#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f0x s LEU 2 N 0.00 3.03 0.16 -4.42 2.96 -1.26 -0.09 118.68 119.06 3f0x s LEU 2 Ca 0.00 -1.10 0.11 0.00 -0.22 0.00 0.00 54.13 52.92 3f0x s LEU 2 Cb 0.00 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 45.10 3f0x s LEU 2 CO 0.00 -0.13 -0.24 -0.44 -1.32 0.00 0.00 176.35 174.22 3f0x s SER 3 N 1.19 3.22 0.07 3.68 0.01 0.23 -1.43 113.70 120.67 3f0x s SER 3 Ca -0.03 -0.80 -0.20 0.00 1.31 0.00 0.00 55.95 56.23 3f0x s SER 3 Cb -0.17 -0.22 -0.07 0.00 0.21 0.00 0.00 66.02 65.77 3f0x s SER 3 CO -0.07 0.12 0.58 -0.63 0.41 0.00 0.00 173.24 173.65 3f0x s ILE 4 N -1.42 4.73 -0.22 1.44 1.01 -0.41 0.86 121.20 127.19 3f0x s ILE 4 Ca 0.16 1.24 0.02 0.00 0.00 0.00 0.00 60.65 62.07 3f0x s ILE 4 Cb -0.09 -3.91 0.05 0.00 0.01 0.00 0.00 42.46 38.52 3f0x s ILE 4 CO 0.07 0.54 -0.12 -0.22 0.00 0.00 0.00 174.94 175.22 3f0x s LEU 5 N -1.05 2.68 -0.10 2.97 2.96 0.48 -0.49 118.68 126.13 3f0x s LEU 5 Ca 0.29 -1.05 -0.14 0.00 -0.22 0.00 0.00 54.13 53.02 3f0x s LEU 5 Cb -0.20 -1.38 0.03 0.00 0.50 0.00 0.00 46.19 45.15 3f0x s LEU 5 CO 0.19 -0.14 0.36 0.54 -1.32 0.00 0.00 176.35 175.97 3f0x s VAL 6 N 1.28 0.02 -0.14 1.68 0.11 -0.44 -4.42 120.40 118.48 3f0x s VAL 6 Ca -0.03 -0.14 -0.01 0.00 -2.93 0.00 0.00 61.98 58.87 3f0x s VAL 6 Cb -0.17 -0.55 -0.02 0.00 -1.53 0.00 0.00 36.38 34.11 3f0x s VAL 6 CO -0.08 -0.08 -0.10 0.00 -3.33 0.00 0.00 175.10 171.52 3f0x s ALA 7 N -0.27 2.72 0.03 1.54 0.00 -1.26 -0.65 121.76 123.87 3f0x s ALA 7 Ca -0.04 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 50.97 3f0x s ALA 7 Cb -0.03 -1.34 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 3f0x s ALA 7 CO 0.02 0.18 0.08 -3.38 0.00 0.00 0.00 175.76 172.66 3f0x s HIS 8 N 0.46 0.18 0.00 0.00 -3.43 -0.31 -4.51 115.29 107.69 3f0x s HIS 8 Ca -0.08 -0.44 0.00 0.00 -0.80 0.00 0.00 55.06 53.74 3f0x s HIS 8 Cb -0.15 -0.14 0.00 0.00 -1.43 0.00 0.00 32.58 30.86 3f0x s HIS 8 CO 0.04 -0.32 0.00 -0.40 -2.00 0.00 0.00 174.74 172.06 3f0x n ASP 9 N 1.01 0.00 0.32 7.38 5.68 -0.44 -0.78 116.55 129.73 3f0x n ASP 9 Ca -0.20 -0.81 0.19 0.00 -0.50 0.00 0.00 54.79 53.46 3f0x n ASP 9 Cb 0.57 0.00 1.05 0.00 -1.14 0.00 0.00 41.12 41.61 3f0x n ASP 9 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3f0x h LEU 10 N 0.00 0.00 -3.12 -2.12 3.38 -1.08 -1.78 115.31 110.59 3f0x h LEU 10 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3f0x h LEU 10 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3f0x h LEU 10 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3f0x n GLN 11 N -3.49 2.14 -2.04 1.13 6.02 -1.26 -4.97 117.38 114.90 3f0x n GLN 11 Ca -0.03 -2.67 -0.16 0.00 -0.01 0.00 0.00 57.00 54.13 3f0x n GLN 11 Cb 0.08 -1.65 -0.03 0.00 1.02 0.00 0.00 30.24 29.67 3f0x n GLN 11 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3f0x n ARG 12 N -0.93 -1.24 -2.30 -1.09 1.74 -0.67 -4.91 116.66 107.25 3f0x n ARG 12 Ca 0.18 0.88 -0.41 0.00 -0.77 0.00 0.00 57.85 57.73 3f0x n ARG 12 Cb 0.74 -5.21 -0.03 0.00 -1.02 0.00 0.00 32.46 26.94 3f0x n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3f0x s VAL 13 N -2.75 3.19 0.00 1.55 1.01 -1.26 -0.75 120.40 121.39 3f0x s VAL 13 Ca 0.00 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.12 3f0x s VAL 13 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 3f0x s VAL 13 CO 0.00 0.25 0.00 2.30 0.00 0.00 0.00 175.10 177.65 3f0x n ILE 14 N 1.40 0.00 -3.56 2.22 -5.35 -0.43 -1.32 119.36 112.31 3f0x n ILE 14 Ca 0.01 -0.25 -0.17 0.00 -0.27 0.00 0.00 62.75 62.07 3f0x n ILE 14 Cb 0.43 0.82 -0.06 0.00 -1.74 0.00 0.00 39.64 39.09 3f0x n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3f0x s GLY 15 N -0.87 -0.54 -0.14 3.28 0.00 -1.14 -4.66 107.32 103.25 3f0x s GLY 15 Ca 0.00 1.39 -0.04 0.00 0.00 0.00 0.00 44.72 46.07 3f0x s GLY 15 CO 0.00 1.07 0.11 -0.12 0.00 0.00 0.00 173.10 174.15 3f0x s PHE 16 N -0.84 0.08 -1.05 1.90 2.19 -0.22 -1.05 117.98 118.99 3f0x s PHE 16 Ca -0.09 -0.07 -0.16 0.00 0.33 0.00 0.00 56.93 56.94 3f0x s PHE 16 Cb -0.01 -0.58 -0.01 0.00 -1.31 0.00 0.00 43.02 41.11 3f0x s PHE 16 CO 0.08 -0.45 0.76 0.39 1.83 0.00 0.00 175.22 177.83 3f0x n GLU 17 N 5.29 -1.28 -3.04 10.12 1.02 -1.26 -2.19 120.64 129.30 3f0x n GLU 17 Ca -0.06 0.63 -0.21 0.00 -0.02 0.00 0.00 57.16 57.50 3f0x n GLU 17 Cb 0.49 -4.12 0.01 0.00 -0.02 0.00 0.00 31.44 27.80 3f0x n GLU 17 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3f0x n ASN 18 N -2.56 -4.62 -3.89 1.62 3.02 -1.26 -4.97 115.26 102.59 3f0x n ASN 18 Ca -0.11 -0.23 -0.10 0.00 -0.03 0.00 0.00 54.58 54.11 3f0x n ASN 18 Cb 0.59 -3.80 -0.09 0.00 -0.61 0.00 0.00 39.78 35.87 3f0x n ASN 18 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3f0x s GLN 19 N -5.69 0.59 0.04 3.52 -1.52 -0.93 -4.82 119.66 110.85 3f0x s GLN 19 Ca 0.28 -0.64 -0.30 0.00 -1.95 0.00 0.00 55.36 52.75 3f0x s GLN 19 Cb -0.14 0.24 -0.04 0.00 -0.22 0.00 0.00 33.01 32.85 3f0x s GLN 19 CO 0.34 -0.15 0.98 -0.51 -0.25 0.00 0.00 175.29 175.70 3f0x s LEU 20 N -1.94 4.42 0.55 2.90 1.43 -1.26 -1.06 118.68 123.72 3f0x s LEU 20 Ca -0.07 1.72 0.23 0.00 -1.03 0.00 0.00 54.13 54.97 3f0x s LEU 20 Cb -0.03 -3.58 1.52 0.00 0.03 0.00 0.00 46.19 44.14 3f0x s LEU 20 CO -0.03 -0.19 2.17 -0.65 0.23 0.00 0.00 176.35 177.88 3f0x h PRO 21 N 6.34 0.00 -6.23 1.29 0.11 -1.88 -3.45 132.00 128.19 3f0x h PRO 21 Ca -0.42 0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.08 3f0x h PRO 21 Cb 1.22 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.18 3f0x h PRO 21 CO 0.74 0.00 -0.76 1.67 -0.21 0.00 0.00 178.00 179.43 3f0x s TRP 22 N -4.86 2.29 -0.34 0.65 -2.14 -1.26 -5.09 118.94 108.18 3f0x s TRP 22 Ca -0.05 -0.33 -0.00 0.00 2.66 0.00 0.00 56.10 58.37 3f0x s TRP 22 Cb 0.16 -1.00 0.08 0.00 -3.10 0.00 0.00 33.47 29.62 3f0x s TRP 22 CO 0.62 0.70 0.07 -1.01 -2.66 0.00 0.00 176.95 174.67 3f0x s HIS 23 N -2.46 3.51 -0.51 1.66 3.76 -1.26 -5.05 115.29 114.94 3f0x s HIS 23 Ca 0.29 -2.41 0.04 0.00 -0.15 0.00 0.00 55.06 52.84 3f0x s HIS 23 Cb -0.05 -2.69 0.17 0.00 1.11 0.00 0.00 32.58 31.12 3f0x s HIS 23 CO 0.15 -0.91 0.40 -0.11 -0.85 0.00 0.00 174.74 173.42 3f0x n LEU 24 N 4.50 0.73 -0.31 0.89 7.94 -1.26 -4.73 117.00 124.76 3f0x n LEU 24 Ca -0.05 -4.67 0.25 0.00 -1.11 0.00 0.00 56.01 50.43 3f0x n LEU 24 Cb 0.42 0.10 0.56 0.00 0.53 0.00 0.00 43.42 45.04 3f0x n LEU 24 CO 0.27 1.83 1.24 -0.65 -1.11 0.00 0.00 177.39 178.97 3f0x h PRO 25 N 5.50 0.29 -0.67 1.96 0.11 -1.97 -0.50 132.00 136.73 3f0x h PRO 25 Ca 0.23 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.31 3f0x h PRO 25 Cb 0.85 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.86 3f0x h PRO 25 CO 0.49 0.20 0.39 -0.91 -0.21 0.00 0.00 178.00 177.96 3f0x h ASN 26 N 0.30 0.80 0.74 -2.05 4.21 -1.94 -2.15 115.58 115.50 3f0x h ASN 26 Ca 0.57 -0.05 -0.12 0.00 1.21 0.00 0.00 56.30 57.91 3f0x h ASN 26 Cb 1.61 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 38.59 3f0x h ASN 26 CO -0.22 0.63 -0.58 -0.78 -1.29 0.00 0.00 177.43 175.19 3f0x h ASP 27 N 0.92 0.00 0.91 5.81 1.82 -1.52 -2.33 116.42 122.03 3f0x h ASP 27 Ca 0.24 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.74 3f0x h ASP 27 Cb -0.02 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 39.97 3f0x h ASP 27 CO -0.04 0.58 -0.67 -0.07 -1.61 0.00 0.00 179.24 177.42 3f0x h LEU 28 N 0.00 0.00 -0.33 2.28 3.38 -1.33 -1.36 115.31 117.95 3f0x h LEU 28 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3f0x h LEU 28 Cb 1.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 3f0x h LEU 28 CO 0.08 0.67 0.00 0.11 0.09 0.00 0.00 178.44 179.39 3f0x h LYS 29 N 0.00 0.57 -1.00 1.13 1.79 -1.30 -1.97 116.57 115.79 3f0x h LYS 29 Ca -0.01 -0.18 0.03 0.00 -2.18 0.00 0.00 60.65 58.31 3f0x h LYS 29 Cb 1.31 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.85 3f0x h LYS 29 CO 0.09 0.70 0.66 1.25 -1.08 0.00 0.00 179.45 181.06 3f0x h HIS 30 N 0.38 1.24 -0.36 -1.35 2.76 -1.31 0.18 115.15 116.68 3f0x h HIS 30 Ca 0.09 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.21 3f0x h HIS 30 Cb 0.44 -0.41 -0.01 0.00 1.55 0.00 0.00 27.41 28.97 3f0x h HIS 30 CO 0.04 0.73 -0.08 0.28 -1.30 0.00 0.00 177.93 177.60 3f0x h VAL 31 N 1.29 1.28 0.14 5.26 2.07 -1.14 -1.87 116.25 123.27 3f0x h VAL 31 Ca 0.39 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 3f0x h VAL 31 Cb -0.05 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3f0x h VAL 31 CO -0.11 0.38 -0.07 0.11 0.02 0.00 0.00 177.57 177.90 3f0x h LYS 32 N 0.49 -0.18 -0.76 1.57 1.57 -0.74 -1.75 116.57 116.77 3f0x h LYS 32 Ca 0.09 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.92 3f0x h LYS 32 Cb 0.59 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.89 3f0x h LYS 32 CO 0.03 -0.04 0.48 -0.22 -0.57 0.00 0.00 179.45 179.14 3f0x h LYS 33 N -0.29 0.90 -0.12 3.15 3.64 -0.69 -1.57 116.57 121.59 3f0x h LYS 33 Ca -0.02 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.14 3f0x h LYS 33 Cb 0.23 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3f0x h LYS 33 CO 0.03 0.60 -0.63 1.25 -2.27 0.00 0.00 179.45 178.43 3f0x h LEU 34 N 0.93 0.50 -0.61 5.20 5.85 -1.26 -3.36 115.31 122.56 3f0x h LEU 34 Ca 0.31 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3f0x h LEU 34 Cb 0.03 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.91 3f0x h LEU 34 CO -0.12 1.00 -0.17 -1.54 -0.34 0.00 0.00 178.44 177.28 3f0x n SER 35 N -3.90 0.94 -4.69 1.25 3.41 -0.66 -4.92 113.62 105.05 3f0x n SER 35 Ca -0.04 -0.97 -0.42 0.00 -0.26 0.00 0.00 58.87 57.18 3f0x n SER 35 Cb 0.65 0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 65.10 3f0x n SER 35 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3f0x n THR 36 N -0.41 0.44 -0.57 6.66 -1.04 -0.61 -1.38 114.28 117.37 3f0x n THR 36 Ca 0.03 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.96 3f0x n THR 36 Cb 0.15 -2.17 0.00 0.00 -1.82 0.00 0.00 70.33 66.48 3f0x n THR 36 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3f0x n GLY 37 N 4.31 0.76 0.00 3.41 0.00 -0.35 -5.02 105.19 108.30 3f0x n GLY 37 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3f0x n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3f0x n HIS 38 N -2.21 -0.01 -5.00 1.61 -0.00 -0.48 -4.89 115.22 104.23 3f0x n HIS 38 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.40 3f0x n HIS 38 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 29.85 3f0x n HIS 38 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 3f0x s THR 39 N 0.70 2.75 -0.14 1.59 2.01 -0.92 -0.43 115.64 121.21 3f0x s THR 39 Ca 0.00 -0.83 0.00 0.00 0.31 0.00 0.00 61.69 61.17 3f0x s THR 39 Cb 0.00 -2.06 -0.01 0.00 0.01 0.00 0.00 72.50 70.44 3f0x s THR 39 CO 0.00 0.58 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.61 3f0x s LEU 40 N -0.52 2.64 -0.16 4.42 1.43 0.89 -0.76 118.68 126.61 3f0x s LEU 40 Ca 0.07 -0.37 -0.01 0.00 -1.03 0.00 0.00 54.13 52.79 3f0x s LEU 40 Cb -0.11 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 3f0x s LEU 40 CO 0.01 0.14 -0.13 -0.69 0.23 0.00 0.00 176.35 175.92 3f0x s VAL 41 N 0.50 2.90 0.03 -1.59 1.01 -0.40 -0.06 120.40 122.79 3f0x s VAL 41 Ca -0.09 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3f0x s VAL 41 Cb -0.16 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.95 3f0x s VAL 41 CO 0.04 0.50 -0.05 0.00 0.00 0.00 0.00 175.10 175.59 3f0x s MET 42 N 0.83 0.43 0.83 2.72 0.23 -0.03 -0.79 119.30 123.53 3f0x s MET 42 Ca -0.04 -0.73 -0.11 0.00 -1.03 0.00 0.00 55.69 53.78 3f0x s MET 42 Cb -0.15 -0.05 0.09 0.00 -1.53 0.00 0.00 34.83 33.19 3f0x s MET 42 CO 0.00 -0.01 1.10 0.20 -2.03 0.00 0.00 175.02 174.28 3f0x s GLY 43 N -1.65 1.66 0.42 3.16 0.00 0.91 -0.80 107.32 111.02 3f0x s GLY 43 Ca -0.11 0.24 0.12 0.00 0.00 0.00 0.00 44.72 44.97 3f0x s GLY 43 CO -0.01 0.64 1.98 -0.09 0.00 0.00 0.00 173.10 175.62 3f0x h ARG 44 N -1.38 0.47 -0.05 2.90 1.12 -1.73 -1.63 114.38 114.08 3f0x h ARG 44 Ca -0.45 -0.03 -0.20 0.00 -1.11 0.00 0.00 59.98 58.19 3f0x h ARG 44 Cb 1.25 -0.11 -0.00 0.00 -0.01 0.00 0.00 29.97 31.10 3f0x h ARG 44 CO 0.50 0.31 -0.81 0.87 -3.11 0.00 0.00 179.97 177.73 3f0x h LYS 45 N 0.49 0.43 0.14 0.20 1.57 -1.92 -1.61 116.57 115.86 3f0x h LYS 45 Ca 0.27 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3f0x h LYS 45 Cb 0.43 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3f0x h LYS 45 CO -0.08 1.04 -0.07 1.15 -0.57 0.00 0.00 179.45 180.92 3f0x h THR 46 N 0.27 0.97 -0.76 -0.16 2.02 -1.74 -1.39 112.91 112.11 3f0x h THR 46 Ca -0.05 -0.43 0.14 0.00 0.77 0.00 0.00 66.41 66.84 3f0x h THR 46 Cb 1.41 1.23 -0.09 0.00 -1.74 0.00 0.00 68.15 68.96 3f0x h THR 46 CO 0.14 0.10 0.33 0.15 0.37 0.00 0.00 175.52 176.61 3f0x h PHE 47 N -0.38 0.56 0.00 3.16 3.04 -1.29 -2.55 116.94 119.48 3f0x h PHE 47 Ca -0.02 0.04 -0.08 0.00 3.98 0.00 0.00 57.97 61.88 3f0x h PHE 47 Cb 0.31 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.67 3f0x h PHE 47 CO -0.01 0.09 -0.40 0.93 -2.02 0.00 0.00 178.31 176.91 3f0x h GLU 48 N 0.48 0.00 -0.37 1.11 5.08 -1.03 0.13 114.58 119.99 3f0x h GLU 48 Ca 0.42 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.70 3f0x h GLU 48 Cb 0.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 3f0x h GLU 48 CO -0.39 0.40 -0.09 0.66 -1.00 0.00 0.00 179.01 178.59 3f0x h SER 49 N 0.00 0.61 0.07 1.42 4.64 -0.85 -3.21 113.55 116.23 3f0x h SER 49 Ca -0.00 -0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3f0x h SER 49 Cb 0.91 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3f0x h SER 49 CO 0.05 0.74 -0.03 0.40 -0.87 0.00 0.00 176.83 177.12 3f0x h ILE 50 N 0.58 1.19 0.00 0.95 2.04 -1.14 -3.49 117.51 117.64 3f0x h ILE 50 Ca 0.11 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.50 3f0x h ILE 50 Cb 0.50 2.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 3f0x h ILE 50 CO 0.03 0.33 0.00 0.61 0.00 0.00 0.00 178.15 179.12 3f0x n GLY 51 N 0.86 2.91 3.28 5.37 0.00 0.41 -5.01 105.19 113.01 3f0x n GLY 51 Ca -0.08 -0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 3f0x n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f0x s LYS 52 N 0.00 1.13 0.51 1.61 0.00 -1.26 -5.01 119.74 116.73 3f0x s LYS 52 Ca 0.00 -1.42 -0.22 0.00 0.00 0.00 0.00 55.97 54.33 3f0x s LYS 52 Cb 0.00 -0.87 -0.06 0.00 0.00 0.00 0.00 37.83 36.90 3f0x s LYS 52 CO 0.00 0.14 1.27 -1.25 0.00 0.00 0.00 175.35 175.51 3f0x s PRO 53 N -3.36 3.38 0.02 1.78 0.04 -1.26 -5.01 135.00 130.59 3f0x s PRO 53 Ca 0.16 2.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 3f0x s PRO 53 Cb -0.01 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 3f0x s PRO 53 CO 0.03 -0.93 1.03 -0.51 0.04 0.00 0.00 177.00 176.67 3f0x s LEU 54 N -3.36 4.38 0.75 -3.56 1.43 -1.26 -5.02 118.68 112.04 3f0x s LEU 54 Ca 0.69 1.76 -0.14 0.00 -1.03 0.00 0.00 54.13 55.41 3f0x s LEU 54 Cb -0.35 -3.57 0.05 0.00 0.03 0.00 0.00 46.19 42.35 3f0x s LEU 54 CO 0.41 -0.30 1.17 -2.84 0.23 0.00 0.00 176.35 175.02 3f0x s PRO 55 N 0.95 2.09 -0.93 1.29 0.02 -1.26 -4.04 135.00 133.12 3f0x s PRO 55 Ca 0.53 1.59 -0.01 0.00 0.02 0.00 0.00 61.00 63.14 3f0x s PRO 55 Cb -0.23 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.44 3f0x s PRO 55 CO 0.28 -1.84 0.13 0.09 -0.33 0.00 0.00 177.00 175.34 3f0x n ASN 56 N -2.99 -3.85 -3.50 2.53 5.03 -1.26 -4.97 115.26 106.25 3f0x n ASN 56 Ca 0.12 -0.07 -0.09 0.00 0.87 0.00 0.00 54.58 55.41 3f0x n ASN 56 Cb 0.51 -2.94 -0.02 0.00 -1.02 0.00 0.00 39.78 36.30 3f0x n ASN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3f0x s ARG 57 N -4.80 0.86 0.01 3.52 1.70 -1.26 -1.21 118.95 117.77 3f0x s ARG 57 Ca 0.06 -0.25 -0.30 0.00 -0.47 0.00 0.00 55.73 54.77 3f0x s ARG 57 Cb -0.03 0.40 -0.06 0.00 -0.57 0.00 0.00 34.95 34.69 3f0x s ARG 57 CO 0.08 -0.36 1.47 1.03 -1.08 0.00 0.00 175.30 176.44 3f0x s ARG 58 N -2.90 4.26 -0.35 3.89 1.81 0.43 -4.89 118.95 121.19 3f0x s ARG 58 Ca 0.03 2.06 -0.10 0.00 -1.72 0.00 0.00 55.73 55.99 3f0x s ARG 58 Cb -0.01 -3.61 0.01 0.00 -0.45 0.00 0.00 34.95 30.90 3f0x s ARG 58 CO -0.08 -0.63 0.18 -0.80 -0.68 0.00 0.00 175.30 173.30 3f0x s ASN 59 N 2.08 5.65 -0.18 0.23 0.01 -1.26 -0.08 114.94 121.40 3f0x s ASN 59 Ca 0.66 -0.81 -0.02 0.00 -0.71 0.00 0.00 52.86 51.99 3f0x s ASN 59 Cb -0.33 -2.01 -0.01 0.00 0.41 0.00 0.00 41.25 39.31 3f0x s ASN 59 CO 0.28 -0.31 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.76 3f0x s VAL 60 N 1.57 3.00 -0.16 1.60 1.01 0.91 -1.51 120.40 126.82 3f0x s VAL 60 Ca 0.03 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 3f0x s VAL 60 Cb -0.18 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 3f0x s VAL 60 CO 0.06 0.48 -0.11 -0.69 0.00 0.00 0.00 175.10 174.85 3f0x s VAL 61 N 1.03 3.11 -0.16 2.92 1.01 -0.25 -0.85 120.40 127.21 3f0x s VAL 61 Ca -0.01 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.17 3f0x s VAL 61 Cb -0.15 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 3f0x s VAL 61 CO -0.02 0.49 0.50 -0.22 0.00 0.00 0.00 175.10 175.86 3f0x s LEU 62 N 0.76 4.20 0.18 3.92 2.96 0.02 -1.47 118.68 129.25 3f0x s LEU 62 Ca -0.04 0.73 -0.21 0.00 -0.22 0.00 0.00 54.13 54.40 3f0x s LEU 62 Cb -0.15 -2.70 0.05 0.00 0.50 0.00 0.00 46.19 43.89 3f0x s LEU 62 CO 0.01 -0.10 0.57 0.28 -1.32 0.00 0.00 176.35 175.79 3f0x s THR 63 N 1.20 0.02 -1.62 3.68 -1.32 -0.80 -1.91 115.64 114.88 3f0x s THR 63 Ca 0.25 -0.40 0.23 0.00 -1.21 0.00 0.00 61.69 60.56 3f0x s THR 63 Cb -0.15 -1.30 -0.05 0.00 -1.51 0.00 0.00 72.50 69.49 3f0x s THR 63 CO 0.10 -0.07 1.10 -1.54 -2.21 0.00 0.00 174.62 172.00 3f0x n SER 64 N -0.36 1.51 -4.61 8.08 3.41 -1.26 -4.14 113.62 116.25 3f0x n SER 64 Ca -0.13 -1.21 -0.43 0.00 -0.26 0.00 0.00 58.87 56.83 3f0x n SER 64 Cb 0.63 0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 65.15 3f0x n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3f0x s ASP 65 N -2.68 6.20 0.19 4.04 3.68 -1.26 -4.89 116.67 121.95 3f0x s ASP 65 Ca 0.15 1.17 0.25 0.00 2.13 0.00 0.00 52.55 56.26 3f0x s ASP 65 Cb 0.18 -2.53 0.90 0.00 -1.45 0.00 0.00 42.92 40.01 3f0x s ASP 65 CO 0.67 -1.48 1.76 0.35 0.13 0.00 0.00 175.17 176.60 3f0x n THR 66 N 7.04 0.61 0.17 1.71 -2.24 -1.26 -2.43 114.28 117.88 3f0x n THR 66 Ca 0.19 -0.08 0.10 0.00 -2.27 0.00 0.00 64.05 62.00 3f0x n THR 66 Cb 0.47 -0.76 0.09 0.00 -2.10 0.00 0.00 70.33 68.03 3f0x n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3f0x h SER 67 N 0.00 0.00 -2.11 3.42 0.02 -2.02 -3.47 113.55 109.40 3f0x h SER 67 Ca 0.00 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.38 3f0x h SER 67 Cb 0.58 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.13 3f0x h SER 67 CO 0.00 0.07 1.30 0.33 -1.14 0.00 0.00 176.83 177.40 3f0x n PHE 68 N -2.96 2.26 -3.70 3.45 7.35 -1.02 -4.95 117.46 117.90 3f0x n PHE 68 Ca 0.02 -0.20 -0.12 0.00 -0.76 0.00 0.00 57.45 56.39 3f0x n PHE 68 Cb 0.57 -2.74 -0.13 0.00 0.35 0.00 0.00 39.48 37.53 3f0x n PHE 68 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 3f0x s ASN 69 N 5.76 -0.10 -0.02 -2.13 3.84 -1.26 -4.97 114.94 116.06 3f0x s ASN 69 Ca 0.95 0.62 0.00 0.00 0.21 0.00 0.00 52.86 54.64 3f0x s ASN 69 Cb -0.48 0.60 0.02 0.00 -0.55 0.00 0.00 41.25 40.85 3f0x s ASN 69 CO 0.42 -0.20 0.01 -0.69 -2.79 0.00 0.00 177.10 173.85 3f0x s VAL 70 N 1.73 0.07 -0.12 -5.21 1.01 -1.26 -5.12 120.40 111.50 3f0x s VAL 70 Ca -0.06 0.11 -0.36 0.00 0.00 0.00 0.00 61.98 61.68 3f0x s VAL 70 Cb -0.11 -0.17 -0.13 0.00 0.00 0.00 0.00 36.38 35.98 3f0x s VAL 70 CO -0.09 0.10 1.83 -0.62 0.00 0.00 0.00 175.10 176.32 3f0x n GLU 71 N 3.96 1.92 -0.63 2.72 -0.58 -1.26 -2.11 120.64 124.66 3f0x n GLU 71 Ca -0.25 0.70 0.00 0.00 -0.42 0.00 0.00 57.16 57.20 3f0x n GLU 71 Cb 0.52 -2.50 0.00 0.00 -0.57 0.00 0.00 31.44 28.88 3f0x n GLU 71 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3f0x n GLY 72 N 4.28 0.62 2.77 0.62 0.00 -1.26 -4.79 105.19 107.44 3f0x n GLY 72 Ca 0.23 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 3f0x n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f0x s VAL 73 N -2.00 0.31 0.29 1.61 1.01 -0.90 -4.47 120.40 116.25 3f0x s VAL 73 Ca 0.00 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 3f0x s VAL 73 Cb 0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 36.38 35.83 3f0x s VAL 73 CO 0.00 0.24 0.74 -1.81 0.00 0.00 0.00 175.10 174.27 3f0x s ASP 74 N 1.86 6.89 -0.06 3.32 1.01 -0.57 -4.54 116.67 124.58 3f0x s ASP 74 Ca 0.03 1.35 0.04 0.00 0.71 0.00 0.00 52.55 54.68 3f0x s ASP 74 Cb -0.12 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.39 3f0x s ASP 74 CO -0.04 -0.12 -0.19 -0.69 0.21 0.00 0.00 175.17 174.34 3f0x s VAL 75 N -1.82 2.65 0.23 -1.27 1.01 -1.26 -1.09 120.40 118.85 3f0x s VAL 75 Ca 0.50 -0.86 0.09 0.00 0.00 0.00 0.00 61.98 61.71 3f0x s VAL 75 Cb -0.13 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 3f0x s VAL 75 CO 0.19 0.57 -0.15 0.27 0.00 0.00 0.00 175.10 175.98 3f0x s ILE 76 N -0.39 1.90 0.00 2.22 -4.36 -0.54 -4.93 121.20 115.10 3f0x s ILE 76 Ca 0.04 -2.25 0.00 0.00 -0.26 0.00 0.00 60.65 58.18 3f0x s ILE 76 Cb -0.12 -2.16 0.00 0.00 1.25 0.00 0.00 42.46 41.43 3f0x s ILE 76 CO 0.02 -0.51 0.00 1.41 0.24 0.00 0.00 174.94 176.10 3f0x n HIS 77 N -0.46 0.00 -4.12 1.37 8.25 -1.26 -1.91 115.22 117.09 3f0x n HIS 77 Ca -0.07 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.29 3f0x n HIS 77 Cb 0.61 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.61 3f0x n HIS 77 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3f0x s SER 78 N -0.93 0.87 0.53 0.41 1.04 -1.26 -4.74 113.70 109.62 3f0x s SER 78 Ca 0.00 -0.91 0.24 0.00 0.48 0.00 0.00 55.95 55.76 3f0x s SER 78 Cb 0.00 0.12 1.38 0.00 0.10 0.00 0.00 66.02 67.62 3f0x s SER 78 CO 0.00 -0.45 2.03 -0.29 0.98 0.00 0.00 173.24 175.51 3f0x h ILE 79 N 3.34 0.77 0.00 -1.02 6.09 -2.00 -2.47 117.51 122.22 3f0x h ILE 79 Ca -0.35 0.00 -0.06 0.00 -1.37 0.00 0.00 64.86 63.08 3f0x h ILE 79 Cb 1.17 0.79 -0.01 0.00 0.47 0.00 0.00 36.82 39.24 3f0x h ILE 79 CO 0.60 0.00 -0.29 -0.33 -3.07 0.00 0.00 178.15 175.06 3f0x h GLU 80 N 0.00 0.00 0.00 2.19 4.39 -2.03 -2.77 114.58 116.36 3f0x h GLU 80 Ca 0.19 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 3f0x h GLU 80 Cb 0.79 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.44 3f0x h GLU 80 CO -0.00 0.29 -0.09 -0.44 -1.16 0.00 0.00 179.01 177.60 3f0x h ASP 81 N 0.00 0.00 -0.41 1.42 3.32 -1.86 -3.02 116.42 115.86 3f0x h ASP 81 Ca -0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 3f0x h ASP 81 Cb 0.77 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.29 3f0x h ASP 81 CO 0.04 0.09 0.22 0.40 -1.72 0.00 0.00 179.24 178.27 3f0x h ILE 82 N 0.00 0.99 0.00 0.35 2.04 -1.65 -2.09 117.51 117.15 3f0x h ILE 82 Ca -0.00 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.71 3f0x h ILE 82 Cb 0.46 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3f0x h ILE 82 CO 0.01 0.08 0.00 1.88 0.00 0.00 0.00 178.15 180.12 3f0x h TYR 83 N 0.44 0.00 -0.01 1.37 0.05 -1.72 -1.47 116.97 115.63 3f0x h TYR 83 Ca 0.17 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.95 3f0x h TYR 83 Cb 0.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.81 3f0x h TYR 83 CO -0.09 0.00 -0.09 1.04 -1.05 0.00 0.00 178.16 177.97 3f0x n GLN 84 N -2.70 1.17 -2.88 4.88 3.00 -0.79 -4.88 117.38 115.17 3f0x n GLN 84 Ca -0.01 -0.57 -0.41 0.00 -0.01 0.00 0.00 57.00 56.00 3f0x n GLN 84 Cb 0.14 -1.49 -0.04 0.00 0.00 0.00 0.00 30.24 28.85 3f0x n GLN 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3f0x s LEU 85 N -2.22 4.26 0.52 1.08 1.43 -0.55 -5.04 118.68 118.15 3f0x s LEU 85 Ca 0.34 1.30 -0.21 0.00 -1.03 0.00 0.00 54.13 54.54 3f0x s LEU 85 Cb 0.20 -3.28 -0.06 0.00 0.03 0.00 0.00 46.19 43.08 3f0x s LEU 85 CO 0.41 -0.29 1.17 -2.16 0.23 0.00 0.00 176.35 175.71 3f0x s PRO 86 N 1.50 3.45 0.07 1.29 0.04 -1.26 -4.94 135.00 135.15 3f0x s PRO 86 Ca 0.42 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.20 3f0x s PRO 86 Cb -0.18 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.19 3f0x s PRO 86 CO 0.18 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.82 3f0x n GLY 87 N 0.36 -1.90 3.63 0.56 0.00 -1.26 -4.80 105.19 101.77 3f0x n GLY 87 Ca 0.10 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 3f0x n GLY 87 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3f0x s HIS 88 N 0.00 3.27 -0.21 1.61 5.65 -1.26 -2.34 115.29 122.00 3f0x s HIS 88 Ca 0.00 0.90 -0.03 0.00 0.25 0.00 0.00 55.06 56.18 3f0x s HIS 88 Cb 0.00 -3.00 -0.00 0.00 -1.18 0.00 0.00 32.58 28.40 3f0x s HIS 88 CO 0.00 -0.41 -0.07 0.08 -0.65 0.00 0.00 174.74 173.69 3f0x s VAL 89 N 2.72 3.15 -0.29 0.89 1.01 0.87 -2.18 120.40 126.57 3f0x s VAL 89 Ca 0.30 -0.57 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 3f0x s VAL 89 Cb -0.15 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 3f0x s VAL 89 CO 0.09 0.44 0.18 -0.36 0.00 0.00 0.00 175.10 175.46 3f0x s PHE 90 N 1.44 3.20 -0.29 5.22 0.08 0.06 -0.60 117.98 127.09 3f0x s PHE 90 Ca 0.06 -0.02 -0.29 0.00 0.12 0.00 0.00 56.93 56.80 3f0x s PHE 90 Cb -0.14 -2.38 -0.01 0.00 -0.57 0.00 0.00 43.02 39.93 3f0x s PHE 90 CO -0.05 -0.22 1.46 0.42 -0.10 0.00 0.00 175.22 176.73 3f0x s ILE 91 N 1.73 3.90 -1.57 0.64 -1.09 0.25 -1.27 121.20 123.78 3f0x s ILE 91 Ca 0.07 0.99 0.16 0.00 -2.23 0.00 0.00 60.65 59.64 3f0x s ILE 91 Cb -0.16 -3.97 0.02 0.00 -1.58 0.00 0.00 42.46 36.76 3f0x s ILE 91 CO 0.10 -0.46 0.88 0.33 -1.23 0.00 0.00 174.94 174.57 3f0x n PHE 92 N 8.29 0.00 0.00 3.97 -0.00 0.03 -0.39 117.46 129.36 3f0x n PHE 92 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.62 3f0x n PHE 92 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.94 3f0x n PHE 92 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3f0x n GLY 93 N 1.12 3.86 0.00 7.13 0.00 -1.25 -4.92 105.19 111.13 3f0x n GLY 93 Ca 0.07 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3f0x n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0x n GLY 94 N -1.89 4.01 0.11 -0.02 0.00 -1.26 -0.07 105.19 106.08 3f0x n GLY 94 Ca 0.00 -1.38 -0.08 0.00 0.00 0.00 0.00 46.02 44.55 3f0x n GLY 94 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3f0x h GLN 95 N 0.00 0.09 -0.54 1.61 4.15 -1.97 -1.18 115.11 117.26 3f0x h GLN 95 Ca 0.00 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.33 3f0x h GLN 95 Cb 0.00 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 3f0x h GLN 95 CO 0.00 0.06 0.00 1.79 -1.93 0.00 0.00 178.83 178.75 3f0x h THR 96 N 0.09 1.26 -0.18 2.39 1.35 -1.95 -0.92 112.91 114.94 3f0x h THR 96 Ca 0.11 -1.10 -0.01 0.00 -0.55 0.00 0.00 66.41 64.85 3f0x h THR 96 Cb 0.13 0.91 -0.01 0.00 -1.73 0.00 0.00 68.15 67.45 3f0x h THR 96 CO -0.17 0.39 0.08 0.25 -0.25 0.00 0.00 175.52 175.82 3f0x h LEU 97 N 0.83 0.25 -0.95 3.87 5.85 -1.79 -1.36 115.31 122.01 3f0x h LEU 97 Ca 0.15 -0.14 0.10 0.00 0.84 0.00 0.00 57.88 58.83 3f0x h LEU 97 Cb 0.53 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.42 3f0x h LEU 97 CO 0.03 0.32 0.59 1.88 -0.34 0.00 0.00 178.44 180.92 3f0x h TYR 98 N 0.16 1.07 -0.68 1.25 0.05 -1.11 0.30 116.97 118.01 3f0x h TYR 98 Ca 0.06 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.86 3f0x h TYR 98 Cb 0.15 -0.34 -0.03 0.00 1.01 0.00 0.00 36.73 37.52 3f0x h TYR 98 CO -0.02 0.46 0.36 1.49 -1.05 0.00 0.00 178.16 179.40 3f0x h GLU 99 N 0.97 0.94 0.02 4.88 4.81 -0.79 0.25 114.58 125.66 3f0x h GLU 99 Ca 0.45 -0.11 -0.21 0.00 -0.13 0.00 0.00 59.36 59.37 3f0x h GLU 99 Cb 0.38 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 3f0x h GLU 99 CO -0.24 0.70 -0.97 0.93 -0.73 0.00 0.00 179.01 178.70 3f0x h GLU 100 N 0.95 0.05 0.00 1.92 5.08 -0.09 -3.38 114.58 119.11 3f0x h GLU 100 Ca 0.24 -0.08 -0.19 0.00 -1.00 0.00 0.00 59.36 58.34 3f0x h GLU 100 Cb 0.04 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 3f0x h GLU 100 CO -0.04 0.98 -2.14 -1.33 -1.00 0.00 0.00 179.01 175.48 3f0x n MET 101 N -3.46 0.67 -0.25 2.33 2.81 0.96 -4.61 117.12 115.57 3f0x n MET 101 Ca -0.02 -0.08 0.19 0.00 -1.81 0.00 0.00 57.70 55.99 3f0x n MET 101 Cb 0.90 -1.54 0.51 0.00 -0.71 0.00 0.00 33.22 32.38 3f0x n MET 101 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3f0x h ILE 102 N 0.00 0.67 0.00 2.02 2.10 -0.71 0.25 117.51 121.84 3f0x h ILE 102 Ca -0.27 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 65.53 3f0x h ILE 102 Cb 1.63 0.22 0.00 0.00 -1.09 0.00 0.00 36.82 37.58 3f0x h ILE 102 CO 0.02 0.07 0.00 0.47 -1.08 0.00 0.00 178.15 177.63 3f0x n ASP 103 N -4.52 0.82 -0.00 2.19 8.00 -1.26 -3.79 116.55 117.99 3f0x n ASP 103 Ca 0.20 0.60 0.08 0.00 0.71 0.00 0.00 54.79 56.37 3f0x n ASP 103 Cb 0.71 -0.81 -0.10 0.00 -0.02 0.00 0.00 41.12 40.90 3f0x n ASP 103 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3f0x n LYS 104 N -2.29 1.29 -2.63 -1.24 4.76 0.83 -5.01 118.16 113.87 3f0x n LYS 104 Ca 0.05 -0.05 -0.36 0.00 -2.87 0.00 0.00 58.31 55.08 3f0x n LYS 104 Cb 0.40 -1.31 -0.05 0.00 -1.84 0.00 0.00 35.03 32.23 3f0x n LYS 104 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3f0x s VAL 105 N -2.73 3.93 0.21 -0.18 -7.23 -0.93 -4.95 120.40 108.53 3f0x s VAL 105 Ca 0.02 1.41 0.01 0.00 -1.81 0.00 0.00 61.98 61.62 3f0x s VAL 105 Cb 0.12 -3.69 -0.06 0.00 0.56 0.00 0.00 36.38 33.31 3f0x s VAL 105 CO 0.67 -0.06 1.52 0.44 -0.31 0.00 0.00 175.10 177.37 3f0x h ASP 106 N 2.38 0.40 -3.99 4.85 3.32 -1.62 -3.47 116.42 118.30 3f0x h ASP 106 Ca -0.48 -0.23 -0.12 0.00 0.02 0.00 0.00 57.03 56.21 3f0x h ASP 106 Cb 1.21 -0.12 -0.24 0.00 0.22 0.00 0.00 39.33 40.40 3f0x h ASP 106 CO 0.62 0.92 -0.25 -0.62 -1.72 0.00 0.00 179.24 178.19 3f0x s ASP 107 N -6.92 -0.39 -0.03 6.45 2.15 -1.21 -2.84 116.67 113.88 3f0x s ASP 107 Ca -0.05 0.73 0.02 0.00 0.43 0.00 0.00 52.55 53.68 3f0x s ASP 107 Cb 0.11 0.75 0.01 0.00 -0.30 0.00 0.00 42.92 43.50 3f0x s ASP 107 CO 0.82 -0.17 -0.08 -0.04 -0.17 0.00 0.00 175.17 175.53 3f0x s MET 108 N 0.05 0.94 -0.39 4.34 -1.94 0.80 -1.29 119.30 121.81 3f0x s MET 108 Ca -0.01 -0.25 -0.01 0.00 -1.71 0.00 0.00 55.69 53.71 3f0x s MET 108 Cb -0.03 -0.88 0.11 0.00 2.01 0.00 0.00 34.83 36.04 3f0x s MET 108 CO 0.01 0.05 0.16 0.71 -0.01 0.00 0.00 175.02 175.95 3f0x s TYR 109 N 0.41 3.63 -0.16 -0.03 1.51 0.35 -0.87 117.35 122.18 3f0x s TYR 109 Ca -0.06 -2.55 -0.02 0.00 -1.01 0.00 0.00 57.07 53.43 3f0x s TYR 109 Cb -0.10 -3.14 -0.01 0.00 -0.11 0.00 0.00 41.96 38.59 3f0x s TYR 109 CO 0.01 -0.97 -0.09 0.42 -1.11 0.00 0.00 175.55 173.81 3f0x s ILE 110 N 1.08 3.22 -0.45 2.71 1.01 0.14 -1.33 121.20 127.58 3f0x s ILE 110 Ca 0.09 -0.58 -0.18 0.00 0.00 0.00 0.00 60.65 59.98 3f0x s ILE 110 Cb -0.22 -2.40 0.04 0.00 0.01 0.00 0.00 42.46 39.89 3f0x s ILE 110 CO -0.05 0.49 0.49 -0.89 0.00 0.00 0.00 174.94 174.97 3f0x s THR 111 N 0.76 5.05 -0.43 2.92 2.01 0.18 0.41 115.64 126.54 3f0x s THR 111 Ca -0.04 -0.51 -0.28 0.00 0.31 0.00 0.00 61.69 61.18 3f0x s THR 111 Cb -0.15 -4.13 0.02 0.00 0.01 0.00 0.00 72.50 68.25 3f0x s THR 111 CO 0.02 -0.56 1.04 -0.69 -0.69 0.00 0.00 174.62 173.73 3f0x s VAL 112 N 2.20 4.39 -0.44 3.82 1.01 -0.19 -1.16 120.40 130.03 3f0x s VAL 112 Ca 0.12 1.19 -0.27 0.00 0.00 0.00 0.00 61.98 63.01 3f0x s VAL 112 Cb -0.19 -4.48 0.03 0.00 0.00 0.00 0.00 36.38 31.73 3f0x s VAL 112 CO 0.12 -0.79 1.03 -0.63 0.00 0.00 0.00 175.10 174.83 3f0x s ILE 113 N 3.97 4.37 -1.15 2.22 -1.09 0.04 -1.06 121.20 128.52 3f0x s ILE 113 Ca 0.43 1.11 -0.12 0.00 -2.23 0.00 0.00 60.65 59.84 3f0x s ILE 113 Cb -0.10 -4.50 -0.07 0.00 -1.58 0.00 0.00 42.46 36.22 3f0x s ILE 113 CO 0.25 -0.84 2.30 -0.62 -1.23 0.00 0.00 174.94 174.80 3f0x n GLU 114 N 7.39 2.48 -4.02 2.79 -0.58 0.12 -2.73 120.64 126.10 3f0x n GLU 114 Ca 0.09 -1.91 -0.11 0.00 -0.42 0.00 0.00 57.16 54.82 3f0x n GLU 114 Cb 0.49 -2.77 -0.05 0.00 -0.57 0.00 0.00 31.44 28.54 3f0x n GLU 114 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 3f0x s GLY 115 N 3.41 0.81 -0.28 0.62 0.00 -1.26 -4.65 107.32 105.98 3f0x s GLY 115 Ca 0.52 -1.08 -0.00 0.00 0.00 0.00 0.00 44.72 44.16 3f0x s GLY 115 CO -0.02 -0.74 0.05 0.54 0.00 0.00 0.00 173.10 172.93 3f0x s LYS 116 N -3.68 0.98 0.15 2.90 1.02 -1.26 -1.56 119.74 118.30 3f0x s LYS 116 Ca 0.25 -1.06 0.05 0.00 0.02 0.00 0.00 55.97 55.23 3f0x s LYS 116 Cb -0.00 -2.28 -0.04 0.00 -0.52 0.00 0.00 37.83 34.98 3f0x s LYS 116 CO 0.12 -0.85 0.09 -0.06 -0.92 0.00 0.00 175.35 173.73 3f0x s PHE 117 N 1.52 3.06 0.10 3.18 0.08 -1.26 -5.09 117.98 119.58 3f0x s PHE 117 Ca 0.05 -0.04 -0.31 0.00 0.12 0.00 0.00 56.93 56.75 3f0x s PHE 117 Cb -0.18 -1.49 -0.07 0.00 -0.57 0.00 0.00 43.02 40.71 3f0x s PHE 117 CO -0.17 0.52 1.31 0.50 -0.10 0.00 0.00 175.22 177.28 3f0x s ARG 118 N -2.95 4.37 0.19 0.44 3.52 -1.26 -4.94 118.95 118.32 3f0x s ARG 118 Ca 0.30 1.96 -0.08 0.00 -0.13 0.00 0.00 55.73 57.77 3f0x s ARG 118 Cb -0.10 -3.28 -0.01 0.00 -1.56 0.00 0.00 34.95 30.00 3f0x s ARG 118 CO 0.22 -0.35 0.30 0.20 -0.81 0.00 0.00 175.30 174.85 3f0x s GLY 119 N 1.01 0.67 0.00 8.12 0.00 -1.26 -4.68 107.32 111.18 3f0x s GLY 119 Ca 0.62 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 44.30 3f0x s GLY 119 CO 0.31 -0.90 0.00 2.09 0.00 0.00 0.00 173.10 174.60 3f0x n ASP 120 N -0.26 0.92 -4.32 1.64 3.85 -0.21 -4.97 116.55 113.19 3f0x n ASP 120 Ca -0.04 -0.35 -0.31 0.00 -0.71 0.00 0.00 54.79 53.37 3f0x n ASP 120 Cb 0.63 0.89 -0.16 0.00 -1.35 0.00 0.00 41.12 41.13 3f0x n ASP 120 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 3f0x s THR 121 N -1.07 2.24 0.04 2.12 -4.23 -0.83 -5.03 115.64 108.88 3f0x s THR 121 Ca 0.00 -1.02 0.04 0.00 -1.18 0.00 0.00 61.69 59.53 3f0x s THR 121 Cb 0.00 -1.81 -0.02 0.00 1.34 0.00 0.00 72.50 72.01 3f0x s THR 121 CO 0.00 0.58 -0.12 -0.36 -0.54 0.00 0.00 174.62 174.18 3f0x s PHE 122 N -0.44 1.02 0.20 3.99 0.08 -1.26 -1.32 117.98 120.26 3f0x s PHE 122 Ca 0.05 -0.39 -0.26 0.00 0.12 0.00 0.00 56.93 56.45 3f0x s PHE 122 Cb -0.12 -0.60 -0.08 0.00 -0.57 0.00 0.00 43.02 41.65 3f0x s PHE 122 CO 0.01 0.01 0.83 0.12 -0.10 0.00 0.00 175.22 176.09 3f0x s PHE 123 N -1.00 3.89 0.59 0.36 5.36 0.07 -4.59 117.98 122.66 3f0x s PHE 123 Ca -0.02 1.70 -0.20 0.00 -0.96 0.00 0.00 56.93 57.46 3f0x s PHE 123 Cb -0.08 -2.82 -0.03 0.00 -0.34 0.00 0.00 43.02 39.74 3f0x s PHE 123 CO 0.01 0.46 1.28 -1.25 -1.46 0.00 0.00 175.22 174.26 3f0x s PRO 124 N -1.30 2.92 0.37 10.12 0.04 -1.26 -4.89 135.00 141.01 3f0x s PRO 124 Ca 0.39 2.03 -0.26 0.00 0.04 0.00 0.00 61.00 63.20 3f0x s PRO 124 Cb -0.23 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.17 3f0x s PRO 124 CO 0.27 -1.30 1.00 -2.30 0.04 0.00 0.00 177.00 174.71 3f0x n PRO 125 N -1.47 1.35 -3.65 0.56 -0.02 -1.26 -5.04 135.00 125.47 3f0x n PRO 125 Ca 0.13 0.48 -0.14 0.00 -2.02 0.00 0.00 63.50 61.95 3f0x n PRO 125 Cb 0.48 -1.96 -0.07 0.00 -0.02 0.00 0.00 33.50 31.92 3f0x n PRO 125 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3f0x s TYR 126 N -1.21 -0.35 0.09 6.00 -0.85 -1.26 -5.16 117.35 114.61 3f0x s TYR 126 Ca 0.61 0.49 0.06 0.00 -0.52 0.00 0.00 57.07 57.71 3f0x s TYR 126 Cb -0.60 0.24 -0.04 0.00 0.38 0.00 0.00 41.96 41.93 3f0x s TYR 126 CO 0.58 -0.53 -0.06 0.99 -1.52 0.00 0.00 175.55 175.02 3f0x s THR 127 N -1.75 3.65 -0.50 -3.49 2.01 -1.26 -5.00 115.64 109.31 3f0x s THR 127 Ca -0.10 -1.11 0.23 0.00 0.31 0.00 0.00 61.69 61.03 3f0x s THR 127 Cb -0.02 -2.71 0.25 0.00 0.01 0.00 0.00 72.50 70.03 3f0x s THR 127 CO 0.03 0.14 1.71 0.49 -0.69 0.00 0.00 174.62 176.30 3f0x n PHE 128 N 0.74 0.80 0.83 4.92 3.72 -1.26 -2.20 117.46 125.00 3f0x n PHE 128 Ca -0.13 0.31 0.04 0.00 -0.05 0.00 0.00 57.45 57.62 3f0x n PHE 128 Cb 0.52 -1.00 0.22 0.00 -0.94 0.00 0.00 39.48 38.28 3f0x n PHE 128 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3f0x n GLU 129 N -2.23 0.41 0.00 -1.08 1.02 -1.26 -2.31 120.64 115.20 3f0x n GLU 129 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3f0x n GLU 129 Cb 0.23 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 3f0x n GLU 129 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3f0x n ASP 130 N -0.78 0.11 -3.86 1.62 10.43 -0.93 -4.97 116.55 118.18 3f0x n ASP 130 Ca 0.06 -0.51 -0.18 0.00 2.57 0.00 0.00 54.79 56.72 3f0x n ASP 130 Cb 0.03 0.77 -0.16 0.00 1.84 0.00 0.00 41.12 43.59 3f0x n ASP 130 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 3f0x s TRP 131 N -0.77 0.53 0.16 1.24 0.52 -0.98 -1.28 118.94 118.37 3f0x s TRP 131 Ca 0.00 -0.10 -0.17 0.00 0.02 0.00 0.00 56.10 55.85 3f0x s TRP 131 Cb 0.00 -0.53 -0.07 0.00 -1.15 0.00 0.00 33.47 31.71 3f0x s TRP 131 CO 0.00 -0.16 0.62 -2.00 0.02 0.00 0.00 176.95 175.43 3f0x s GLU 132 N 0.95 4.12 -0.73 4.98 2.12 0.14 -4.76 118.70 125.52 3f0x s GLU 132 Ca -0.11 0.68 -0.24 0.00 0.36 0.00 0.00 54.97 55.66 3f0x s GLU 132 Cb -0.14 -2.96 0.05 0.00 0.26 0.00 0.00 34.13 31.34 3f0x s GLU 132 CO -0.01 0.47 1.14 0.08 -0.54 0.00 0.00 175.26 176.41 3f0x s VAL 133 N -1.43 4.05 0.20 3.70 1.01 -1.26 -1.27 120.40 125.40 3f0x s VAL 133 Ca 0.38 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.18 3f0x s VAL 133 Cb -0.16 -4.82 0.05 0.00 0.00 0.00 0.00 36.38 31.44 3f0x s VAL 133 CO 0.20 -1.67 1.63 0.00 0.00 0.00 0.00 175.10 175.26 3f0x h ALA 134 N 9.75 0.85 -1.82 5.51 0.00 -1.11 -3.46 119.26 128.98 3f0x h ALA 134 Ca -0.23 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3f0x h ALA 134 Cb 1.05 -0.18 -0.21 0.00 0.00 0.00 0.00 17.79 18.46 3f0x h ALA 134 CO 1.24 0.65 0.34 -1.54 0.00 0.00 0.00 179.25 179.94 3f0x s SER 135 N -6.69 -0.53 -0.07 0.00 1.04 -1.12 -4.98 113.70 101.36 3f0x s SER 135 Ca -0.10 0.58 -0.01 0.00 0.48 0.00 0.00 55.95 56.90 3f0x s SER 135 Cb 0.13 0.44 0.03 0.00 0.10 0.00 0.00 66.02 66.72 3f0x s SER 135 CO 0.85 -0.50 -0.00 -0.55 0.98 0.00 0.00 173.24 174.02 3f0x s SER 136 N -1.16 1.44 -0.08 7.02 0.15 -1.26 -1.32 113.70 118.49 3f0x s SER 136 Ca -0.07 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.50 3f0x s SER 136 Cb -0.00 -0.43 0.02 0.00 -1.71 0.00 0.00 66.02 63.90 3f0x s SER 136 CO 0.06 -0.17 -0.07 -0.69 1.20 0.00 0.00 173.24 173.57 3f0x s VAL 137 N 1.80 0.90 0.09 4.45 1.01 -0.34 -4.99 120.40 123.31 3f0x s VAL 137 Ca 0.02 -0.26 -0.31 0.00 0.00 0.00 0.00 61.98 61.43 3f0x s VAL 137 Cb -0.13 -0.90 -0.07 0.00 0.00 0.00 0.00 36.38 35.28 3f0x s VAL 137 CO -0.04 0.33 1.38 -1.61 0.00 0.00 0.00 175.10 175.16 3f0x s GLU 138 N 1.33 4.32 0.64 2.72 2.02 -1.26 -0.57 118.70 127.90 3f0x s GLU 138 Ca -0.03 2.04 -0.16 0.00 0.02 0.00 0.00 54.97 56.84 3f0x s GLU 138 Cb -0.14 -3.32 -0.01 0.00 0.10 0.00 0.00 34.13 30.76 3f0x s GLU 138 CO -0.03 -0.46 1.12 0.20 0.02 0.00 0.00 175.26 176.12 3f0x s GLY 139 N 1.27 2.27 -0.09 -1.39 0.00 0.81 -4.92 107.32 105.26 3f0x s GLY 139 Ca 0.64 0.63 -0.19 0.00 0.00 0.00 0.00 44.72 45.80 3f0x s GLY 139 CO 0.30 0.99 0.53 1.25 0.00 0.00 0.00 173.10 176.17 3f0x s LYS 140 N -3.92 4.34 0.75 2.90 2.20 -1.26 -4.69 119.74 120.06 3f0x s LYS 140 Ca 0.69 0.56 -0.11 0.00 -0.36 0.00 0.00 55.97 56.74 3f0x s LYS 140 Cb -0.22 -3.42 0.04 0.00 -1.51 0.00 0.00 37.83 32.72 3f0x s LYS 140 CO 0.39 0.18 1.09 -0.51 -0.36 0.00 0.00 175.35 176.14 3f0x s LEU 141 N 0.52 3.11 0.18 5.43 1.43 -1.26 -4.81 118.68 123.27 3f0x s LEU 141 Ca 0.29 1.86 -0.24 0.00 -1.03 0.00 0.00 54.13 55.00 3f0x s LEU 141 Cb -0.16 -4.53 0.06 0.00 0.03 0.00 0.00 46.19 41.59 3f0x s LEU 141 CO 0.12 -1.94 0.93 -1.81 0.23 0.00 0.00 176.35 173.89 3f0x s ASP 142 N -3.23 -0.17 0.10 2.29 1.11 0.02 -4.92 116.67 111.87 3f0x s ASP 142 Ca 0.62 -0.46 -0.17 0.00 0.18 0.00 0.00 52.55 52.72 3f0x s ASP 142 Cb -0.18 0.53 -0.06 0.00 1.07 0.00 0.00 42.92 44.27 3f0x s ASP 142 CO 0.53 -0.98 1.54 -0.33 1.18 0.00 0.00 175.17 177.11 3f0x h GLU 143 N 2.00 0.51 0.21 8.23 3.07 -2.00 -3.35 114.58 123.25 3f0x h GLU 143 Ca -0.24 -0.16 -0.31 0.00 -0.50 0.00 0.00 59.36 58.16 3f0x h GLU 143 Cb 1.23 -0.05 0.04 0.00 -0.84 0.00 0.00 28.75 29.13 3f0x h GLU 143 CO 0.26 0.65 -1.34 0.87 -1.40 0.00 0.00 179.01 178.05 3f0x h LYS 144 N 0.30 0.53 -4.01 2.33 6.56 -1.98 -3.42 116.57 116.89 3f0x h LYS 144 Ca 0.08 -0.85 -0.71 0.00 -1.06 0.00 0.00 60.65 58.11 3f0x h LYS 144 Cb 0.41 0.31 -0.33 0.00 -0.57 0.00 0.00 32.23 32.05 3f0x h LYS 144 CO 0.01 1.40 -0.37 -0.80 -2.06 0.00 0.00 179.45 177.64 3f0x s ASN 145 N -7.47 5.51 0.00 0.86 0.01 -1.25 -4.64 114.94 107.96 3f0x s ASN 145 Ca -0.10 -2.41 0.20 0.00 -0.71 0.00 0.00 52.86 49.84 3f0x s ASN 145 Cb 0.04 -1.92 0.34 0.00 0.41 0.00 0.00 41.25 40.12 3f0x s ASN 145 CO 0.93 -0.51 1.29 0.35 -1.51 0.00 0.00 177.10 177.64 3f0x n THR 146 N 4.15 0.45 -4.98 1.60 -2.24 -1.26 -0.80 114.28 111.21 3f0x n THR 146 Ca 0.02 -0.72 -0.32 0.00 -2.27 0.00 0.00 64.05 60.75 3f0x n THR 146 Cb 0.40 1.01 -0.16 0.00 -2.10 0.00 0.00 70.33 69.48 3f0x n THR 146 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3f0x s ILE 147 N -1.38 2.32 0.34 2.28 1.01 -1.26 -4.94 121.20 119.57 3f0x s ILE 147 Ca 0.32 -0.92 -0.29 0.00 0.00 0.00 0.00 60.65 59.77 3f0x s ILE 147 Cb 0.19 -1.92 -0.11 0.00 0.01 0.00 0.00 42.46 40.63 3f0x s ILE 147 CO 0.27 0.55 1.44 -2.84 0.00 0.00 0.00 174.94 174.35 3f0x s PRO 148 N 0.46 4.20 -0.09 2.79 0.02 -1.26 -4.87 135.00 136.25 3f0x s PRO 148 Ca -0.14 2.44 -0.15 0.00 0.02 0.00 0.00 61.00 63.17 3f0x s PRO 148 Cb -0.17 -3.02 0.03 0.00 0.02 0.00 0.00 34.50 31.37 3f0x s PRO 148 CO 0.06 -0.43 0.37 -3.38 -0.33 0.00 0.00 177.00 173.30 3f0x s HIS 149 N -0.94 -0.34 -0.09 6.54 -3.43 -1.26 0.13 115.29 115.90 3f0x s HIS 149 Ca 0.53 0.75 0.01 0.00 -0.80 0.00 0.00 55.06 55.55 3f0x s HIS 149 Cb -0.44 0.14 0.02 0.00 -1.43 0.00 0.00 32.58 30.87 3f0x s HIS 149 CO 0.57 -0.30 -0.11 0.99 -2.00 0.00 0.00 174.74 173.89 3f0x s THR 150 N -0.45 1.15 -0.34 -5.38 2.01 -0.22 -0.14 115.64 112.27 3f0x s THR 150 Ca -0.06 -0.44 -0.29 0.00 0.31 0.00 0.00 61.69 61.22 3f0x s THR 150 Cb -0.04 -1.09 0.01 0.00 0.01 0.00 0.00 72.50 71.40 3f0x s THR 150 CO 0.02 0.37 1.15 -0.36 -0.69 0.00 0.00 174.62 175.11 3f0x s PHE 151 N 1.07 2.97 -0.11 4.92 0.08 0.27 -1.02 117.98 126.16 3f0x s PHE 151 Ca -0.07 1.03 -0.03 0.00 0.12 0.00 0.00 56.93 57.98 3f0x s PHE 151 Cb -0.15 -3.86 -0.03 0.00 -0.57 0.00 0.00 43.02 38.41 3f0x s PHE 151 CO -0.01 -1.11 0.02 -0.51 -0.10 0.00 0.00 175.22 173.51 3f0x s LEU 152 N 3.98 3.66 -0.27 -0.37 1.43 0.17 -1.20 118.68 126.07 3f0x s LEU 152 Ca 0.49 0.14 0.02 0.00 -1.03 0.00 0.00 54.13 53.75 3f0x s LEU 152 Cb -0.13 -1.86 0.06 0.00 0.03 0.00 0.00 46.19 44.29 3f0x s LEU 152 CO 0.20 0.34 -0.08 -2.28 0.23 0.00 0.00 176.35 174.76 3f0x s HIS 153 N -0.62 3.29 -0.11 0.29 5.65 -0.43 -0.69 115.29 122.67 3f0x s HIS 153 Ca 0.10 -2.25 -0.02 0.00 0.25 0.00 0.00 55.06 53.14 3f0x s HIS 153 Cb -0.12 -2.02 -0.03 0.00 -1.18 0.00 0.00 32.58 29.23 3f0x s HIS 153 CO 0.02 -0.87 -0.01 -0.51 -0.65 0.00 0.00 174.74 172.72 3f0x s LEU 154 N 1.13 3.45 -0.03 8.88 2.01 -0.05 -0.43 118.68 133.64 3f0x s LEU 154 Ca -0.07 0.04 0.08 0.00 0.01 0.00 0.00 54.13 54.19 3f0x s LEU 154 Cb -0.20 -1.80 -0.02 0.00 0.01 0.00 0.00 46.19 44.18 3f0x s LEU 154 CO -0.04 0.30 -0.26 -0.63 1.01 0.00 0.00 176.35 176.73 3f0x s ILE 155 N -0.43 2.06 0.28 -0.59 1.01 -0.40 -0.14 121.20 122.99 3f0x s ILE 155 Ca 0.07 -1.10 -0.29 0.00 0.00 0.00 0.00 60.65 59.33 3f0x s ILE 155 Cb -0.12 -1.71 -0.10 0.00 0.01 0.00 0.00 42.46 40.54 3f0x s ILE 155 CO 0.02 0.58 1.39 -0.60 0.00 0.00 0.00 174.94 176.33 3f0x s ARG 156 N -0.55 4.30 0.00 2.79 3.52 -1.13 0.24 118.95 128.12 3f0x s ARG 156 Ca 0.08 2.27 0.09 0.00 -0.13 0.00 0.00 55.73 58.04 3f0x s ARG 156 Cb -0.11 -3.09 0.53 0.00 -1.56 0.00 0.00 34.95 30.72 3f0x s ARG 156 CO -0.00 -0.33 0.98 1.63 -0.81 0.00 0.00 175.30 176.76