#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lqv s LEU 8 N 0.00 4.83 -0.07 0.99 2.96 -1.26 -4.25 118.68 121.88 1lqv s LEU 8 Ca 0.00 -0.92 -0.30 0.00 -0.22 0.00 0.00 54.13 52.69 1lqv s LEU 8 Cb 0.00 -2.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 1lqv s LEU 8 CO 0.00 -1.06 1.17 -1.10 -1.32 0.00 0.00 176.35 174.04 1lqv s GLN 9 N 3.04 4.36 0.06 1.98 -0.21 -1.23 -4.90 119.66 122.76 1lqv s GLN 9 Ca 0.18 1.63 -0.16 0.00 0.02 0.00 0.00 55.36 57.03 1lqv s GLN 9 Cb -0.19 -3.56 0.03 0.00 1.00 0.00 0.00 33.01 30.29 1lqv s GLN 9 CO 0.12 -0.44 0.37 -0.98 -2.12 0.00 0.00 175.29 172.24 1lqv s ARG 10 N 2.24 0.91 -0.12 2.91 1.70 -1.26 -0.65 118.95 124.68 1lqv s ARG 10 Ca 0.55 -0.50 0.00 0.00 -0.47 0.00 0.00 55.73 55.31 1lqv s ARG 10 Cb -0.23 0.40 0.02 0.00 -0.57 0.00 0.00 34.95 34.57 1lqv s ARG 10 CO 0.21 -0.32 -0.11 -1.17 -1.08 0.00 0.00 175.30 172.84 1lqv s LEU 11 N -2.22 1.41 0.13 -1.89 2.96 -0.76 -1.85 118.68 116.46 1lqv s LEU 11 Ca -0.03 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1lqv s LEU 11 Cb -0.00 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 1lqv s LEU 11 CO -0.05 -0.09 0.04 -1.00 -1.32 0.00 0.00 176.35 173.93 1lqv s HIS 12 N 1.56 3.00 -0.02 5.38 3.76 -0.36 -1.84 115.29 126.77 1lqv s HIS 12 Ca 0.04 -0.05 -0.02 0.00 -0.15 0.00 0.00 55.06 54.89 1lqv s HIS 12 Cb -0.13 -1.49 0.01 0.00 1.11 0.00 0.00 32.58 32.08 1lqv s HIS 12 CO -0.09 0.50 0.05 -1.64 -0.85 0.00 0.00 174.74 172.72 1lqv s MET 13 N -2.69 0.05 -0.03 1.40 -1.94 0.66 -2.15 119.30 114.59 1lqv s MET 13 Ca 0.28 0.10 0.03 0.00 -1.71 0.00 0.00 55.69 54.39 1lqv s MET 13 Cb -0.11 -0.02 -0.00 0.00 2.01 0.00 0.00 34.83 36.71 1lqv s MET 13 CO 0.20 -0.04 -0.12 -1.17 -0.01 0.00 0.00 175.02 173.87 1lqv s LEU 14 N 0.24 1.85 -0.05 -0.03 2.96 0.15 -1.38 118.68 122.43 1lqv s LEU 14 Ca -0.02 -0.26 -0.01 0.00 -0.22 0.00 0.00 54.13 53.63 1lqv s LEU 14 Cb -0.03 -0.72 0.03 0.00 0.50 0.00 0.00 46.19 45.97 1lqv s LEU 14 CO -0.01 0.11 0.01 -1.58 -1.32 0.00 0.00 176.35 173.56 1lqv s GLN 15 N 0.10 0.37 -0.10 1.98 0.74 -0.16 -1.33 119.66 121.26 1lqv s GLN 15 Ca -0.03 0.13 0.02 0.00 0.05 0.00 0.00 55.36 55.53 1lqv s GLN 15 Cb -0.09 -0.67 -0.02 0.00 1.10 0.00 0.00 33.01 33.33 1lqv s GLN 15 CO 0.01 -0.22 -0.16 0.42 -0.55 0.00 0.00 175.29 174.79 1lqv s ILE 16 N 1.53 2.86 -0.20 -2.34 -1.09 0.12 -0.67 121.20 121.41 1lqv s ILE 16 Ca -0.02 -0.76 0.01 0.00 -2.23 0.00 0.00 60.65 57.65 1lqv s ILE 16 Cb -0.13 -2.15 0.04 0.00 -1.58 0.00 0.00 42.46 38.64 1lqv s ILE 16 CO -0.03 0.55 -0.09 -0.44 -1.23 0.00 0.00 174.94 173.70 1lqv s SER 17 N -0.01 3.34 -0.38 3.58 0.01 0.20 -1.09 113.70 119.35 1lqv s SER 17 Ca -0.05 -0.87 -0.15 0.00 1.31 0.00 0.00 55.95 56.19 1lqv s SER 17 Cb -0.14 -1.19 0.00 0.00 0.21 0.00 0.00 66.02 64.90 1lqv s SER 17 CO 0.04 -0.15 0.34 -0.31 0.41 0.00 0.00 173.24 173.56 1lqv s TYR 18 N 1.43 3.21 -0.41 2.43 2.02 0.21 -1.04 117.35 125.21 1lqv s TYR 18 Ca -0.01 -0.32 -0.15 0.00 -0.37 0.00 0.00 57.07 56.22 1lqv s TYR 18 Cb -0.16 -2.66 0.02 0.00 -0.40 0.00 0.00 41.96 38.76 1lqv s TYR 18 CO -0.08 -0.53 0.30 -0.06 -1.57 0.00 0.00 175.55 173.61 1lqv s PHE 19 N 1.88 3.24 0.18 2.71 0.40 0.40 -1.18 117.98 125.62 1lqv s PHE 19 Ca 0.09 -0.58 -0.03 0.00 -0.60 0.00 0.00 56.93 55.81 1lqv s PHE 19 Cb -0.18 -2.60 0.08 0.00 0.51 0.00 0.00 43.02 40.84 1lqv s PHE 19 CO 0.11 -0.59 1.47 0.00 0.70 0.00 0.00 175.22 176.91 1lqv h ARG 20 N 8.63 0.50 0.00 0.44 3.08 -1.80 -1.81 114.38 123.42 1lqv h ARG 20 Ca -0.27 -0.36 -0.14 0.00 0.07 0.00 0.00 59.98 59.29 1lqv h ARG 20 Cb 1.12 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.20 1lqv h ARG 20 CO 0.73 0.97 0.03 -0.40 -1.07 0.00 0.00 179.97 180.23 1lqv n ASP 21 N -3.91 -1.40 -0.07 7.04 5.68 -1.26 -4.11 116.55 118.52 1lqv n ASP 21 Ca -0.04 -2.40 0.07 0.00 -0.50 0.00 0.00 54.79 51.92 1lqv n ASP 21 Cb 0.65 2.46 0.42 0.00 -1.14 0.00 0.00 41.12 43.51 1lqv n ASP 21 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 1lqv h PRO 22 N 0.00 0.56 -0.00 0.11 0.11 -1.98 -3.21 132.00 127.59 1lqv h PRO 22 Ca -0.24 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1lqv h PRO 22 Cb 0.96 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1lqv h PRO 22 CO 0.31 0.37 -0.72 0.66 -0.21 0.00 0.00 178.00 178.41 1lqv n TYR 23 N -4.47 0.00 -4.96 0.65 4.01 -1.26 -4.69 117.16 106.43 1lqv n TYR 23 Ca 0.07 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.52 1lqv n TYR 23 Cb 0.18 -0.08 -0.17 0.00 -0.31 0.00 0.00 39.34 38.97 1lqv n TYR 23 CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 1lqv s HIS 24 N -2.87 2.04 -0.00 -0.72 3.76 -1.21 -5.04 115.29 111.25 1lqv s HIS 24 Ca 0.12 -0.74 -0.02 0.00 -0.15 0.00 0.00 55.06 54.27 1lqv s HIS 24 Cb 0.17 -1.39 -0.00 0.00 1.11 0.00 0.00 32.58 32.47 1lqv s HIS 24 CO 0.75 -0.30 0.03 0.54 -0.85 0.00 0.00 174.74 174.92 1lqv s VAL 25 N 0.30 0.05 -0.18 -0.90 0.11 -1.26 -2.81 120.40 115.71 1lqv s VAL 25 Ca -0.12 -0.39 -0.03 0.00 -2.93 0.00 0.00 61.98 58.50 1lqv s VAL 25 Cb -0.15 -0.18 -0.02 0.00 -1.53 0.00 0.00 36.38 34.50 1lqv s VAL 25 CO 0.05 -0.22 -0.06 0.86 -3.33 0.00 0.00 175.10 172.41 1lqv s TRP 26 N -0.65 2.95 0.05 1.54 -0.11 -0.32 -1.22 118.94 121.18 1lqv s TRP 26 Ca -0.07 -0.63 0.01 0.00 1.22 0.00 0.00 56.10 56.62 1lqv s TRP 26 Cb -0.04 -2.00 -0.04 0.00 -1.50 0.00 0.00 33.47 29.89 1lqv s TRP 26 CO -0.00 -0.29 0.14 0.71 -4.62 0.00 0.00 176.95 172.89 1lqv s TYR 27 N 0.84 3.38 -0.21 5.86 2.02 -0.04 -0.61 117.35 128.58 1lqv s TYR 27 Ca -0.02 0.20 -0.06 0.00 -0.37 0.00 0.00 57.07 56.82 1lqv s TYR 27 Cb -0.15 -1.72 0.10 0.00 -0.40 0.00 0.00 41.96 39.80 1lqv s TYR 27 CO 0.01 0.57 0.43 -1.14 -1.57 0.00 0.00 175.55 173.86 1lqv s GLN 28 N -2.28 0.35 0.34 -0.62 0.74 -0.25 -1.67 119.66 116.27 1lqv s GLN 28 Ca 0.30 1.00 -0.11 0.00 0.05 0.00 0.00 55.36 56.60 1lqv s GLN 28 Cb -0.13 0.27 0.03 0.00 1.10 0.00 0.00 33.01 34.28 1lqv s GLN 28 CO 0.23 -0.31 0.63 0.20 -0.55 0.00 0.00 175.29 175.48 1lqv s GLY 29 N 2.63 0.78 0.24 2.59 0.00 0.75 0.10 107.32 114.42 1lqv s GLY 29 Ca 0.01 -1.03 -0.22 0.00 0.00 0.00 0.00 44.72 43.48 1lqv s GLY 29 CO -0.14 -0.60 0.84 0.54 0.00 0.00 0.00 173.10 173.75 1lqv s ASN 30 N -3.12 -0.17 0.03 1.64 2.20 -0.44 -0.98 114.94 114.10 1lqv s ASN 30 Ca 0.22 -0.61 -0.03 0.00 -0.94 0.00 0.00 52.86 51.49 1lqv s ASN 30 Cb -0.03 0.64 -0.02 0.00 -2.00 0.00 0.00 41.25 39.84 1lqv s ASN 30 CO 0.14 -1.21 0.03 0.00 -2.94 0.00 0.00 177.10 173.13 1lqv s ALA 31 N -3.34 0.10 -0.02 3.54 0.00 -0.66 -0.67 121.76 120.71 1lqv s ALA 31 Ca 0.13 -0.69 -0.03 0.00 0.00 0.00 0.00 51.96 51.37 1lqv s ALA 31 Cb -0.04 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.30 1lqv s ALA 31 CO 0.06 -0.28 0.07 -1.12 0.00 0.00 0.00 175.76 174.49 1lqv s SER 32 N -2.08 -0.02 -0.35 0.00 0.01 -0.91 -0.95 113.70 109.40 1lqv s SER 32 Ca -0.06 -0.00 -0.09 0.00 1.31 0.00 0.00 55.95 57.11 1lqv s SER 32 Cb -0.02 0.17 0.02 0.00 0.21 0.00 0.00 66.02 66.40 1lqv s SER 32 CO -0.05 -0.13 0.16 -0.76 0.41 0.00 0.00 173.24 172.88 1lqv s LEU 33 N -0.44 4.45 0.00 2.44 1.43 -0.32 -1.23 118.68 125.01 1lqv s LEU 33 Ca -0.05 -0.95 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 1lqv s LEU 33 Cb -0.03 -1.97 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1lqv s LEU 33 CO 0.00 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1lqv n GLY 34 N 4.93 2.85 1.25 -3.19 0.00 -0.77 -1.60 105.19 108.66 1lqv n GLY 34 Ca -0.12 -0.26 0.09 0.00 0.00 0.00 0.00 46.02 45.73 1lqv n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lqv n GLY 35 N 0.00 2.07 3.59 -0.02 0.00 -1.26 -4.91 105.19 104.66 1lqv n GLY 35 Ca 0.00 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 44.96 1lqv n GLY 35 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1lqv s HIS 36 N -1.41 3.23 0.03 1.61 5.04 -0.63 -5.06 115.29 118.10 1lqv s HIS 36 Ca 0.42 0.05 -0.30 0.00 -1.54 0.00 0.00 55.06 53.69 1lqv s HIS 36 Cb 0.24 -2.30 -0.06 0.00 0.04 0.00 0.00 32.58 30.50 1lqv s HIS 36 CO 0.26 -0.11 1.45 -1.17 -2.34 0.00 0.00 174.74 172.83 1lqv s LEU 37 N 1.42 4.33 -0.02 8.88 2.96 -1.26 -1.17 118.68 133.82 1lqv s LEU 37 Ca 0.07 2.23 0.02 0.00 -0.22 0.00 0.00 54.13 56.23 1lqv s LEU 37 Cb -0.15 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 1lqv s LEU 37 CO 0.07 -0.75 0.03 0.35 -1.32 0.00 0.00 176.35 174.73 1lqv n THR 38 N 4.57 0.11 -3.91 3.68 -2.24 -0.12 -4.93 114.28 111.45 1lqv n THR 38 Ca 0.13 -0.09 -0.10 0.00 -2.27 0.00 0.00 64.05 61.73 1lqv n THR 38 Cb 0.43 -0.47 -0.09 0.00 -2.10 0.00 0.00 70.33 68.09 1lqv n THR 38 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1lqv s HIS 39 N -2.10 0.15 0.04 4.78 3.76 -1.00 -0.93 115.29 120.00 1lqv s HIS 39 Ca -0.01 -0.40 0.03 0.00 -0.15 0.00 0.00 55.06 54.52 1lqv s HIS 39 Cb 0.01 -0.11 -0.02 0.00 1.11 0.00 0.00 32.58 33.57 1lqv s HIS 39 CO 0.10 -0.36 -0.09 0.14 -0.85 0.00 0.00 174.74 173.69 1lqv s VAL 40 N -2.35 0.68 -0.03 -0.90 -7.23 -0.62 -1.65 120.40 108.29 1lqv s VAL 40 Ca -0.07 -1.05 0.01 0.00 -1.81 0.00 0.00 61.98 59.06 1lqv s VAL 40 Cb -0.03 -0.70 0.02 0.00 0.56 0.00 0.00 36.38 36.24 1lqv s VAL 40 CO -0.03 -0.28 -0.01 -0.22 -0.31 0.00 0.00 175.10 174.24 1lqv s LEU 41 N -1.46 1.24 -0.28 1.32 0.20 -0.15 -1.11 118.68 118.44 1lqv s LEU 41 Ca -0.07 -0.05 -0.25 0.00 0.69 0.00 0.00 54.13 54.45 1lqv s LEU 41 Cb -0.09 -0.28 0.10 0.00 -0.43 0.00 0.00 46.19 45.49 1lqv s LEU 41 CO 0.01 -0.08 0.92 -0.70 -0.29 0.00 0.00 176.35 176.21 1lqv s GLU 42 N 0.95 0.61 0.00 1.98 2.12 0.02 -0.18 118.70 124.21 1lqv s GLU 42 Ca -0.10 0.74 0.00 0.00 0.36 0.00 0.00 54.97 55.97 1lqv s GLU 42 Cb -0.14 0.29 0.00 0.00 0.26 0.00 0.00 34.13 34.55 1lqv s GLU 42 CO -0.01 -0.08 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 1lqv n GLY 43 N 2.44 1.65 3.83 -1.50 0.00 -0.67 -0.92 105.19 110.02 1lqv n GLY 43 Ca -0.13 -1.59 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 1lqv n GLY 43 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1lqv s PRO 44 N -1.72 2.37 0.55 1.61 0.04 -1.24 -0.86 135.00 135.75 1lqv s PRO 44 Ca 0.00 0.60 0.26 0.00 0.04 0.00 0.00 61.00 61.90 1lqv s PRO 44 Cb 0.00 -1.95 1.47 0.00 0.04 0.00 0.00 34.50 34.06 1lqv s PRO 44 CO 0.00 -1.41 2.04 0.38 0.04 0.00 0.00 177.00 178.05 1lqv h ASP 45 N -0.93 0.00 1.63 6.66 2.03 -1.56 -1.12 116.42 123.13 1lqv h ASP 45 Ca -0.46 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 55.82 1lqv h ASP 45 Cb 1.26 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.76 1lqv h ASP 45 CO 0.61 0.00 -0.10 0.71 -1.03 0.00 0.00 179.24 179.42 1lqv h THR 46 N 0.00 0.19 -0.87 1.15 1.35 -1.91 -3.40 112.91 109.42 1lqv h THR 46 Ca 0.17 -1.11 -0.25 0.00 -0.55 0.00 0.00 66.41 64.66 1lqv h THR 46 Cb 0.75 1.95 -0.19 0.00 -1.73 0.00 0.00 68.15 68.92 1lqv h THR 46 CO -0.00 0.10 -0.59 -3.20 -0.25 0.00 0.00 175.52 171.58 1lqv n ASN 47 N -3.15 -2.68 -4.63 5.36 5.15 -0.45 -5.12 115.26 109.75 1lqv n ASN 47 Ca 0.03 -2.98 -0.40 0.00 -0.60 0.00 0.00 54.58 50.63 1lqv n ASN 47 Cb 0.51 1.36 -0.08 0.00 -0.53 0.00 0.00 39.78 41.04 1lqv n ASN 47 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1lqv s THR 48 N 0.56 5.10 -0.11 -0.44 2.01 -1.05 -3.66 115.64 118.06 1lqv s THR 48 Ca 0.31 0.84 -0.24 0.00 0.31 0.00 0.00 61.69 62.91 1lqv s THR 48 Cb 0.10 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.77 1lqv s THR 48 CO -0.14 0.12 0.76 -0.89 -0.69 0.00 0.00 174.62 173.78 1lqv s THR 49 N 2.07 4.98 -0.16 -0.82 2.01 -0.09 -4.90 115.64 118.73 1lqv s THR 49 Ca 0.21 1.52 0.01 0.00 0.31 0.00 0.00 61.69 63.74 1lqv s THR 49 Cb -0.16 -4.08 0.02 0.00 0.01 0.00 0.00 72.50 68.29 1lqv s THR 49 CO 0.09 0.16 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.36 1lqv s ILE 50 N 1.37 1.90 -0.01 1.82 1.01 -1.26 -0.80 121.20 125.23 1lqv s ILE 50 Ca 0.38 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 60.21 1lqv s ILE 50 Cb -0.17 -1.73 -0.01 0.00 0.01 0.00 0.00 42.46 40.57 1lqv s ILE 50 CO 0.16 0.52 -0.11 -0.63 0.00 0.00 0.00 174.94 174.88 1lqv s ILE 51 N 1.23 0.87 -0.30 2.92 1.01 -0.27 -5.02 121.20 121.63 1lqv s ILE 51 Ca 0.02 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.10 1lqv s ILE 51 Cb -0.14 -0.74 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 1lqv s ILE 51 CO -0.10 0.25 0.19 0.00 0.00 0.00 0.00 174.94 175.29 1lqv s GLN 52 N -0.14 3.72 0.43 2.79 -2.07 -1.26 -1.58 119.66 121.54 1lqv s GLN 52 Ca 0.02 -0.48 0.11 0.00 -1.82 0.00 0.00 55.36 53.19 1lqv s GLN 52 Cb -0.06 -3.67 0.93 0.00 -1.09 0.00 0.00 33.01 29.12 1lqv s GLN 52 CO -0.00 -0.29 2.01 -0.07 -1.32 0.00 0.00 175.29 175.62 1lqv h LEU 53 N 8.40 0.21 -8.70 2.60 3.38 -1.39 -3.41 115.31 116.40 1lqv h LEU 53 Ca -0.34 -0.03 -0.66 0.00 0.09 0.00 0.00 57.88 56.94 1lqv h LEU 53 Cb 1.17 -0.05 -0.26 0.00 0.09 0.00 0.00 40.66 41.61 1lqv h LEU 53 CO 0.59 0.27 -0.87 -1.10 0.09 0.00 0.00 178.44 177.42 1lqv s GLN 54 N -4.97 1.66 0.00 1.13 -0.21 -1.26 -5.05 119.66 110.96 1lqv s GLN 54 Ca -0.06 -1.08 0.00 0.00 0.02 0.00 0.00 55.36 54.24 1lqv s GLN 54 Cb 0.16 -1.84 0.00 0.00 1.00 0.00 0.00 33.01 32.33 1lqv s GLN 54 CO 0.72 0.47 0.38 -2.30 -2.12 0.00 0.00 175.29 172.43 1lqv n PRO 55 N 1.73 0.00 -0.25 2.91 -0.02 -1.26 -4.61 135.00 133.50 1lqv n PRO 55 Ca -0.17 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.24 1lqv n PRO 55 Cb 0.52 -1.29 0.05 0.00 -0.02 0.00 0.00 33.50 32.76 1lqv n PRO 55 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1lqv h LEU 56 N 5.28 1.07 -9.31 2.45 3.38 -1.96 -3.42 115.31 112.80 1lqv h LEU 56 Ca 0.00 -0.24 -0.67 0.00 0.09 0.00 0.00 57.88 57.06 1lqv h LEU 56 Cb 0.00 -0.28 -0.15 0.00 0.09 0.00 0.00 40.66 40.32 1lqv h LEU 56 CO 0.38 1.03 -0.65 -1.10 0.09 0.00 0.00 178.44 178.18 1lqv s GLN 57 N -5.30 2.77 0.91 1.13 -0.21 -1.26 -5.02 119.66 112.67 1lqv s GLN 57 Ca -0.12 -0.60 -0.12 0.00 0.02 0.00 0.00 55.36 54.54 1lqv s GLN 57 Cb 0.15 -2.65 0.14 0.00 1.00 0.00 0.00 33.01 31.64 1lqv s GLN 57 CO 0.85 0.63 1.09 -1.21 -2.12 0.00 0.00 175.29 174.53 1lqv s GLU 58 N -1.41 1.13 0.22 2.91 2.02 -1.26 -4.63 118.70 117.68 1lqv s GLU 58 Ca 0.18 0.86 -0.11 0.00 0.02 0.00 0.00 54.97 55.91 1lqv s GLU 58 Cb -0.11 -1.79 0.30 0.00 0.10 0.00 0.00 34.13 32.63 1lqv s GLU 58 CO 0.08 -2.34 1.63 -1.35 0.02 0.00 0.00 175.26 173.30 1lqv h PRO 59 N -1.62 0.03 -0.25 0.39 0.11 -1.99 -0.98 132.00 127.69 1lqv h PRO 59 Ca -0.50 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1lqv h PRO 59 Cb 1.29 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1lqv h PRO 59 CO 0.54 0.02 -0.01 0.93 -0.21 0.00 0.00 178.00 179.27 1lqv h GLU 60 N 0.03 0.45 -0.57 1.05 5.08 -1.99 -1.79 114.58 116.83 1lqv h GLU 60 Ca 0.34 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.48 1lqv h GLU 60 Cb 0.54 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1lqv h GLU 60 CO -0.67 0.63 0.05 1.03 -1.00 0.00 0.00 179.01 179.05 1lqv h SER 61 N 0.22 0.91 -0.50 1.42 0.87 -1.87 -2.04 113.55 112.55 1lqv h SER 61 Ca 0.07 -0.22 -0.07 0.00 -1.23 0.00 0.00 61.79 60.34 1lqv h SER 61 Cb 0.43 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 1lqv h SER 61 CO 0.01 0.93 0.05 -0.25 -0.53 0.00 0.00 176.83 177.05 1lqv h TRP 62 N 0.88 0.92 -0.69 2.24 -0.00 -1.14 -2.00 115.95 116.16 1lqv h TRP 62 Ca 0.17 -0.14 -0.00 0.00 -0.00 0.00 0.00 58.89 58.92 1lqv h TRP 62 Cb 0.44 -0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 29.32 1lqv h TRP 62 CO 0.03 0.85 0.43 0.00 -0.00 0.00 0.00 178.44 179.75 1lqv h ALA 63 N 0.96 1.45 -0.34 2.65 0.00 -1.08 0.91 119.26 123.81 1lqv h ALA 63 Ca 0.15 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1lqv h ALA 63 Cb 0.45 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1lqv h ALA 63 CO 0.02 0.48 -0.23 0.00 0.00 0.00 0.00 179.25 179.52 1lqv h ARG 64 N 0.95 0.75 -0.41 0.00 3.08 -1.18 -0.98 114.38 116.59 1lqv h ARG 64 Ca 0.25 -0.36 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 1lqv h ARG 64 Cb -0.06 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1lqv h ARG 64 CO -0.05 0.97 0.17 1.15 -1.07 0.00 0.00 179.97 181.15 1lqv h THR 65 N 0.53 1.19 -0.75 2.04 2.02 -0.79 -1.83 112.91 115.32 1lqv h THR 65 Ca 0.07 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.67 1lqv h THR 65 Cb 0.78 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.97 1lqv h THR 65 CO 0.06 0.22 0.49 1.56 0.37 0.00 0.00 175.52 178.22 1lqv h GLN 66 N 0.52 0.97 -0.75 6.66 4.20 -0.73 -1.38 115.11 124.60 1lqv h GLN 66 Ca 0.14 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.80 1lqv h GLN 66 Cb 0.18 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 1lqv h GLN 66 CO -0.01 0.64 0.49 1.03 -0.67 0.00 0.00 178.83 180.31 1lqv h SER 67 N 1.00 0.87 -0.20 1.46 0.87 -0.72 0.03 113.55 116.86 1lqv h SER 67 Ca 0.28 -0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.71 1lqv h SER 67 Cb -0.08 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.65 1lqv h SER 67 CO -0.07 0.64 -0.21 1.23 -0.53 0.00 0.00 176.83 177.88 1lqv h GLY 68 N 1.02 0.71 1.45 5.77 0.00 -0.85 -1.65 103.07 109.51 1lqv h GLY 68 Ca 0.28 -0.58 -0.15 0.00 0.00 0.00 0.00 47.33 46.88 1lqv h GLY 68 CO -0.06 0.53 -0.46 1.41 0.00 0.00 0.00 176.54 177.96 1lqv h LEU 69 N 0.58 0.65 -0.49 3.11 3.38 -0.63 -0.92 115.31 120.99 1lqv h LEU 69 Ca 0.09 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 1lqv h LEU 69 Cb 0.68 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1lqv h LEU 69 CO 0.05 1.01 -0.29 1.56 0.09 0.00 0.00 178.44 180.86 1lqv h GLN 70 N 0.48 0.93 -0.59 1.13 1.08 -0.76 -0.95 115.11 116.44 1lqv h GLN 70 Ca 0.03 -0.43 -0.06 0.00 -1.45 0.00 0.00 58.65 56.74 1lqv h GLN 70 Cb 0.98 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.38 1lqv h GLN 70 CO 0.09 1.09 0.15 0.77 -0.95 0.00 0.00 178.83 179.98 1lqv h SER 71 N 0.79 0.89 -0.37 1.46 0.02 -1.18 -2.46 113.55 112.70 1lqv h SER 71 Ca 0.09 -0.23 0.02 0.00 -0.84 0.00 0.00 61.79 60.82 1lqv h SER 71 Cb 0.86 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.15 1lqv h SER 71 CO 0.08 0.89 0.22 0.22 -1.14 0.00 0.00 176.83 177.09 1lqv h TYR 72 N 0.85 0.40 -0.92 3.45 3.20 -0.87 -2.01 116.97 121.07 1lqv h TYR 72 Ca 0.18 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.09 1lqv h TYR 72 Cb 0.34 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.44 1lqv h TYR 72 CO 0.02 0.24 0.60 -0.07 -1.64 0.00 0.00 178.16 177.31 1lqv h LEU 73 N 0.44 1.03 -0.89 2.82 3.38 -0.90 0.11 115.31 121.31 1lqv h LEU 73 Ca 0.15 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 1lqv h LEU 73 Cb 0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1lqv h LEU 73 CO -0.07 0.74 -0.16 -0.07 0.09 0.00 0.00 178.44 178.97 1lqv h LEU 74 N 1.21 0.64 -0.40 1.67 3.38 -1.23 -1.29 115.31 119.30 1lqv h LEU 74 Ca 0.34 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 57.94 1lqv h LEU 74 Cb -0.10 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 1lqv h LEU 74 CO -0.09 0.81 -0.62 1.56 0.09 0.00 0.00 178.44 180.20 1lqv h GLN 75 N 0.59 0.63 0.05 1.13 4.20 -0.72 -0.30 115.11 120.69 1lqv h GLN 75 Ca 0.10 -0.44 -0.00 0.00 0.06 0.00 0.00 58.65 58.37 1lqv h GLN 75 Cb 0.60 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1lqv h GLN 75 CO 0.04 1.05 -0.02 0.35 -0.67 0.00 0.00 178.83 179.58 1lqv h PHE 76 N 0.46 -0.06 -0.60 2.96 3.57 -0.55 -0.17 116.94 122.54 1lqv h PHE 76 Ca -0.01 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.51 1lqv h PHE 76 Cb 1.20 0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.92 1lqv h PHE 76 CO 0.06 0.11 0.37 1.25 -2.23 0.00 0.00 178.31 177.87 1lqv h HIS 77 N -0.22 0.70 -1.01 0.41 2.76 -1.22 -1.84 115.15 114.73 1lqv h HIS 77 Ca -0.01 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.24 1lqv h HIS 77 Cb 0.20 -0.23 -0.06 0.00 1.55 0.00 0.00 27.41 28.86 1lqv h HIS 77 CO -0.02 0.41 0.66 0.78 -1.30 0.00 0.00 177.93 178.45 1lqv h GLY 78 N 0.74 1.51 1.24 5.26 0.00 -0.60 -0.36 103.07 110.87 1lqv h GLY 78 Ca 0.24 -0.49 -0.11 0.00 0.00 0.00 0.00 47.33 46.97 1lqv h GLY 78 CO -0.09 0.38 -0.16 -2.00 0.00 0.00 0.00 176.54 174.67 1lqv h LEU 79 N 1.22 0.88 -0.44 3.11 5.85 -0.43 -0.66 115.31 124.84 1lqv h LEU 79 Ca 0.42 -0.30 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 1lqv h LEU 79 Cb 0.10 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1lqv h LEU 79 CO -0.15 1.04 -0.02 0.58 -0.34 0.00 0.00 178.44 179.54 1lqv h VAL 80 N 0.78 1.26 -0.62 1.05 2.07 -0.70 -0.92 116.25 119.17 1lqv h VAL 80 Ca 0.12 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1lqv h VAL 80 Cb 0.69 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1lqv h VAL 80 CO 0.05 0.37 0.34 0.03 0.02 0.00 0.00 177.57 178.38 1lqv h ARG 81 N 0.63 0.84 -0.24 1.57 3.08 -0.86 -1.53 114.38 117.87 1lqv h ARG 81 Ca 0.12 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 60.00 1lqv h ARG 81 Cb 0.52 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 1lqv h ARG 81 CO 0.03 0.61 -0.21 1.25 -1.07 0.00 0.00 179.97 180.58 1lqv h LEU 82 N 0.85 0.59 -0.96 3.04 5.85 -0.57 -0.31 115.31 123.80 1lqv h LEU 82 Ca 0.22 -0.46 0.01 0.00 0.84 0.00 0.00 57.88 58.48 1lqv h LEU 82 Cb 0.01 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 1lqv h LEU 82 CO -0.04 0.94 0.64 0.58 -0.34 0.00 0.00 178.44 180.22 1lqv h VAL 83 N 0.26 1.25 -0.05 1.05 2.07 -0.83 -0.40 116.25 119.60 1lqv h VAL 83 Ca 0.04 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 1lqv h VAL 83 Cb 0.76 -0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1lqv h VAL 83 CO 0.05 0.24 0.02 -0.74 0.02 0.00 0.00 177.57 177.16 1lqv h HIS 84 N 1.31 0.08 0.00 1.57 -0.00 -1.01 0.16 115.15 117.26 1lqv h HIS 84 Ca 0.35 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.70 1lqv h HIS 84 Cb -0.15 -0.02 -0.00 0.00 -0.00 0.00 0.00 27.41 27.23 1lqv h HIS 84 CO -0.00 0.21 -0.10 1.96 -0.00 0.00 0.00 177.93 179.99 1lqv h GLN 85 N -0.07 0.00 0.00 5.26 4.20 -0.51 -0.28 115.11 123.70 1lqv h GLN 85 Ca 0.02 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.40 1lqv h GLN 85 Cb 0.16 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.88 1lqv h GLN 85 CO -0.00 0.10 -2.01 0.39 -0.67 0.00 0.00 178.83 176.64 1lqv n GLU 86 N -4.29 0.66 0.00 1.46 -0.58 -0.21 -4.72 120.64 112.96 1lqv n GLU 86 Ca -0.03 0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 1lqv n GLU 86 Cb 0.18 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 1lqv n GLU 86 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1lqv n ARG 87 N -2.92 2.20 -1.07 3.49 5.12 0.55 -5.09 116.66 118.94 1lqv n ARG 87 Ca -0.24 -0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.66 1lqv n ARG 87 Cb 1.10 -0.24 0.00 0.00 -1.16 0.00 0.00 32.46 32.16 1lqv n ARG 87 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1lqv n THR 88 N -0.32 -5.90 -4.31 0.55 -1.04 -0.12 -4.85 114.28 98.28 1lqv n THR 88 Ca 0.00 1.15 -0.31 0.00 -2.04 0.00 0.00 64.05 62.85 1lqv n THR 88 Cb 0.02 -3.28 -0.10 0.00 -1.82 0.00 0.00 70.33 65.14 1lqv n THR 88 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1lqv s LEU 89 N -0.18 3.12 -0.25 -4.42 1.43 -1.26 -4.89 118.68 112.23 1lqv s LEU 89 Ca 0.00 -0.28 -0.18 0.00 -1.03 0.00 0.00 54.13 52.64 1lqv s LEU 89 Cb 0.00 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1lqv s LEU 89 CO 0.00 0.22 0.54 0.00 0.23 0.00 0.00 176.35 177.33 1lqv s ALA 90 N -1.14 3.59 0.11 4.21 0.00 -1.26 -5.03 121.76 122.24 1lqv s ALA 90 Ca 0.20 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 51.64 1lqv s ALA 90 Cb -0.11 -2.91 -0.04 0.00 0.00 0.00 0.00 23.12 20.06 1lqv s ALA 90 CO 0.12 -0.72 0.10 -0.06 0.00 0.00 0.00 175.76 175.20 1lqv s PHE 91 N 2.28 3.19 0.56 0.00 0.40 -1.26 -4.40 117.98 118.75 1lqv s PHE 91 Ca 0.22 0.05 -0.18 0.00 -0.60 0.00 0.00 56.93 56.43 1lqv s PHE 91 Cb -0.16 -1.59 -0.05 0.00 0.51 0.00 0.00 43.02 41.73 1lqv s PHE 91 CO 0.09 0.52 1.06 -2.14 0.70 0.00 0.00 175.22 175.45 1lqv s PRO 92 N -2.65 3.45 0.05 0.24 0.02 -1.26 -5.03 135.00 129.83 1lqv s PRO 92 Ca 0.30 1.32 -0.06 0.00 0.02 0.00 0.00 61.00 62.57 1lqv s PRO 92 Cb -0.11 -2.04 -0.01 0.00 0.02 0.00 0.00 34.50 32.35 1lqv s PRO 92 CO 0.23 -0.72 0.12 -0.48 -0.33 0.00 0.00 177.00 175.82 1lqv s LEU 93 N -4.10 1.72 -0.04 -5.54 0.05 -0.68 -5.02 118.68 105.07 1lqv s LEU 93 Ca 0.66 -0.59 0.05 0.00 0.05 0.00 0.00 54.13 54.30 1lqv s LEU 93 Cb -0.17 0.72 -0.01 0.00 -2.05 0.00 0.00 46.19 44.68 1lqv s LEU 93 CO 0.30 -0.58 -0.20 -0.89 -0.55 0.00 0.00 176.35 174.44 1lqv s THR 94 N -3.06 1.61 -0.04 5.48 2.01 -1.26 -0.46 115.64 119.93 1lqv s THR 94 Ca -0.01 -0.83 0.07 0.00 0.31 0.00 0.00 61.69 61.22 1lqv s THR 94 Cb 0.01 -1.36 -0.01 0.00 0.01 0.00 0.00 72.50 71.15 1lqv s THR 94 CO -0.07 0.46 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.44 1lqv s ILE 95 N -0.16 1.99 -0.11 1.82 1.01 -0.20 -0.25 121.20 125.30 1lqv s ILE 95 Ca -0.00 -1.06 0.03 0.00 0.00 0.00 0.00 60.65 59.62 1lqv s ILE 95 Cb -0.11 -1.67 0.01 0.00 0.01 0.00 0.00 42.46 40.71 1lqv s ILE 95 CO 0.02 0.56 -0.19 -0.60 0.00 0.00 0.00 174.94 174.73 1lqv s ARG 96 N -0.38 2.58 -0.15 2.79 3.52 -0.04 -0.63 118.95 126.64 1lqv s ARG 96 Ca 0.03 -0.70 -0.01 0.00 -0.13 0.00 0.00 55.73 54.92 1lqv s ARG 96 Cb -0.11 -2.07 -0.02 0.00 -1.56 0.00 0.00 34.95 31.19 1lqv s ARG 96 CO 0.01 0.03 -0.10 0.00 -0.81 0.00 0.00 175.30 174.43 1lqv s PHE 98 N 0.50 1.35 0.15 0.00 5.36 -0.33 -0.99 117.98 124.01 1lqv s PHE 98 Ca -0.07 -0.58 -0.10 0.00 -0.96 0.00 0.00 56.93 55.21 1lqv s PHE 98 Cb -0.15 -1.09 0.00 0.00 -0.34 0.00 0.00 43.02 41.43 1lqv s PHE 98 CO 0.04 -0.39 0.29 -0.48 -1.46 0.00 0.00 175.22 173.22 1lqv s LEU 99 N 1.29 0.94 0.00 6.12 2.34 -0.48 -0.69 118.68 128.21 1lqv s LEU 99 Ca -0.03 -0.73 0.00 0.00 0.06 0.00 0.00 54.13 53.43 1lqv s LEU 99 Cb -0.14 1.30 0.00 0.00 -0.56 0.00 0.00 46.19 46.79 1lqv s LEU 99 CO -0.03 -0.86 0.00 0.61 -1.06 0.00 0.00 176.35 175.00 1lqv n GLY 100 N -0.19 -1.65 2.90 -3.48 0.00 -0.62 -0.25 105.19 101.91 1lqv n GLY 100 Ca -0.10 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 1lqv n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lqv s GLU 102 N -0.26 0.63 -0.36 0.00 2.02 0.57 -1.82 118.70 119.47 1lqv s GLU 102 Ca -0.02 0.03 -0.11 0.00 0.02 0.00 0.00 54.97 54.89 1lqv s GLU 102 Cb -0.02 -0.84 0.02 0.00 0.10 0.00 0.00 34.13 33.38 1lqv s GLU 102 CO -0.00 -0.20 0.20 -0.51 0.02 0.00 0.00 175.26 174.77 1lqv s LEU 103 N 1.45 4.60 0.42 1.80 1.02 0.18 -0.61 118.68 127.54 1lqv s LEU 103 Ca -0.03 -0.86 -0.26 0.00 0.02 0.00 0.00 54.13 53.00 1lqv s LEU 103 Cb -0.13 -2.03 -0.09 0.00 0.02 0.00 0.00 46.19 43.96 1lqv s LEU 103 CO -0.03 -0.34 1.41 -2.84 0.02 0.00 0.00 176.35 174.57 1lqv s PRO 104 N 1.58 3.87 0.34 1.29 0.02 -1.26 -3.47 135.00 137.37 1lqv s PRO 104 Ca 0.03 2.38 0.03 0.00 0.02 0.00 0.00 61.00 63.46 1lqv s PRO 104 Cb -0.19 -2.76 0.61 0.00 0.02 0.00 0.00 34.50 32.18 1lqv s PRO 104 CO 0.07 -0.66 1.94 -1.35 -0.33 0.00 0.00 177.00 176.67 1lqv h PRO 105 N 2.59 0.70 -0.47 5.54 0.11 -1.96 -3.05 132.00 135.47 1lqv h PRO 105 Ca -0.50 -0.09 -0.02 0.00 0.11 0.00 0.00 66.00 65.50 1lqv h PRO 105 Cb 1.25 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1lqv h PRO 105 CO 0.62 0.57 0.22 1.05 -0.21 0.00 0.00 178.00 180.24 1lqv h GLU 106 N 0.69 0.65 0.00 1.05 4.11 -1.94 -3.48 114.58 115.67 1lqv h GLU 106 Ca 0.17 -0.08 0.00 0.00 0.07 0.00 0.00 59.36 59.52 1lqv h GLU 106 Cb 0.12 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1lqv h GLU 106 CO -0.02 0.52 0.00 0.41 0.07 0.00 0.00 179.01 179.99 1lqv n GLY 107 N -1.22 1.09 3.64 1.06 0.00 -1.15 -5.13 105.19 103.49 1lqv n GLY 107 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1lqv n GLY 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lqv s SER 108 N -0.83 1.63 0.40 1.61 1.04 -1.26 -4.97 113.70 111.32 1lqv s SER 108 Ca 0.00 0.80 -0.27 0.00 0.48 0.00 0.00 55.95 56.96 1lqv s SER 108 Cb 0.00 -1.18 -0.10 0.00 0.10 0.00 0.00 66.02 64.84 1lqv s SER 108 CO 0.00 -3.70 1.40 -0.60 0.98 0.00 0.00 173.24 171.32 1lqv s ARG 109 N -5.28 3.99 0.37 4.02 3.52 -1.26 -4.54 118.95 119.77 1lqv s ARG 109 Ca 0.69 2.38 -0.28 0.00 -0.13 0.00 0.00 55.73 58.39 1lqv s ARG 109 Cb -0.13 -2.84 -0.11 0.00 -1.56 0.00 0.00 34.95 30.31 1lqv s ARG 109 CO 0.56 -0.56 1.43 0.00 -0.81 0.00 0.00 175.30 175.93 1lqv n ALA 110 N 0.24 2.06 -2.68 6.12 0.00 -1.26 -4.73 120.51 120.26 1lqv n ALA 110 Ca 0.03 0.34 -0.37 0.00 0.00 0.00 0.00 53.44 53.43 1lqv n ALA 110 Cb 0.41 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.43 1lqv n ALA 110 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1lqv s HIS 111 N -1.12 3.55 0.21 0.00 2.46 0.22 -4.89 115.29 115.72 1lqv s HIS 111 Ca 0.54 0.77 0.06 0.00 0.47 0.00 0.00 55.06 56.90 1lqv s HIS 111 Cb -0.50 -2.36 -0.05 0.00 -0.13 0.00 0.00 32.58 29.54 1lqv s HIS 111 CO 0.63 0.35 -0.10 0.14 -2.47 0.00 0.00 174.74 173.28 1lqv s VAL 112 N 0.04 1.50 0.11 0.89 -7.23 -1.26 -0.32 120.40 114.12 1lqv s VAL 112 Ca 0.21 -2.14 -0.19 0.00 -1.81 0.00 0.00 61.98 58.04 1lqv s VAL 112 Cb -0.14 -2.10 0.05 0.00 0.56 0.00 0.00 36.38 34.75 1lqv s VAL 112 CO 0.08 -0.55 0.47 0.72 -0.31 0.00 0.00 175.10 175.51 1lqv s PHE 113 N -3.12 -0.33 -0.29 2.82 -0.71 -0.93 -4.83 117.98 110.59 1lqv s PHE 113 Ca 0.23 0.15 0.03 0.00 -1.04 0.00 0.00 56.93 56.30 1lqv s PHE 113 Cb 0.02 0.34 0.18 0.00 -1.21 0.00 0.00 43.02 42.34 1lqv s PHE 113 CO 0.06 -0.71 0.51 0.12 -1.34 0.00 0.00 175.22 173.87 1lqv s PHE 114 N -3.33 -1.45 -0.10 3.49 2.19 -1.26 -1.58 117.98 115.94 1lqv s PHE 114 Ca -0.00 0.93 0.01 0.00 0.33 0.00 0.00 56.93 58.21 1lqv s PHE 114 Cb 0.00 0.18 -0.02 0.00 -1.31 0.00 0.00 43.02 41.88 1lqv s PHE 114 CO -0.09 -0.98 -0.14 -1.21 1.83 0.00 0.00 175.22 174.63 1lqv s GLU 115 N 2.72 3.03 -0.15 10.12 2.02 0.14 -0.89 118.70 135.69 1lqv s GLU 115 Ca 0.12 -0.70 -0.01 0.00 0.02 0.00 0.00 54.97 54.41 1lqv s GLU 115 Cb -0.12 -2.52 -0.01 0.00 0.10 0.00 0.00 34.13 31.57 1lqv s GLU 115 CO -0.25 0.37 -0.11 0.08 0.02 0.00 0.00 175.26 175.37 1lqv s VAL 116 N -0.08 3.11 0.07 2.63 1.01 0.34 -1.19 120.40 126.30 1lqv s VAL 116 Ca -0.02 -0.63 0.09 0.00 0.00 0.00 0.00 61.98 61.42 1lqv s VAL 116 Cb -0.14 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 1lqv s VAL 116 CO 0.04 0.51 -0.24 0.00 0.00 0.00 0.00 175.10 175.41 1lqv s ALA 117 N 0.55 2.40 -0.09 5.51 0.00 0.55 -1.57 121.76 129.12 1lqv s ALA 117 Ca -0.07 -1.31 0.03 0.00 0.00 0.00 0.00 51.96 50.61 1lqv s ALA 117 Cb -0.15 -0.53 0.01 0.00 0.00 0.00 0.00 23.12 22.44 1lqv s ALA 117 CO 0.03 0.55 -0.19 0.08 0.00 0.00 0.00 175.76 176.24 1lqv s VAL 118 N -0.92 1.67 -1.53 0.00 1.01 0.09 -0.86 120.40 119.86 1lqv s VAL 118 Ca 0.13 -0.78 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 1lqv s VAL 118 Cb -0.10 -1.48 0.09 0.00 0.00 0.00 0.00 36.38 34.89 1lqv s VAL 118 CO 0.04 0.47 0.90 0.59 0.00 0.00 0.00 175.10 177.11 1lqv n ASN 119 N 3.77 -4.63 0.00 3.32 4.13 0.65 -1.75 115.26 120.74 1lqv n ASN 119 Ca -0.20 -0.74 0.00 0.00 1.68 0.00 0.00 54.58 55.32 1lqv n ASN 119 Cb 0.52 -3.72 0.00 0.00 -1.54 0.00 0.00 39.78 35.05 1lqv n ASN 119 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1lqv n GLY 120 N -1.60 0.91 3.50 7.41 0.00 -1.26 -5.03 105.19 109.12 1lqv n GLY 120 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1lqv n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lqv s SER 121 N -2.86 4.08 0.29 1.61 0.01 -0.72 -5.08 113.70 111.03 1lqv s SER 121 Ca 0.00 -0.34 -0.29 0.00 1.31 0.00 0.00 55.95 56.63 1lqv s SER 121 Cb 0.00 -0.77 -0.13 0.00 0.21 0.00 0.00 66.02 65.33 1lqv s SER 121 CO 0.00 0.26 1.23 -1.20 0.41 0.00 0.00 173.24 173.94 1lqv n SER 122 N 1.51 2.24 0.00 2.44 7.64 -1.26 -0.73 113.62 125.47 1lqv n SER 122 Ca -0.16 1.18 0.00 0.00 1.01 0.00 0.00 58.87 60.90 1lqv n SER 122 Cb 0.52 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.33 1lqv n SER 122 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1lqv n PHE 123 N 0.75 0.00 -4.08 1.43 7.35 -0.61 -4.12 117.46 118.17 1lqv n PHE 123 Ca 0.08 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.70 1lqv n PHE 123 Cb 0.33 0.12 -0.10 0.00 0.35 0.00 0.00 39.48 40.17 1lqv n PHE 123 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1lqv s VAL 124 N -0.58 0.27 0.08 -2.13 -7.23 -1.02 -0.37 120.40 109.41 1lqv s VAL 124 Ca 0.00 -1.69 -0.11 0.00 -1.81 0.00 0.00 61.98 58.36 1lqv s VAL 124 Cb 0.00 -1.36 0.01 0.00 0.56 0.00 0.00 36.38 35.59 1lqv s VAL 124 CO 0.00 -0.91 0.25 -0.94 -0.31 0.00 0.00 175.10 173.19 1lqv s SER 125 N -2.72 -0.00 0.05 4.85 1.04 -0.47 -0.50 113.70 115.95 1lqv s SER 125 Ca 0.04 -0.47 -0.17 0.00 0.48 0.00 0.00 55.95 55.83 1lqv s SER 125 Cb 0.05 0.36 -0.06 0.00 0.10 0.00 0.00 66.02 66.47 1lqv s SER 125 CO -0.08 -0.71 0.50 0.12 0.98 0.00 0.00 173.24 174.05 1lqv s PHE 126 N -3.46 3.77 -0.30 5.02 5.36 -0.07 -1.26 117.98 127.05 1lqv s PHE 126 Ca 0.02 1.16 -0.02 0.00 -0.96 0.00 0.00 56.93 57.12 1lqv s PHE 126 Cb 0.03 -2.41 0.05 0.00 -0.34 0.00 0.00 43.02 40.34 1lqv s PHE 126 CO -0.09 0.61 0.00 1.03 -1.46 0.00 0.00 175.22 175.31 1lqv s ARG 127 N -1.12 2.51 0.52 10.12 1.81 0.29 -4.54 118.95 128.53 1lqv s ARG 127 Ca 0.27 -1.22 0.31 0.00 -1.72 0.00 0.00 55.73 53.37 1lqv s ARG 127 Cb -0.18 -3.19 1.14 0.00 -0.45 0.00 0.00 34.95 32.27 1lqv s ARG 127 CO 0.17 -0.60 1.90 -1.00 -0.68 0.00 0.00 175.30 175.09 1lqv h PRO 128 N 8.02 0.00 -0.32 3.54 0.13 -1.88 -1.52 132.00 139.97 1lqv h PRO 128 Ca -0.23 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.96 1lqv h PRO 128 Cb 1.07 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.15 1lqv h PRO 128 CO 0.54 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.24 1lqv h GLU 129 N 0.00 0.09 -0.15 0.86 3.07 -1.95 -2.92 114.58 113.58 1lqv h GLU 129 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1lqv h GLU 129 Cb 0.61 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 1lqv h GLU 129 CO 0.00 0.06 0.00 0.54 -1.40 0.00 0.00 179.01 178.21 1lqv n ARG 130 N -5.17 2.73 -3.42 2.33 1.74 -1.26 -5.01 116.66 108.60 1lqv n ARG 130 Ca 0.01 -1.70 -0.18 0.00 -0.77 0.00 0.00 57.85 55.21 1lqv n ARG 130 Cb 0.17 -1.12 0.07 0.00 -1.02 0.00 0.00 32.46 30.55 1lqv n ARG 130 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lqv n ALA 131 N -0.00 -2.22 -2.64 7.54 0.00 -0.92 -5.02 120.51 117.25 1lqv n ALA 131 Ca 0.05 -0.02 -0.20 0.00 0.00 0.00 0.00 53.44 53.27 1lqv n ALA 131 Cb 0.32 -3.66 -0.12 0.00 0.00 0.00 0.00 19.45 15.99 1lqv n ALA 131 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1lqv s LEU 132 N -6.07 2.27 0.04 0.00 1.43 -0.62 -4.71 118.68 111.02 1lqv s LEU 132 Ca 0.19 -0.61 -0.05 0.00 -1.03 0.00 0.00 54.13 52.63 1lqv s LEU 132 Cb -0.03 -0.64 -0.05 0.00 0.03 0.00 0.00 46.19 45.50 1lqv s LEU 132 CO 0.75 -0.02 0.27 0.26 0.23 0.00 0.00 176.35 177.85 1lqv s TRP 133 N -1.17 3.55 0.13 0.29 0.52 -1.26 -0.55 118.94 120.45 1lqv s TRP 133 Ca 0.01 0.50 0.04 0.00 0.02 0.00 0.00 56.10 56.67 1lqv s TRP 133 Cb -0.10 -1.94 -0.04 0.00 -1.15 0.00 0.00 33.47 30.24 1lqv s TRP 133 CO 0.03 0.58 -0.10 1.14 0.02 0.00 0.00 176.95 178.62 1lqv s GLN 134 N -2.05 0.98 0.24 4.98 -2.07 -0.39 -4.95 119.66 116.40 1lqv s GLN 134 Ca 0.31 -1.37 -0.30 0.00 -1.82 0.00 0.00 55.36 52.19 1lqv s GLN 134 Cb -0.13 -0.54 -0.09 0.00 -1.09 0.00 0.00 33.01 31.16 1lqv s GLN 134 CO 0.20 0.06 0.98 0.00 -1.32 0.00 0.00 175.29 175.21 1lqv s ALA 135 N -3.17 3.35 -0.51 2.60 0.00 -1.26 -1.36 121.76 121.41 1lqv s ALA 135 Ca 0.13 0.68 0.19 0.00 0.00 0.00 0.00 51.96 52.96 1lqv s ALA 135 Cb 0.02 -3.24 -0.25 0.00 0.00 0.00 0.00 23.12 19.64 1lqv s ALA 135 CO -0.00 0.11 0.64 -0.25 0.00 0.00 0.00 175.76 176.26 1lqv n ASP 136 N 1.54 0.71 -4.92 0.00 8.00 0.51 -4.86 116.55 117.53 1lqv n ASP 136 Ca -0.01 -0.52 -0.29 0.00 0.71 0.00 0.00 54.79 54.67 1lqv n ASP 136 Cb 0.47 1.41 -0.04 0.00 -0.02 0.00 0.00 41.12 42.94 1lqv n ASP 136 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1lqv s THR 137 N -3.07 5.24 -2.72 -3.53 -1.32 -1.19 -4.79 115.64 104.27 1lqv s THR 137 Ca 0.01 -0.28 0.24 0.00 -1.21 0.00 0.00 61.69 60.44 1lqv s THR 137 Cb 0.14 -3.68 0.14 0.00 -1.51 0.00 0.00 72.50 67.58 1lqv s THR 137 CO 0.80 -0.05 1.22 0.00 -2.21 0.00 0.00 174.62 174.38 1lqv n GLN 138 N -0.27 2.00 -2.74 7.08 3.00 -1.26 -4.87 117.38 120.31 1lqv n GLN 138 Ca -0.04 -1.65 -0.43 0.00 -0.01 0.00 0.00 57.00 54.87 1lqv n GLN 138 Cb 0.53 -1.47 -0.03 0.00 0.00 0.00 0.00 30.24 29.27 1lqv n GLN 138 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1lqv s VAL 139 N -2.14 4.67 0.31 5.09 1.01 -1.26 -5.02 120.40 123.07 1lqv s VAL 139 Ca 0.25 1.70 -0.20 0.00 0.00 0.00 0.00 61.98 63.73 1lqv s VAL 139 Cb 0.19 -4.29 -0.09 0.00 0.00 0.00 0.00 36.38 32.20 1lqv s VAL 139 CO 0.38 -0.28 0.82 0.42 0.00 0.00 0.00 175.10 176.44 1lqv s THR 140 N 3.25 4.48 0.02 3.92 -4.23 -1.26 -4.97 115.64 116.85 1lqv s THR 140 Ca 0.41 1.36 -0.28 0.00 -1.18 0.00 0.00 61.69 62.01 1lqv s THR 140 Cb -0.14 -3.78 0.09 0.00 1.34 0.00 0.00 72.50 70.01 1lqv s THR 140 CO 0.11 -0.02 0.78 -0.94 -0.54 0.00 0.00 174.62 174.01 1lqv s SER 141 N -1.91 -0.47 0.35 3.99 1.04 -1.26 -5.01 113.70 110.42 1lqv s SER 141 Ca 0.51 0.17 0.03 0.00 0.48 0.00 0.00 55.95 57.14 1lqv s SER 141 Cb -0.14 0.46 0.64 0.00 0.10 0.00 0.00 66.02 67.08 1lqv s SER 141 CO 0.19 -0.69 1.97 1.23 0.98 0.00 0.00 173.24 176.92 1lqv h GLY 142 N 2.24 0.77 0.93 7.32 0.00 -1.97 -2.06 103.07 110.31 1lqv h GLY 142 Ca -0.26 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1lqv h GLY 142 CO 0.34 0.33 0.13 -2.08 0.00 0.00 0.00 176.54 175.26 1lqv h VAL 143 N 0.73 1.15 -0.25 4.60 2.07 -1.92 -0.14 116.25 122.49 1lqv h VAL 143 Ca 0.19 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 1lqv h VAL 143 Cb 0.04 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1lqv h VAL 143 CO -0.03 0.16 0.01 0.58 0.02 0.00 0.00 177.57 178.31 1lqv h VAL 144 N 0.32 1.25 -0.45 2.57 2.07 -1.88 -0.63 116.25 119.50 1lqv h VAL 144 Ca 0.10 -0.88 0.03 0.00 0.82 0.00 0.00 66.70 66.76 1lqv h VAL 144 Cb 0.13 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 1lqv h VAL 144 CO -0.01 0.28 0.24 0.74 0.02 0.00 0.00 177.57 178.84 1lqv h THR 145 N 0.23 0.99 -0.33 2.57 2.02 -1.26 -0.93 112.91 116.19 1lqv h THR 145 Ca 0.07 -0.16 -0.07 0.00 0.77 0.00 0.00 66.41 67.02 1lqv h THR 145 Cb 0.40 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1lqv h THR 145 CO 0.01 0.09 -0.06 0.15 0.37 0.00 0.00 175.52 176.08 1lqv h PHE 146 N 0.48 0.70 -0.49 3.16 3.57 -0.95 -0.93 116.94 122.48 1lqv h PHE 146 Ca 0.19 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.56 1lqv h PHE 146 Cb 0.07 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 1lqv h PHE 146 CO -0.09 0.79 0.32 1.15 -2.23 0.00 0.00 178.31 178.24 1lqv h THR 147 N 0.41 1.11 -0.59 4.41 2.02 -0.89 -0.77 112.91 118.61 1lqv h THR 147 Ca 0.09 -0.22 -0.08 0.00 0.77 0.00 0.00 66.41 66.97 1lqv h THR 147 Cb 0.55 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1lqv h THR 147 CO 0.03 0.12 0.07 -0.07 0.37 0.00 0.00 175.52 176.03 1lqv h LEU 148 N 0.65 0.92 -0.26 2.58 3.38 -1.01 -0.79 115.31 120.79 1lqv h LEU 148 Ca 0.18 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1lqv h LEU 148 Cb -0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 1lqv h LEU 148 CO -0.05 0.94 0.15 -0.61 0.09 0.00 0.00 178.44 178.96 1lqv h GLN 149 N 0.90 0.29 -0.13 1.13 -0.00 -0.66 -0.43 115.11 116.22 1lqv h GLN 149 Ca 0.18 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.81 1lqv h GLN 149 Cb 0.44 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 27.84 1lqv h GLN 149 CO 0.01 0.19 0.06 1.96 0.00 0.00 0.00 178.83 181.05 1lqv h GLN 150 N 0.30 0.18 -0.37 1.69 1.08 -0.89 -2.19 115.11 114.91 1lqv h GLN 150 Ca 0.10 -0.03 -0.04 0.00 -1.45 0.00 0.00 58.65 57.23 1lqv h GLN 150 Cb 0.00 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 1lqv h GLN 150 CO -0.05 0.26 0.06 -0.07 -0.95 0.00 0.00 178.83 178.08 1lqv h LEU 151 N 0.06 0.51 -0.89 1.46 3.38 -0.93 -1.87 115.31 117.03 1lqv h LEU 151 Ca 0.04 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1lqv h LEU 151 Cb 0.14 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1lqv h LEU 151 CO -0.00 0.54 0.00 0.59 0.09 0.00 0.00 178.44 179.65 1lqv n ASN 152 N -4.31 1.34 0.02 -0.43 3.02 -0.19 -4.21 115.26 110.50 1lqv n ASN 152 Ca 0.02 -1.69 0.11 0.00 -0.03 0.00 0.00 54.58 52.99 1lqv n ASN 152 Cb 0.21 -0.09 -0.07 0.00 -0.61 0.00 0.00 39.78 39.21 1lqv n ASN 152 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lqv n ALA 153 N 0.12 3.23 -2.59 5.41 0.00 -0.70 -5.00 120.51 120.98 1lqv n ALA 153 Ca 0.15 -0.45 -0.22 0.00 0.00 0.00 0.00 53.44 52.92 1lqv n ALA 153 Cb 0.27 -0.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.71 1lqv n ALA 153 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1lqv s TYR 154 N -3.32 1.58 0.25 0.00 2.02 -1.25 -5.03 117.35 111.60 1lqv s TYR 154 Ca -0.01 -0.41 -0.03 0.00 -0.37 0.00 0.00 57.07 56.25 1lqv s TYR 154 Cb 0.14 -0.89 0.45 0.00 -0.40 0.00 0.00 41.96 41.26 1lqv s TYR 154 CO 0.85 0.13 1.79 -0.91 -1.57 0.00 0.00 175.55 175.84 1lqv h ASN 155 N 4.35 0.62 -0.27 2.29 2.35 -1.94 -2.40 115.58 120.57 1lqv h ASN 155 Ca -0.43 0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.42 1lqv h ASN 155 Cb 1.18 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 39.47 1lqv h ASN 155 CO 0.41 0.32 0.04 -0.09 -1.65 0.00 0.00 177.43 176.46 1lqv h ARG 156 N 0.72 0.14 -0.00 0.81 9.65 -1.96 0.00 114.38 123.74 1lqv h ARG 156 Ca 0.42 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.30 1lqv h ARG 156 Cb 0.48 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.03 1lqv h ARG 156 CO -0.29 0.09 -0.24 0.25 2.80 0.00 0.00 179.97 182.58 1lqv n THR 157 N -5.10 0.00 0.00 0.20 -2.24 -1.13 -2.57 114.28 103.44 1lqv n THR 157 Ca -0.01 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1lqv n THR 157 Cb 0.12 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 1lqv n THR 157 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1lqv n ARG 158 N -1.09 0.00 -0.05 -0.78 1.74 -0.92 -4.65 116.66 110.92 1lqv n ARG 158 Ca 0.11 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 57.03 1lqv n ARG 158 Cb 0.32 -0.09 -0.07 0.00 -1.02 0.00 0.00 32.46 31.61 1lqv n ARG 158 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1lqv h TYR 159 N 0.00 0.91 -0.58 -1.55 0.05 -1.29 -0.91 116.97 113.60 1lqv h TYR 159 Ca 0.00 -0.36 -0.08 0.00 0.05 0.00 0.00 58.73 58.34 1lqv h TYR 159 Cb 0.00 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.56 1lqv h TYR 159 CO 0.00 1.16 0.04 0.93 -1.05 0.00 0.00 178.16 179.24 1lqv h GLU 160 N 0.40 0.96 -0.44 4.88 5.08 -1.27 0.15 114.58 124.34 1lqv h GLU 160 Ca -0.02 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.02 1lqv h GLU 160 Cb 1.16 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 1lqv h GLU 160 CO 0.12 0.92 0.04 1.25 -1.00 0.00 0.00 179.01 180.34 1lqv h LEU 161 N 0.90 0.72 -0.84 1.33 6.46 -1.46 -0.22 115.31 122.21 1lqv h LEU 161 Ca 0.17 -0.28 -0.03 0.00 -0.12 0.00 0.00 57.88 57.63 1lqv h LEU 161 Cb 0.46 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 1lqv h LEU 161 CO 0.02 0.82 0.42 -0.09 -0.62 0.00 0.00 178.44 178.98 1lqv h ARG 162 N 0.60 1.20 -0.16 1.25 2.43 -0.80 -1.64 114.38 117.26 1lqv h ARG 162 Ca 0.13 -0.17 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 1lqv h ARG 162 Cb 0.42 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1lqv h ARG 162 CO 0.01 0.92 -0.23 0.93 -1.51 0.00 0.00 179.97 180.09 1lqv h GLU 163 N 1.19 0.29 -0.49 0.20 5.08 -0.68 0.23 114.58 120.41 1lqv h GLU 163 Ca 0.29 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1lqv h GLU 163 Cb 0.10 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1lqv h GLU 163 CO -0.04 0.52 0.13 0.35 -1.00 0.00 0.00 179.01 178.97 1lqv h PHE 164 N 0.27 0.81 -0.04 4.33 3.57 -0.13 0.21 116.94 125.96 1lqv h PHE 164 Ca 0.04 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.40 1lqv h PHE 164 Cb 0.56 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1lqv h PHE 164 CO 0.01 0.72 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.55 1lqv h LEU 165 N 0.66 0.23 0.00 0.59 3.38 -0.77 0.13 115.31 119.52 1lqv h LEU 165 Ca 0.15 -0.67 -0.05 0.00 0.09 0.00 0.00 57.88 57.41 1lqv h LEU 165 Cb 0.31 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1lqv h LEU 165 CO -0.00 0.86 -0.59 -0.33 0.09 0.00 0.00 178.44 178.47 1lqv h GLU 166 N -0.38 0.00 0.00 1.13 5.08 -0.61 -3.30 114.58 116.50 1lqv h GLU 166 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1lqv h GLU 166 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1lqv h GLU 166 CO 0.04 0.18 -0.31 -0.25 -1.00 0.00 0.00 179.01 177.67 1lqv n ASP 167 N -3.00 1.29 -0.03 1.42 9.92 -0.02 -4.38 116.55 121.74 1lqv n ASP 167 Ca 0.00 0.19 -0.11 0.00 -0.53 0.00 0.00 54.79 54.34 1lqv n ASP 167 Cb 0.64 -0.45 -0.06 0.00 -0.64 0.00 0.00 41.12 40.61 1lqv n ASP 167 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1lqv h THR 168 N -0.31 1.16 -0.41 -3.53 2.02 -1.13 -1.10 112.91 109.61 1lqv h THR 168 Ca 0.00 -0.48 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 1lqv h THR 168 Cb 0.31 1.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 1lqv h THR 168 CO 0.00 0.14 0.14 0.00 0.37 0.00 0.00 175.52 176.17 1lqv h VAL 170 N 0.52 1.19 -0.49 0.00 2.07 -1.61 -1.60 116.25 116.34 1lqv h VAL 170 Ca 0.13 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1lqv h VAL 170 Cb 0.25 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1lqv h VAL 170 CO -0.01 0.21 0.24 1.56 0.02 0.00 0.00 177.57 179.60 1lqv h GLN 171 N 0.43 0.68 -0.35 1.57 4.20 -1.10 -0.72 115.11 119.81 1lqv h GLN 171 Ca 0.12 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1lqv h GLN 171 Cb 0.20 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1lqv h GLN 171 CO -0.01 0.52 0.11 -0.92 -0.67 0.00 0.00 178.83 177.86 1lqv h TYR 172 N 0.68 0.57 -0.44 2.96 5.03 -0.98 -1.06 116.97 123.75 1lqv h TYR 172 Ca 0.17 -0.06 -0.02 0.00 2.58 0.00 0.00 58.73 61.41 1lqv h TYR 172 Cb 0.06 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.16 1lqv h TYR 172 CO 0.00 0.56 0.21 0.28 -1.32 0.00 0.00 178.16 177.90 1lqv h VAL 173 N 0.42 1.18 -0.29 1.81 2.07 -0.68 -0.97 116.25 119.80 1lqv h VAL 173 Ca 0.11 -0.51 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 1lqv h VAL 173 Cb 0.26 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1lqv h VAL 173 CO -0.00 0.20 -0.01 1.56 0.02 0.00 0.00 177.57 179.33 1lqv h GLN 174 N 0.56 0.44 0.12 1.57 1.08 -0.96 -2.44 115.11 115.48 1lqv h GLN 174 Ca 0.15 -0.09 -0.19 0.00 -1.45 0.00 0.00 58.65 57.07 1lqv h GLN 174 Cb 0.12 -0.07 0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1lqv h GLN 174 CO -0.02 0.48 -0.89 -0.22 -0.95 0.00 0.00 178.83 177.24 1lqv h LYS 175 N 0.43 0.25 -0.01 1.46 3.64 -1.06 -3.20 116.57 118.09 1lqv h LYS 175 Ca 0.09 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1lqv h LYS 175 Cb 0.31 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1lqv h LYS 175 CO 0.01 1.20 -0.48 0.72 -2.27 0.00 0.00 179.45 178.64 1lqv n HIS 176 N -4.14 0.00 -0.05 1.91 8.25 -0.38 -4.40 115.22 116.41 1lqv n HIS 176 Ca -0.17 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.23 1lqv n HIS 176 Cb 0.80 -0.09 -0.02 0.00 1.12 0.00 0.00 29.99 31.80 1lqv n HIS 176 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 1lqv n ILE 177 N -0.74 1.23 -0.44 1.59 0.00 -0.92 -5.07 119.36 115.02 1lqv n ILE 177 Ca 0.09 0.23 0.00 0.00 0.00 0.00 0.00 62.75 63.07 1lqv n ILE 177 Cb 0.38 -2.06 0.00 0.00 0.00 0.00 0.00 39.64 37.96 1lqv n ILE 177 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35