.00 174.62 173.07 1a7o s PRO 95 N 3.06 3.85 0.10 4.92 0.04 -1.26 -4.67 135.00 141.03 1a7o s PRO 95 Ca 0.68 2.21 -0.04 0.00 0.04 0.00 0.00 61.00 63.88 1a7o s PRO 95 Cb -0.33 -2.69 -0.02 0.00 0.04 0.00 0.00 34.50 31.50 1a7o s PRO 95 CO 0.28 -0.61 0.10 0.95 0.04 0.00 0.00 177.00 177.76 1a7o s THR 97 N -1.26 0.15 0.11 1.26 -4.23 -1.22 -5.02 115.64 105.43 1a7o s THR 97 Ca 0.59 -1.60 0.08 0.00 -1.18 0.00 0.00 61.69 59.59 1a7o s THR 97 Cb -0.39 -1.65 -0.04 0.00 1.34 0.00 0.00 72.50 71.76 1a7o s THR 97 CO 0.50 -0.66 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.40 1a7o s PHE 98 N -3.94 2.58 0.79 3.99 0.40 -1.26 -2.30 117.98 118.24 1a7o s PHE 98 Ca 0.12 -0.24 -0.11 0.00 -0.60 0.00 0.00 56.93 56.10 1a7o s PHE 98 Cb 0.06 -1.37 0.08 0.00 0.51 0.00 0.00 43.02 42.30 1a7o s PHE 98 CO -0.06 0.39 1.16 0.20 0.70 0.00 0.00 175.22 177.61 1a7o s GLY 99 N -2.14 1.60 0.27 4.36 0.00 -0.08 -4.48 107.32 106.85 1a7o s GLY 99 Ca 0.19 -0.68 0.22 0.00 0.00 0.00 0.00 44.72 44.45 1a7o s GLY 99 CO 0.11 -0.20 1.68 0.61 0.00 0.00 0.00 173.10 175.30 1a7o n GLY 100 N -3.26 -1.12 0.00 0.20 0.00 -1.26 -4.74 105.19 95.01 1a7o n GLY 100 Ca 0.08 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1a7o n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a7o n GLY 101 N -0.46 0.29 2.97 -0.02 0.00 -1.26 -5.03 105.19 101.69 1a7o n GLY 101 Ca 0.01 -1.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.16 1a7o n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a7o s THR 102 N -2.83 1.14 -0.29 2.61 2.01 0.56 -4.61 115.64 114.23 1a7o s THR 102 Ca 0.00 -0.41 -0.19 0.00 0.31 0.00 0.00 61.69 61.40 1a7o s THR 102 Cb 0.00 -1.09 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 1a7o s THR 102 CO 0.00 0.37 0.55 -0.75 -0.69 0.00 0.00 174.62 174.11 1a7o s LYS 103 N 1.22 3.96 -0.39 4.92 2.20 0.18 -0.52 119.74 131.30 1a7o s LYS 103 Ca -0.04 0.25 -0.11 0.00 -0.36 0.00 0.00 55.97 55.72 1a7o s LYS 103 Cb -0.14 -3.70 0.04 0.00 -1.51 0.00 0.00 37.83 32.52 1a7o s LYS 103 CO -0.03 -0.46 0.23 -1.17 -0.36 0.00 0.00 175.35 173.56 1a7o s LEU 104 N 2.42 4.88 -0.09 5.43 0.20 0.81 -0.36 118.68 131.97 1a7o s LEU 104 Ca 0.22 -1.12 0.03 0.00 0.69 0.00 0.00 54.13 53.96 1a7o s LEU 104 Cb -0.15 -2.03 -0.01 0.00 -0.43 0.00 0.00 46.19 43.56 1a7o s LEU 104 CO 0.10 -0.44 -0.19 -1.61 -0.29 0.00 0.00 176.35 173.93 1a7o s GLU 105 N 1.54 2.89 0.22 1.98 2.02 -0.10 -1.12 118.70 126.13 1a7o s GLU 105 Ca 0.02 -0.79 -0.32 0.00 0.02 0.00 0.00 54.97 53.91 1a7o s GLU 105 Cb -0.20 -2.38 -0.12 0.00 0.10 0.00 0.00 34.13 31.53 1a7o s GLU 105 CO 0.06 0.35 1.69 1.51 0.02 0.00 0.00 175.26 178.89 1a7o n ILE 106 N 3.09 0.18 1.66 -1.63 3.06 -1.26 -0.32 119.36 124.15 1a7o n ILE 106 Ca -0.18 -0.05 0.15 0.00 -2.50 0.00 0.00 62.75 60.17 1a7o n ILE 106 Cb 0.52 -1.96 0.66 0.00 0.54 0.00 0.00 39.64 39.41 1a7o n ILE 106 CO 0.00 0.00 0.00 1.17 -2.50 0.00 0.00 176.55 175.22