#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fi0 s THR 3 N 0.00 5.24 -0.06 -0.18 2.01 -1.26 0.15 115.64 121.55 3fi0 s THR 3 Ca 0.00 0.62 0.04 0.00 0.31 0.00 0.00 61.69 62.66 3fi0 s THR 3 Cb 0.00 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.87 3fi0 s THR 3 CO 0.00 0.47 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.60 3fi0 s ILE 4 N -0.18 1.50 -0.17 1.82 1.01 0.31 -1.64 121.20 123.86 3fi0 s ILE 4 Ca 0.19 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 60.12 3fi0 s ILE 4 Cb -0.14 -1.31 0.00 0.00 0.01 0.00 0.00 42.46 41.02 3fi0 s ILE 4 CO 0.07 0.43 -0.15 0.12 0.00 0.00 0.00 174.94 175.41 3fi0 s PHE 5 N 0.26 2.80 -0.34 3.97 2.19 -1.01 0.20 117.98 126.04 3fi0 s PHE 5 Ca -0.10 -1.14 -0.01 0.00 0.33 0.00 0.00 56.93 56.01 3fi0 s PHE 5 Cb -0.14 -1.91 0.08 0.00 -1.31 0.00 0.00 43.02 39.73 3fi0 s PHE 5 CO 0.04 -0.54 0.07 0.45 1.83 0.00 0.00 175.22 177.07 3fi0 s SER 6 N 0.97 4.98 0.39 6.13 0.15 -0.13 -4.16 113.70 122.02 3fi0 s SER 6 Ca -0.02 -1.67 -0.25 0.00 0.70 0.00 0.00 55.95 54.70 3fi0 s SER 6 Cb -0.15 -1.73 -0.09 0.00 -1.71 0.00 0.00 66.02 62.34 3fi0 s SER 6 CO -0.03 -0.37 1.11 -0.83 1.20 0.00 0.00 173.24 174.32 3fi0 s GLY 7 N 1.39 2.83 -0.20 9.45 0.00 -1.26 -1.58 107.32 117.95 3fi0 s GLY 7 Ca 0.02 0.84 -0.07 0.00 0.00 0.00 0.00 44.72 45.50 3fi0 s GLY 7 CO -0.03 1.32 0.43 -0.42 0.00 0.00 0.00 173.10 174.40 3fi0 s ILE 8 N -1.49 -0.65 0.00 0.90 1.01 -0.47 -4.95 121.20 115.55 3fi0 s ILE 8 Ca 0.56 0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.37 3fi0 s ILE 8 Cb -0.27 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.52 3fi0 s ILE 8 CO 0.34 0.07 0.88 0.00 0.00 0.00 0.00 174.94 176.22 3fi0 n GLN 9 N 5.37 0.00 0.00 2.79 1.13 -1.26 0.07 117.38 125.48 3fi0 n GLN 9 Ca -0.09 0.48 0.00 0.00 -1.94 0.00 0.00 57.00 55.45 3fi0 n GLN 9 Cb 0.50 -1.38 0.00 0.00 0.11 0.00 0.00 30.24 29.47 3fi0 n GLN 9 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3fi0 n THR 15 N -1.82 0.00 0.37 5.09 -2.24 -1.26 -4.92 114.28 109.51 3fi0 n THR 15 Ca 0.00 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.92 3fi0 n THR 15 Cb 0.00 0.00 0.49 0.00 -2.10 0.00 0.00 70.33 68.72 3fi0 n THR 15 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 3fi0 h ILE 16 N 1.67 0.00 -0.47 2.28 3.07 -1.58 -0.58 117.51 121.91 3fi0 h ILE 16 Ca 0.00 -0.48 -0.06 0.00 1.55 0.00 0.00 64.86 65.87 3fi0 h ILE 16 Cb 0.00 1.39 -0.02 0.00 -0.27 0.00 0.00 36.82 37.92 3fi0 h ILE 16 CO 0.00 0.00 0.05 1.23 -1.05 0.00 0.00 178.15 178.38 3fi0 h GLY 17 N 2.85 0.79 1.02 0.16 0.00 -1.93 -1.36 103.07 104.60 3fi0 h GLY 17 Ca 0.00 -0.49 -0.24 0.00 0.00 0.00 0.00 47.33 46.60 3fi0 h GLY 17 CO 0.00 0.45 -1.02 -0.57 0.00 0.00 0.00 176.54 175.41 3fi0 h ASN 18 N 0.70 0.73 -0.65 0.19 -0.73 -1.72 -2.16 115.58 111.94 3fi0 h ASN 18 Ca 0.15 -0.83 0.14 0.00 1.87 0.00 0.00 56.30 57.63 3fi0 h ASN 18 Cb 0.36 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 38.69 3fi0 h ASN 18 CO 0.01 1.48 0.44 0.22 -0.37 0.00 0.00 177.43 179.22 3fi0 h TYR 19 N 0.06 0.31 0.00 0.67 3.20 -1.10 -1.53 116.97 118.58 3fi0 h TYR 19 Ca -0.15 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.72 3fi0 h TYR 19 Cb 1.73 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.90 3fi0 h TYR 19 CO 0.14 0.12 -1.15 -0.89 -1.64 0.00 0.00 178.16 174.74 3fi0 n ILE 20 N -4.44 0.16 0.00 1.81 5.41 -0.52 -2.26 119.36 119.52 3fi0 n ILE 20 Ca 0.12 -0.28 0.00 0.00 1.00 0.00 0.00 62.75 63.59 3fi0 n ILE 20 Cb 0.53 0.21 0.00 0.00 -0.71 0.00 0.00 39.64 39.67 3fi0 n ILE 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3fi0 n GLY 21 N 1.35 -0.36 0.72 7.39 0.00 -0.67 -4.89 105.19 108.74 3fi0 n GLY 21 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 3fi0 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fi0 n ALA 22 N -2.01 2.43 -0.25 4.61 0.00 -0.67 -4.67 120.51 119.95 3fi0 n ALA 22 Ca 0.00 -0.35 -0.06 0.00 0.00 0.00 0.00 53.44 53.03 3fi0 n ALA 22 Cb 0.00 0.39 0.05 0.00 0.00 0.00 0.00 19.45 19.88 3fi0 n ALA 22 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3fi0 h LEU 23 N -0.31 0.91 -0.24 0.00 5.85 -1.64 -2.39 115.31 117.49 3fi0 h LEU 23 Ca -0.22 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.37 3fi0 h LEU 23 Cb 1.20 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.99 3fi0 h LEU 23 CO -0.13 0.78 -0.44 -1.14 -0.34 0.00 0.00 178.44 177.17 3fi0 n ARG 24 N -4.44 0.39 -0.04 1.25 0.63 -0.96 -2.70 116.66 110.78 3fi0 n ARG 24 Ca 0.06 -0.24 0.11 0.00 -0.92 0.00 0.00 57.85 56.86 3fi0 n ARG 24 Cb 0.13 -1.50 0.48 0.00 0.45 0.00 0.00 32.46 32.02 3fi0 n ARG 24 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3fi0 n GLN 25 N -1.10 1.50 -0.00 -0.14 1.13 -0.91 -4.09 117.38 113.78 3fi0 n GLN 25 Ca 0.08 -0.74 0.03 0.00 -1.94 0.00 0.00 57.00 54.43 3fi0 n GLN 25 Cb 0.35 -1.39 -0.05 0.00 0.11 0.00 0.00 30.24 29.26 3fi0 n GLN 25 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 3fi0 n PHE 26 N -0.05 0.00 -0.06 1.08 3.72 -1.10 -3.62 117.46 117.43 3fi0 n PHE 26 Ca 0.17 0.00 0.24 0.00 -0.05 0.00 0.00 57.45 57.81 3fi0 n PHE 26 Cb 0.26 -0.12 0.72 0.00 -0.94 0.00 0.00 39.48 39.39 3fi0 n PHE 26 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3fi0 h VAL 27 N 0.00 0.51 0.00 -4.37 2.07 -1.71 -2.11 116.25 110.65 3fi0 h VAL 27 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3fi0 h VAL 27 Cb 0.27 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3fi0 h VAL 27 CO 0.00 0.00 -1.55 1.21 0.02 0.00 0.00 177.57 177.25 3fi0 n GLU 28 N -4.08 0.58 0.07 1.57 2.13 -1.26 -4.33 120.64 115.32 3fi0 n GLU 28 Ca 0.13 -0.12 0.12 0.00 0.66 0.00 0.00 57.16 57.95 3fi0 n GLU 28 Cb 0.79 -1.31 0.12 0.00 0.27 0.00 0.00 31.44 31.32 3fi0 n GLU 28 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3fi0 h LEU 29 N 0.00 0.00 -0.08 4.31 3.38 -1.58 -3.28 115.31 118.06 3fi0 h LEU 29 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3fi0 h LEU 29 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3fi0 h LEU 29 CO 0.00 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.63 3fi0 n GLN 30 N -2.20 0.02 0.05 1.13 10.64 -0.81 -0.68 117.38 125.53 3fi0 n GLN 30 Ca 0.03 0.29 -0.01 0.00 -1.83 0.00 0.00 57.00 55.47 3fi0 n GLN 30 Cb 0.46 -1.54 -0.07 0.00 -0.86 0.00 0.00 30.24 28.23 3fi0 n GLN 30 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 3fi0 h HIS 31 N 0.00 0.00 0.00 2.61 3.86 -1.82 -3.41 115.15 116.38 3fi0 h HIS 31 Ca 0.00 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.14 3fi0 h HIS 31 Cb 0.24 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.69 3fi0 h HIS 31 CO 0.00 0.66 -1.31 -1.91 0.86 0.00 0.00 177.93 176.23 3fi0 n GLU 32 N -3.04 2.76 -3.84 2.45 4.07 -0.82 -4.98 120.64 117.25 3fi0 n GLU 32 Ca -0.07 -0.01 -0.22 0.00 -0.06 0.00 0.00 57.16 56.80 3fi0 n GLU 32 Cb 0.85 -1.12 -0.04 0.00 -0.06 0.00 0.00 31.44 31.07 3fi0 n GLU 32 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 3fi0 s TYR 33 N -2.15 2.78 -0.35 4.31 1.51 0.14 -4.53 117.35 119.06 3fi0 s TYR 33 Ca -0.02 -0.40 -0.19 0.00 -1.01 0.00 0.00 57.07 55.46 3fi0 s TYR 33 Cb 0.02 -1.87 -0.00 0.00 -0.11 0.00 0.00 41.96 39.99 3fi0 s TYR 33 CO 0.20 0.14 0.54 1.21 -1.11 0.00 0.00 175.55 176.52 3fi0 s ASN 34 N -3.99 6.34 -0.08 2.29 3.04 0.40 -4.56 114.94 118.38 3fi0 s ASN 34 Ca 0.42 -0.00 -0.00 0.00 0.04 0.00 0.00 52.86 53.31 3fi0 s ASN 34 Cb -0.03 -2.28 -0.03 0.00 -1.54 0.00 0.00 41.25 37.37 3fi0 s ASN 34 CO 0.26 -0.51 -0.05 0.00 -3.04 0.00 0.00 177.10 173.76 3fi0 s TYR 36 N -0.70 2.58 -0.44 0.00 2.02 0.13 -1.59 117.35 119.36 3fi0 s TYR 36 Ca 0.11 -0.73 0.03 0.00 -0.37 0.00 0.00 57.07 56.11 3fi0 s TYR 36 Cb -0.11 -1.69 0.13 0.00 -0.40 0.00 0.00 41.96 39.88 3fi0 s TYR 36 CO 0.02 -0.22 0.21 -0.06 -1.57 0.00 0.00 175.55 173.92 3fi0 s PHE 37 N 0.02 2.59 -0.24 2.71 0.40 0.18 -0.95 117.98 122.70 3fi0 s PHE 37 Ca -0.08 -2.69 -0.15 0.00 -0.60 0.00 0.00 56.93 53.41 3fi0 s PHE 37 Cb -0.15 -2.33 -0.04 0.00 0.51 0.00 0.00 43.02 41.02 3fi0 s PHE 37 CO 0.05 -0.80 0.39 0.00 0.70 0.00 0.00 175.22 175.57 3fi0 s ILE 39 N 1.71 4.21 -1.19 0.00 1.01 0.18 -1.36 121.20 125.75 3fi0 s ILE 39 Ca 0.17 -0.38 -0.20 0.00 0.00 0.00 0.00 60.65 60.24 3fi0 s ILE 39 Cb -0.15 -4.78 -0.03 0.00 0.01 0.00 0.00 42.46 37.51 3fi0 s ILE 39 CO 0.09 -1.59 1.89 1.33 0.00 0.00 0.00 174.94 176.66 3fi0 n VAL 40 N 6.04 2.71 0.32 2.92 0.24 0.11 -1.52 118.33 129.15 3fi0 n VAL 40 Ca 0.04 -2.73 0.12 0.00 -2.04 0.00 0.00 64.34 59.74 3fi0 n VAL 40 Cb 0.47 -2.28 0.25 0.00 -1.47 0.00 0.00 33.84 30.81 3fi0 n VAL 40 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 3fi0 h ASP 41 N 8.46 0.00 1.91 -1.34 2.03 -1.92 -3.15 116.42 122.41 3fi0 h ASP 41 Ca 0.35 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.65 3fi0 h ASP 41 Cb 0.86 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.36 3fi0 h ASP 41 CO 1.45 0.00 -0.08 1.56 -1.03 0.00 0.00 179.24 181.14 3fi0 h GLN 42 N 0.00 0.00 0.01 4.15 4.20 -1.95 -3.15 115.11 118.37 3fi0 h GLN 42 Ca 0.00 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.46 3fi0 h GLN 42 Cb 0.91 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.65 3fi0 h GLN 42 CO 0.00 0.00 -1.29 0.45 -0.67 0.00 0.00 178.83 177.32 3fi0 h HIS 43 N 0.00 0.03 0.00 2.96 3.86 -1.95 -3.34 115.15 116.72 3fi0 h HIS 43 Ca 0.00 -0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.16 3fi0 h HIS 43 Cb 1.00 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.46 3fi0 h HIS 43 CO 0.00 1.03 -0.14 0.00 0.86 0.00 0.00 177.93 179.67 3fi0 h ALA 44 N 0.97 1.33 -0.25 2.45 0.00 -1.51 -2.77 119.26 119.49 3fi0 h ALA 44 Ca -0.13 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3fi0 h ALA 44 Cb 1.88 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.64 3fi0 h ALA 44 CO 0.11 0.18 0.00 0.44 0.00 0.00 0.00 179.25 179.98 3fi0 n ILE 45 N -3.74 0.80 1.00 0.00 -5.35 -1.24 -3.13 119.36 107.70 3fi0 n ILE 45 Ca -0.02 -0.48 0.13 0.00 -0.27 0.00 0.00 62.75 62.12 3fi0 n ILE 45 Cb 0.25 -0.18 0.47 0.00 -1.74 0.00 0.00 39.64 38.44 3fi0 n ILE 45 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3fi0 n THR 46 N 0.28 0.00 -4.36 7.28 -2.24 -1.04 -4.77 114.28 109.42 3fi0 n THR 46 Ca 0.10 -0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.70 3fi0 n THR 46 Cb 0.47 -0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 3fi0 n THR 46 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3fi0 s VAL 47 N -3.00 1.42 0.20 2.28 -7.23 -1.18 -4.52 120.40 108.37 3fi0 s VAL 47 Ca 0.13 -2.10 -0.32 0.00 -1.81 0.00 0.00 61.98 57.87 3fi0 s VAL 47 Cb 0.18 -2.28 -0.12 0.00 0.56 0.00 0.00 36.38 34.72 3fi0 s VAL 47 CO 0.60 -0.41 1.70 1.87 -0.31 0.00 0.00 175.10 178.55 3fi0 n TRP 48 N -0.46 2.67 -4.16 2.82 -0.00 -1.26 -4.99 117.44 112.06 3fi0 n TRP 48 Ca -0.06 0.08 -0.18 0.00 -0.00 0.00 0.00 57.50 57.33 3fi0 n TRP 48 Cb 0.63 -2.65 -0.12 0.00 -0.00 0.00 0.00 31.31 29.17 3fi0 n TRP 48 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 3fi0 s GLN 49 N 1.16 0.79 -0.33 5.87 -1.52 -1.26 -5.02 119.66 119.34 3fi0 s GLN 49 Ca 0.76 -0.94 -0.13 0.00 -1.95 0.00 0.00 55.36 53.10 3fi0 s GLN 49 Cb -0.54 -0.78 -0.02 0.00 -0.22 0.00 0.00 33.01 31.46 3fi0 s GLN 49 CO 0.33 0.17 0.26 0.34 -0.25 0.00 0.00 175.29 176.14 3fi0 s ASP 50 N -1.73 6.08 0.19 5.90 3.68 -1.26 -4.98 116.67 124.54 3fi0 s ASP 50 Ca -0.03 -0.33 -0.24 0.00 2.13 0.00 0.00 52.55 54.09 3fi0 s ASP 50 Cb -0.10 -2.15 0.09 0.00 -1.45 0.00 0.00 42.92 39.31 3fi0 s ASP 50 CO 0.02 -0.23 1.56 -0.65 0.13 0.00 0.00 175.17 176.00 3fi0 h PRO 51 N 8.47 -0.11 -0.26 4.34 0.11 -1.99 0.25 132.00 142.81 3fi0 h PRO 51 Ca -0.31 0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.86 3fi0 h PRO 51 Cb 1.16 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 3fi0 h PRO 51 CO 0.63 -0.07 -0.17 1.25 -0.21 0.00 0.00 178.00 179.42 3fi0 h HIS 52 N -0.12 -0.44 -0.66 0.65 2.76 -1.98 0.14 115.15 115.50 3fi0 h HIS 52 Ca 0.23 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.39 3fi0 h HIS 52 Cb 0.55 0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.71 3fi0 h HIS 52 CO -0.81 -0.25 0.24 0.93 -1.30 0.00 0.00 177.93 176.74 3fi0 h GLU 53 N -0.16 0.98 -0.09 5.26 5.08 -1.71 -2.02 114.58 121.92 3fi0 h GLU 53 Ca 0.14 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3fi0 h GLU 53 Cb 0.37 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3fi0 h GLU 53 CO -0.35 0.82 0.01 1.25 -1.00 0.00 0.00 179.01 179.74 3fi0 h LEU 54 N 0.96 0.14 -1.70 1.33 5.85 0.30 -0.02 115.31 122.18 3fi0 h LEU 54 Ca 0.22 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3fi0 h LEU 54 Cb 0.23 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3fi0 h LEU 54 CO -0.01 0.36 0.00 -0.09 -0.34 0.00 0.00 178.44 178.36 3fi0 h ARG 55 N -0.09 0.00 0.00 1.25 9.65 -0.55 -1.84 114.38 122.81 3fi0 h ARG 55 Ca 0.03 0.00 -0.32 0.00 -1.10 0.00 0.00 59.98 58.59 3fi0 h ARG 55 Cb 0.28 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 28.81 3fi0 h ARG 55 CO 0.00 0.00 -2.05 0.94 2.80 0.00 0.00 179.97 181.66 3fi0 n GLN 56 N -2.60 0.66 0.14 0.20 -0.06 -0.78 -4.04 117.38 110.90 3fi0 n GLN 56 Ca -0.01 0.12 0.01 0.00 -2.00 0.00 0.00 57.00 55.12 3fi0 n GLN 56 Cb 0.13 -1.65 0.10 0.00 -4.06 0.00 0.00 30.24 24.76 3fi0 n GLN 56 CO 0.00 0.00 0.00 -0.91 -0.20 0.00 0.00 177.06 175.95 3fi0 h ASN 57 N 0.00 0.00 -0.15 1.69 2.35 -0.30 -1.86 115.58 117.30 3fi0 h ASN 57 Ca -0.40 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.18 3fi0 h ASN 57 Cb 2.08 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.44 3fi0 h ASN 57 CO 0.05 0.58 -0.49 0.40 -1.65 0.00 0.00 177.43 176.31 3fi0 h ILE 58 N 0.00 1.29 0.43 2.81 2.04 -1.54 -2.63 117.51 119.91 3fi0 h ILE 58 Ca -0.01 -1.70 -0.02 0.00 1.00 0.00 0.00 64.86 64.14 3fi0 h ILE 58 Cb 1.29 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.99 3fi0 h ILE 58 CO 0.07 0.54 -0.21 0.03 0.00 0.00 0.00 178.15 178.59 3fi0 h ARG 59 N 0.57 -0.55 -0.97 2.37 3.08 -1.68 -2.58 114.38 114.62 3fi0 h ARG 59 Ca 0.03 0.04 0.30 0.00 0.07 0.00 0.00 59.98 60.41 3fi0 h ARG 59 Cb 1.06 0.13 -0.17 0.00 0.08 0.00 0.00 29.97 31.06 3fi0 h ARG 59 CO 0.10 -0.37 0.22 0.00 -1.07 0.00 0.00 179.97 178.86 3fi0 h ARG 60 N -0.93 0.06 0.30 0.04 3.08 -1.44 -0.83 114.38 114.66 3fi0 h ARG 60 Ca -0.06 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3fi0 h ARG 60 Cb 0.44 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.48 3fi0 h ARG 60 CO 0.10 0.04 -0.14 1.25 -1.07 0.00 0.00 179.97 180.14 3fi0 h LEU 61 N 0.06 -0.34 -0.28 3.04 5.85 -1.49 -1.68 115.31 120.47 3fi0 h LEU 61 Ca 0.66 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 59.32 3fi0 h LEU 61 Cb 1.47 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.55 3fi0 h LEU 61 CO -0.81 -0.11 0.02 0.00 -0.34 0.00 0.00 178.44 177.21 3fi0 h ALA 62 N 0.07 0.27 -0.76 1.25 0.00 -0.77 -1.23 119.26 118.09 3fi0 h ALA 62 Ca -0.04 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.06 3fi0 h ALA 62 Cb 0.42 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3fi0 h ALA 62 CO 0.07 -0.39 0.50 0.00 0.00 0.00 0.00 179.25 179.43 3fi0 h ALA 63 N 1.23 1.96 -0.04 0.00 0.00 -1.23 -0.68 119.26 120.50 3fi0 h ALA 63 Ca 0.13 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 3fi0 h ALA 63 Cb 0.16 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3fi0 h ALA 63 CO -0.21 -0.15 -0.76 -0.07 0.00 0.00 0.00 179.25 178.06 3fi0 h LEU 64 N 0.54 0.35 -0.38 0.00 3.38 -0.35 -0.59 115.31 118.27 3fi0 h LEU 64 Ca 0.36 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 3fi0 h LEU 64 Cb 0.67 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 3fi0 h LEU 64 CO -0.13 0.98 -0.18 1.88 0.09 0.00 0.00 178.44 181.09 3fi0 h TYR 65 N 0.19 0.90 -0.02 1.13 -1.99 -0.05 -1.97 116.97 115.16 3fi0 h TYR 65 Ca -0.03 -0.22 -0.01 0.00 2.00 0.00 0.00 58.73 60.47 3fi0 h TYR 65 Cb 1.34 -0.21 -0.00 0.00 2.00 0.00 0.00 36.73 39.86 3fi0 h TYR 65 CO 0.03 0.97 -0.01 -0.07 -0.00 0.00 0.00 178.16 179.08 3fi0 h LEU 66 N 0.58 0.04 -1.80 3.88 3.38 -1.26 -1.74 115.31 118.40 3fi0 h LEU 66 Ca 0.08 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3fi0 h LEU 66 Cb 0.73 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3fi0 h LEU 66 CO 0.05 0.48 0.07 0.00 0.09 0.00 0.00 178.44 179.14 3fi0 h ALA 67 N 0.56 1.06 0.00 1.53 0.00 -1.10 -0.43 119.26 120.88 3fi0 h ALA 67 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 3fi0 h ALA 67 Cb 0.46 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3fi0 h ALA 67 CO 0.00 -0.06 -1.28 0.28 0.00 0.00 0.00 179.25 178.19 3fi0 h VAL 68 N 0.00 0.72 0.00 0.00 2.07 -1.18 -3.41 116.25 114.45 3fi0 h VAL 68 Ca 0.00 -2.28 0.00 0.00 0.82 0.00 0.00 66.70 65.24 3fi0 h VAL 68 Cb 0.15 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.15 3fi0 h VAL 68 CO 0.00 0.41 0.00 0.61 0.02 0.00 0.00 177.57 178.61 3fi0 n GLY 69 N 1.39 -0.60 3.71 2.17 0.00 -0.17 -4.96 105.19 106.72 3fi0 n GLY 69 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 3fi0 n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fi0 s ILE 70 N -0.32 2.36 -0.52 -0.61 1.09 -0.67 -4.84 121.20 117.69 3fi0 s ILE 70 Ca 0.00 0.18 -0.17 0.00 -1.10 0.00 0.00 60.65 59.55 3fi0 s ILE 70 Cb 0.00 -3.11 0.09 0.00 -1.06 0.00 0.00 42.46 38.37 3fi0 s ILE 70 CO 0.00 0.01 0.55 -0.62 -0.10 0.00 0.00 174.94 174.78 3fi0 s ASP 71 N 1.55 6.18 0.43 3.58 -1.08 -1.26 -4.56 116.67 121.51 3fi0 s ASP 71 Ca 0.75 -1.34 0.20 0.00 -0.52 0.00 0.00 52.55 51.64 3fi0 s ASP 71 Cb -0.47 -2.24 1.15 0.00 -1.46 0.00 0.00 42.92 39.90 3fi0 s ASP 71 CO 0.33 -0.86 1.82 -0.65 0.52 0.00 0.00 175.17 176.33 3fi0 h PRO 72 N 8.94 0.34 -0.02 4.34 0.11 -1.92 2.55 132.00 146.34 3fi0 h PRO 72 Ca -0.29 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 65.58 3fi0 h PRO 72 Cb 1.10 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3fi0 h PRO 72 CO 0.99 0.22 -0.90 1.79 -0.21 0.00 0.00 178.00 179.89 3fi0 h THR 73 N 0.35 1.39 0.00 -1.15 1.35 -1.99 -3.33 112.91 109.53 3fi0 h THR 73 Ca 0.52 -2.38 -0.15 0.00 -0.55 0.00 0.00 66.41 63.85 3fi0 h THR 73 Cb 1.40 2.35 -0.03 0.00 -1.73 0.00 0.00 68.15 70.14 3fi0 h THR 73 CO -0.20 0.71 -1.47 1.67 -0.25 0.00 0.00 175.52 175.98 3fi0 n GLN 74 N -3.77 0.63 -4.21 4.72 -0.06 0.69 -4.98 117.38 110.39 3fi0 n GLN 74 Ca -0.06 0.17 -0.12 0.00 -2.00 0.00 0.00 57.00 54.98 3fi0 n GLN 74 Cb 0.81 -1.77 -0.10 0.00 -4.06 0.00 0.00 30.24 25.12 3fi0 n GLN 74 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 3fi0 s ALA 75 N -2.99 1.22 -0.31 1.69 0.00 0.83 -4.62 121.76 117.57 3fi0 s ALA 75 Ca -0.03 -1.48 -0.10 0.00 0.00 0.00 0.00 51.96 50.34 3fi0 s ALA 75 Cb 0.09 0.33 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 3fi0 s ALA 75 CO 0.82 -0.26 0.17 0.99 0.00 0.00 0.00 175.76 177.48 3fi0 s THR 76 N -3.60 4.78 -0.18 0.00 2.01 -0.62 -4.21 115.64 113.82 3fi0 s THR 76 Ca 0.18 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 61.85 3fi0 s THR 76 Cb 0.05 -3.43 0.01 0.00 0.01 0.00 0.00 72.50 69.15 3fi0 s THR 76 CO 0.00 0.07 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.60 3fi0 s LEU 77 N 1.65 2.27 0.22 4.42 2.96 -1.26 0.49 118.68 129.42 3fi0 s LEU 77 Ca 0.05 -0.60 -0.13 0.00 -0.22 0.00 0.00 54.13 53.23 3fi0 s LEU 77 Cb -0.17 -1.52 0.00 0.00 0.50 0.00 0.00 46.19 45.00 3fi0 s LEU 77 CO 0.07 0.01 0.46 0.72 -1.32 0.00 0.00 176.35 176.29 3fi0 s PHE 78 N 1.26 0.27 -0.24 5.38 -0.71 -0.44 -4.31 117.98 119.20 3fi0 s PHE 78 Ca 0.04 -0.63 -0.15 0.00 -1.04 0.00 0.00 56.93 55.15 3fi0 s PHE 78 Cb -0.13 0.20 -0.04 0.00 -1.21 0.00 0.00 43.02 41.84 3fi0 s PHE 78 CO -0.10 -0.94 0.37 0.42 -1.34 0.00 0.00 175.22 173.63 3fi0 s ILE 79 N -3.98 5.20 0.28 -4.49 1.01 -1.26 0.47 121.20 118.43 3fi0 s ILE 79 Ca 0.19 0.62 0.01 0.00 0.00 0.00 0.00 60.65 61.47 3fi0 s ILE 79 Cb -0.00 -3.70 0.27 0.00 0.01 0.00 0.00 42.46 39.04 3fi0 s ILE 79 CO 0.05 0.21 1.79 -0.61 0.00 0.00 0.00 174.94 176.39 3fi0 h GLN 80 N 7.74 0.77 0.00 2.79 4.15 -1.61 -1.17 115.11 127.77 3fi0 h GLN 80 Ca -0.34 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.03 3fi0 h GLN 80 Cb 1.16 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.68 3fi0 h GLN 80 CO 0.68 0.51 0.00 0.66 -1.93 0.00 0.00 178.83 178.75 3fi0 h SER 81 N 0.80 0.00 0.57 -0.69 4.64 -1.94 -1.04 113.55 115.88 3fi0 h SER 81 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 3fi0 h SER 81 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3fi0 h SER 81 CO -0.33 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.01 3fi0 n GLU 82 N -2.94 0.43 -3.99 4.77 1.02 -0.44 -4.35 120.64 115.12 3fi0 n GLU 82 Ca -0.01 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.82 3fi0 n GLU 82 Cb 0.17 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 29.95 3fi0 n GLU 82 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3fi0 s VAL 83 N -2.57 2.39 -0.97 2.62 1.01 -0.40 -4.93 120.40 117.55 3fi0 s VAL 83 Ca 0.29 -2.48 0.08 0.00 0.00 0.00 0.00 61.98 59.87 3fi0 s VAL 83 Cb 0.20 -2.74 0.07 0.00 0.00 0.00 0.00 36.38 33.91 3fi0 s VAL 83 CO 0.46 -0.64 1.26 -2.65 0.00 0.00 0.00 175.10 173.54 3fi0 n PRO 84 N 4.10 0.01 0.27 2.72 -0.02 -1.26 -2.61 135.00 138.21 3fi0 n PRO 84 Ca 0.04 0.38 0.16 0.00 -2.02 0.00 0.00 63.50 62.05 3fi0 n PRO 84 Cb 0.41 -1.52 0.64 0.00 -0.02 0.00 0.00 33.50 33.01 3fi0 n PRO 84 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fi0 h ALA 85 N 2.25 1.02 -0.24 3.55 0.00 -1.91 -2.56 119.26 121.37 3fi0 h ALA 85 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 3fi0 h ALA 85 Cb 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3fi0 h ALA 85 CO 0.00 0.07 -0.28 0.45 0.00 0.00 0.00 179.25 179.48 3fi0 h HIS 86 N 0.00 0.75 -0.37 0.00 3.86 -1.81 -0.00 115.15 117.57 3fi0 h HIS 86 Ca -0.00 -0.23 -0.15 0.00 -1.16 0.00 0.00 60.37 58.82 3fi0 h HIS 86 Cb 0.55 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 3fi0 h HIS 86 CO 0.00 0.96 -0.36 0.00 0.86 0.00 0.00 177.93 179.39 3fi0 h ALA 87 N 0.66 0.54 0.20 2.45 0.00 -1.73 -0.27 119.26 121.10 3fi0 h ALA 87 Ca 0.03 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3fi0 h ALA 87 Cb 0.85 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3fi0 h ALA 87 CO 0.07 0.62 -0.09 1.96 0.00 0.00 0.00 179.25 181.80 3fi0 h GLN 88 N 0.70 -0.26 -0.90 0.00 4.20 -1.48 -2.65 115.11 114.73 3fi0 h GLN 88 Ca 0.06 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 3fi0 h GLN 88 Cb 0.95 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.74 3fi0 h GLN 88 CO 0.09 0.02 0.56 0.00 -0.67 0.00 0.00 178.83 178.83 3fi0 h ALA 89 N 0.21 1.29 -0.06 3.87 0.00 -1.03 -2.57 119.26 120.96 3fi0 h ALA 89 Ca -0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3fi0 h ALA 89 Cb 0.40 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3fi0 h ALA 89 CO 0.04 0.62 -0.10 0.00 0.00 0.00 0.00 179.25 179.82 3fi0 h ALA 90 N 1.38 1.73 0.00 0.00 0.00 -0.99 -2.05 119.26 119.33 3fi0 h ALA 90 Ca 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3fi0 h ALA 90 Cb -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3fi0 h ALA 90 CO -0.06 0.21 0.00 1.87 0.00 0.00 0.00 179.25 181.26 3fi0 n TRP 91 N -4.37 0.00 0.00 0.00 -0.00 -0.97 -2.06 117.44 110.04 3fi0 n TRP 91 Ca -0.02 -0.21 0.00 0.00 -0.00 0.00 0.00 57.50 57.27 3fi0 n TRP 91 Cb 0.20 -0.15 0.00 0.00 -0.00 0.00 0.00 31.31 31.36 3fi0 n TRP 91 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 3fi0 n LEU 93 N 0.45 0.00 0.01 5.87 4.77 -0.77 -2.26 117.00 125.06 3fi0 n LEU 93 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 3fi0 n LEU 93 Cb 0.28 0.00 0.50 0.00 -2.33 0.00 0.00 43.42 41.87 3fi0 n LEU 93 CO 0.00 0.00 0.81 1.67 -1.33 0.00 0.00 177.39 178.54 3fi0 n GLN 94 N 0.00 0.02 0.07 3.23 7.27 -0.87 -1.67 117.38 125.42 3fi0 n GLN 94 Ca 0.00 0.01 -0.01 0.00 0.07 0.00 0.00 57.00 57.07 3fi0 n GLN 94 Cb 0.00 -1.52 -0.05 0.00 2.41 0.00 0.00 30.24 31.08 3fi0 n GLN 94 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3fi0 n ILE 96 N -3.08 0.53 -1.95 0.00 -5.35 -1.11 -4.95 119.36 103.44 3fi0 n ILE 96 Ca -0.05 -0.57 -0.32 0.00 -0.27 0.00 0.00 62.75 61.55 3fi0 n ILE 96 Cb 0.83 -0.28 0.02 0.00 -1.74 0.00 0.00 39.64 38.46 3fi0 n ILE 96 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3fi0 s VAL 97 N -3.32 4.06 0.18 7.28 0.11 -0.67 -5.07 120.40 122.97 3fi0 s VAL 97 Ca -0.04 0.86 0.04 0.00 -2.93 0.00 0.00 61.98 59.91 3fi0 s VAL 97 Cb 0.11 -3.48 -0.03 0.00 -1.53 0.00 0.00 36.38 31.45 3fi0 s VAL 97 CO 0.84 -0.69 0.26 -0.31 -3.33 0.00 0.00 175.10 171.87 3fi0 s TYR 98 N -2.71 3.39 0.06 1.54 2.02 -1.26 -4.96 117.35 115.42 3fi0 s TYR 98 Ca 0.61 0.05 -0.18 0.00 -0.37 0.00 0.00 57.07 57.17 3fi0 s TYR 98 Cb -0.14 -1.60 -0.13 0.00 -0.40 0.00 0.00 41.96 39.69 3fi0 s TYR 98 CO 0.43 0.50 1.34 0.82 -1.57 0.00 0.00 175.55 177.07 3fi0 h ILE 99 N 1.61 1.34 -0.93 2.71 1.08 -1.97 -2.84 117.51 118.51 3fi0 h ILE 99 Ca -0.49 -1.46 0.11 0.00 -0.39 0.00 0.00 64.86 62.63 3fi0 h ILE 99 Cb 1.21 1.86 -0.07 0.00 -3.07 0.00 0.00 36.82 36.74 3fi0 h ILE 99 CO 0.65 0.44 0.60 1.23 -0.69 0.00 0.00 178.15 180.38 3fi0 h GLY 100 N 0.15 1.39 1.01 5.37 0.00 -1.97 0.48 103.07 109.48 3fi0 h GLY 100 Ca 0.02 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 46.94 3fi0 h GLY 100 CO 0.06 0.17 0.24 0.83 0.00 0.00 0.00 176.54 177.83 3fi0 h GLU 101 N 0.88 0.97 -0.14 4.80 5.08 -1.95 -1.87 114.58 122.36 3fi0 h GLU 101 Ca 0.45 -0.19 -0.18 0.00 -1.00 0.00 0.00 59.36 58.44 3fi0 h GLU 101 Cb 0.50 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.61 3fi0 h GLU 101 CO -0.21 0.83 -0.63 -0.07 -1.00 0.00 0.00 179.01 177.93 3fi0 h LEU 102 N 0.91 0.79 -2.01 1.33 3.38 -0.92 -3.23 115.31 115.56 3fi0 h LEU 102 Ca 0.21 -0.63 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 3fi0 h LEU 102 Cb 0.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3fi0 h LEU 102 CO -0.01 1.29 -0.03 -0.33 0.09 0.00 0.00 178.44 179.44 3fi0 h GLU 103 N 0.34 0.00 -4.07 1.13 5.08 0.02 -3.46 114.58 113.62 3fi0 h GLU 103 Ca -0.04 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.57 3fi0 h GLU 103 Cb 1.26 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 30.24 3fi0 h GLU 103 CO 0.13 0.03 -0.23 -0.98 -1.00 0.00 0.00 179.01 176.96 3fi0 s ARG 104 N -4.93 2.90 -0.08 2.33 1.70 -0.71 -5.01 118.95 115.14 3fi0 s ARG 104 Ca -0.05 -1.95 0.06 0.00 -0.47 0.00 0.00 55.73 53.32 3fi0 s ARG 104 Cb 0.16 -4.15 -0.09 0.00 -0.57 0.00 0.00 34.95 30.31 3fi0 s ARG 104 CO 0.66 -1.26 0.00 2.41 -1.08 0.00 0.00 175.30 176.03 3fi0 n THR 106 N 4.73 0.55 0.00 4.99 -1.04 -1.26 -5.07 114.28 117.18 3fi0 n THR 106 Ca -0.05 -0.31 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 3fi0 n THR 106 Cb 0.41 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 3fi0 n THR 106 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3fi0 n GLN 107 N -2.40 0.00 0.00 -2.82 3.00 -1.26 -5.28 117.38 108.63 3fi0 n GLN 107 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 3fi0 n GLN 107 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.98 3fi0 n GLN 107 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 3fi0 n VAL 118 N 0.00 0.00 -1.45 5.09 0.31 -1.26 -5.19 118.33 115.82 3fi0 n VAL 118 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.93 3fi0 n VAL 118 Cb 0.00 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 32.95 3fi0 n VAL 118 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3fi0 n SER 119 N 0.00 -0.98 0.13 4.52 3.41 -1.26 -4.90 113.62 114.54 3fi0 n SER 119 Ca 0.00 0.84 -0.01 0.00 -0.26 0.00 0.00 58.87 59.44 3fi0 n SER 119 Cb 0.00 -1.13 0.11 0.00 -0.26 0.00 0.00 64.21 62.93 3fi0 n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fi0 h ALA 120 N 0.60 0.77 0.00 7.33 0.00 -2.02 -3.14 119.26 122.81 3fi0 h ALA 120 Ca -0.42 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 53.89 3fi0 h ALA 120 Cb 1.40 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 3fi0 h ALA 120 CO 0.50 0.81 -0.01 0.78 0.00 0.00 0.00 179.25 181.33 3fi0 h GLY 121 N 2.42 0.00 1.53 0.00 0.00 -1.90 0.83 103.07 105.96 3fi0 h GLY 121 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3fi0 h GLY 121 CO 0.08 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.66 3fi0 n LEU 122 N -3.19 0.00 -0.03 3.11 4.32 -1.19 -2.94 117.00 117.08 3fi0 n LEU 122 Ca -0.02 0.27 -0.04 0.00 -0.02 0.00 0.00 56.01 56.20 3fi0 n LEU 122 Cb 0.12 -0.27 -0.05 0.00 -1.62 0.00 0.00 43.42 41.60 3fi0 n LEU 122 CO 0.22 -0.01 -0.72 -0.11 -1.22 0.00 0.00 177.39 175.55 3fi0 n LEU 123 N -1.27 0.80 -0.96 2.23 7.94 0.22 -4.78 117.00 121.19 3fi0 n LEU 123 Ca 0.14 -0.01 0.08 0.00 -1.11 0.00 0.00 56.01 55.11 3fi0 n LEU 123 Cb 0.22 0.04 0.24 0.00 0.53 0.00 0.00 43.42 44.45 3fi0 n LEU 123 CO 0.22 0.28 0.71 0.35 -1.11 0.00 0.00 177.39 177.84 3fi0 n THR 124 N -2.37 1.75 0.29 1.96 -2.24 -0.80 -4.50 114.28 108.37 3fi0 n THR 124 Ca -0.11 -1.42 0.13 0.00 -2.27 0.00 0.00 64.05 60.38 3fi0 n THR 124 Cb 0.69 0.09 0.28 0.00 -2.10 0.00 0.00 70.33 69.30 3fi0 n THR 124 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3fi0 h TYR 125 N 2.37 0.00 -0.79 4.78 -0.00 -1.81 -3.33 116.97 118.20 3fi0 h TYR 125 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 58.73 58.82 3fi0 h TYR 125 Cb 1.20 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.88 3fi0 h TYR 125 CO 0.47 0.00 0.52 -1.35 -0.00 0.00 0.00 178.16 177.79 3fi0 h PRO 126 N 0.00 0.71 -0.01 0.10 0.11 -1.89 -1.37 132.00 129.64 3fi0 h PRO 126 Ca 0.00 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 65.91 3fi0 h PRO 126 Cb 0.88 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.81 3fi0 h PRO 126 CO 0.00 0.47 -0.73 -1.35 -0.21 0.00 0.00 178.00 176.18 3fi0 h PRO 127 N 0.73 0.09 -1.10 1.05 0.11 -1.91 -0.70 132.00 130.28 3fi0 h PRO 127 Ca 0.36 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 66.39 3fi0 h PRO 127 Cb 0.44 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.57 3fi0 h PRO 127 CO -0.14 0.78 0.00 -0.11 -0.21 0.00 0.00 178.00 178.32 3fi0 n LEU 128 N -3.72 0.51 0.00 2.35 7.94 -0.52 -0.52 117.00 123.03 3fi0 n LEU 128 Ca -0.02 -0.25 0.00 0.00 -1.11 0.00 0.00 56.01 54.63 3fi0 n LEU 128 Cb 0.71 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.54 3fi0 n LEU 128 CO 0.45 0.09 0.00 0.00 -1.11 0.00 0.00 177.39 176.82 3fi0 n ALA 130 N 0.66 0.00 -0.19 1.96 0.00 -0.27 -1.57 120.51 121.09 3fi0 n ALA 130 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 3fi0 n ALA 130 Cb 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.48 3fi0 n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fi0 h ALA 131 N 0.00 -0.49 -0.79 0.00 0.00 -1.08 0.46 119.26 117.35 3fi0 h ALA 131 Ca 0.00 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.10 3fi0 h ALA 131 Cb 0.00 1.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.70 3fi0 h ALA 131 CO 0.00 -0.91 -0.32 -0.25 0.00 0.00 0.00 179.25 177.77 3fi0 n ASP 132 N -5.39 -0.53 0.11 0.00 8.00 -0.61 -0.25 116.55 117.88 3fi0 n ASP 132 Ca -0.00 1.38 -0.05 0.00 0.71 0.00 0.00 54.79 56.83 3fi0 n ASP 132 Cb 0.34 -0.31 -0.02 0.00 -0.02 0.00 0.00 41.12 41.11 3fi0 n ASP 132 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3fi0 h ILE 133 N 0.00 0.00 -1.02 0.53 2.04 -1.14 -3.35 117.51 114.57 3fi0 h ILE 133 Ca 0.27 -0.28 0.25 0.00 1.00 0.00 0.00 64.86 66.09 3fi0 h ILE 133 Cb 0.46 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.44 3fi0 h ILE 133 CO -0.78 0.00 0.63 -0.07 0.00 0.00 0.00 178.15 177.93 3fi0 h LEU 134 N -0.60 0.59 -1.26 1.44 3.38 0.26 -2.44 115.31 116.68 3fi0 h LEU 134 Ca -0.03 0.11 0.30 0.00 0.09 0.00 0.00 57.88 58.35 3fi0 h LEU 134 Cb 0.25 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.90 3fi0 h LEU 134 CO 0.05 0.12 0.68 -0.07 0.09 0.00 0.00 178.44 179.31 3fi0 h LEU 135 N 0.52 0.46 -3.07 1.67 3.38 -0.75 -1.04 115.31 116.48 3fi0 h LEU 135 Ca 0.61 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.70 3fi0 h LEU 135 Cb 1.31 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.11 3fi0 h LEU 135 CO -0.39 0.01 0.00 -1.22 0.09 0.00 0.00 178.44 176.93 3fi0 n TYR 136 N -4.74 1.35 -3.80 1.13 4.01 -0.92 -4.57 117.16 109.62 3fi0 n TYR 136 Ca 0.29 -0.60 -0.30 0.00 -0.16 0.00 0.00 57.90 57.13 3fi0 n TYR 136 Cb 0.97 -0.20 0.02 0.00 -0.31 0.00 0.00 39.34 39.82 3fi0 n TYR 136 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3fi0 n ASN 137 N 1.13 -3.46 -4.83 7.72 5.03 -0.39 -4.91 115.26 115.55 3fi0 n ASN 137 Ca 0.25 -1.03 -0.35 0.00 0.87 0.00 0.00 54.58 54.32 3fi0 n ASN 137 Cb 0.83 -3.18 -0.06 0.00 -1.02 0.00 0.00 39.78 36.35 3fi0 n ASN 137 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 3fi0 s THR 138 N -3.64 4.67 -0.23 3.41 -4.23 -1.25 -4.76 115.64 109.61 3fi0 s THR 138 Ca 0.31 1.09 0.04 0.00 -1.18 0.00 0.00 61.69 61.95 3fi0 s THR 138 Cb -0.12 -3.78 -0.19 0.00 1.34 0.00 0.00 72.50 69.75 3fi0 s THR 138 CO 0.88 0.15 -0.10 0.47 -0.54 0.00 0.00 174.62 175.48 3fi0 n ASP 139 N 0.55 1.65 -4.17 3.99 8.00 -0.65 -4.15 116.55 121.76 3fi0 n ASP 139 Ca -0.02 -0.07 -0.27 0.00 0.71 0.00 0.00 54.79 55.14 3fi0 n ASP 139 Cb 0.52 -0.22 -0.16 0.00 -0.02 0.00 0.00 41.12 41.24 3fi0 n ASP 139 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fi0 s ILE 140 N -2.52 1.55 -0.18 0.53 1.09 -0.93 -0.61 121.20 120.13 3fi0 s ILE 140 Ca -0.29 -0.79 -0.00 0.00 -1.10 0.00 0.00 60.65 58.47 3fi0 s ILE 140 Cb 0.08 -1.32 0.04 0.00 -1.06 0.00 0.00 42.46 40.21 3fi0 s ILE 140 CO 0.66 0.44 -0.06 -0.69 -0.10 0.00 0.00 174.94 175.19 3fi0 s VAL 141 N -0.09 1.25 -1.13 2.92 1.01 0.71 -2.40 120.40 122.67 3fi0 s VAL 141 Ca -0.02 -0.78 -0.21 0.00 0.00 0.00 0.00 61.98 60.97 3fi0 s VAL 141 Cb -0.11 -1.43 0.04 0.00 0.00 0.00 0.00 36.38 34.87 3fi0 s VAL 141 CO 0.02 0.10 1.65 -2.16 0.00 0.00 0.00 175.10 174.71 3fi0 s PRO 142 N 1.56 3.54 0.03 2.72 0.04 -1.17 -2.12 135.00 139.61 3fi0 s PRO 142 Ca -0.01 -1.38 0.06 0.00 0.04 0.00 0.00 61.00 59.71 3fi0 s PRO 142 Cb -0.16 -5.39 -0.02 0.00 0.04 0.00 0.00 34.50 28.97 3fi0 s PRO 142 CO -0.08 -2.50 -0.16 0.14 0.04 0.00 0.00 177.00 174.44 3fi0 s VAL 143 N 5.74 1.29 0.00 -0.36 -7.23 -1.23 -4.97 120.40 113.64 3fi0 s VAL 143 Ca 0.53 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.71 3fi0 s VAL 143 Cb 0.01 -1.13 0.00 0.00 0.56 0.00 0.00 36.38 35.81 3fi0 s VAL 143 CO -0.00 0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.52 3fi0 n GLY 144 N 2.03 -2.93 0.07 2.32 0.00 -1.26 -4.51 105.19 100.90 3fi0 n GLY 144 Ca -0.17 -0.99 0.11 0.00 0.00 0.00 0.00 46.02 44.97 3fi0 n GLY 144 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fi0 n GLU 145 N 0.00 0.59 0.26 1.61 -0.58 -1.26 -3.87 120.64 117.39 3fi0 n GLU 145 Ca 0.00 -0.01 0.11 0.00 -0.42 0.00 0.00 57.16 56.84 3fi0 n GLU 145 Cb 0.00 -1.69 0.71 0.00 -0.57 0.00 0.00 31.44 29.89 3fi0 n GLU 145 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 3fi0 h ASP 146 N 0.00 0.00 -0.62 1.62 2.03 -2.06 -2.21 116.42 115.18 3fi0 h ASP 146 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3fi0 h ASP 146 Cb 0.97 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.47 3fi0 h ASP 146 CO 0.00 0.09 0.00 0.00 -1.03 0.00 0.00 179.24 178.30 3fi0 n GLN 147 N -3.99 3.48 0.25 4.15 1.13 -1.25 -4.63 117.38 116.52 3fi0 n GLN 147 Ca -0.02 -2.79 -0.14 0.00 -1.94 0.00 0.00 57.00 52.10 3fi0 n GLN 147 Cb 0.18 -1.79 -0.08 0.00 0.11 0.00 0.00 30.24 28.66 3fi0 n GLN 147 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 3fi0 h LYS 148 N 3.83 -0.64 -1.04 -1.09 3.64 -1.56 -2.82 116.57 116.89 3fi0 h LYS 148 Ca 0.00 0.04 0.28 0.00 -1.27 0.00 0.00 60.65 59.70 3fi0 h LYS 148 Cb 1.33 0.14 -0.07 0.00 -0.41 0.00 0.00 32.23 33.22 3fi0 h LYS 148 CO 0.18 -0.33 0.70 0.37 -2.27 0.00 0.00 179.45 178.10 3fi0 h GLN 149 N -0.94 0.22 -0.24 1.90 4.15 -1.82 0.41 115.11 118.79 3fi0 h GLN 149 Ca -0.07 -0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.24 3fi0 h GLN 149 Cb 0.60 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 3fi0 h GLN 149 CO 0.11 0.15 -0.26 0.45 -1.93 0.00 0.00 178.83 177.34 3fi0 h HIS 150 N 0.23 0.51 0.21 3.99 3.86 -1.84 -2.40 115.15 119.72 3fi0 h HIS 150 Ca 0.54 -0.11 -0.34 0.00 -1.16 0.00 0.00 60.37 59.30 3fi0 h HIS 150 Cb 1.70 -0.13 0.02 0.00 1.06 0.00 0.00 27.41 30.06 3fi0 h HIS 150 CO -0.00 0.68 -1.60 0.82 0.86 0.00 0.00 177.93 178.69 3fi0 h ILE 151 N 0.40 1.12 -0.98 2.45 1.08 -0.01 -2.19 117.51 119.39 3fi0 h ILE 151 Ca 0.06 -2.64 0.15 0.00 -0.39 0.00 0.00 64.86 62.04 3fi0 h ILE 151 Cb 0.67 2.90 -0.09 0.00 -3.07 0.00 0.00 36.82 37.23 3fi0 h ILE 151 CO 0.05 0.84 0.60 -0.33 -0.69 0.00 0.00 178.15 178.61 3fi0 h GLU 152 N 0.12 0.84 0.25 2.37 4.39 -1.08 -0.30 114.58 121.18 3fi0 h GLU 152 Ca -0.29 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.34 3fi0 h GLU 152 Cb 2.13 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 30.59 3fi0 h GLU 152 CO 0.22 0.56 -0.12 1.25 -1.16 0.00 0.00 179.01 179.76 3fi0 h LEU 153 N 0.87 -0.28 -1.64 1.33 5.85 -1.44 -1.39 115.31 118.60 3fi0 h LEU 153 Ca 0.52 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 59.01 3fi0 h LEU 153 Cb 0.64 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.74 3fi0 h LEU 153 CO -0.31 0.12 0.01 0.00 -0.34 0.00 0.00 178.44 177.92 3fi0 h THR 154 N -0.74 0.00 0.10 1.05 1.03 -0.82 -0.42 112.91 113.11 3fi0 h THR 154 Ca -0.03 0.00 -0.35 0.00 -0.01 0.00 0.00 66.41 66.01 3fi0 h THR 154 Cb 0.50 0.55 -0.02 0.00 -1.07 0.00 0.00 68.15 68.10 3fi0 h THR 154 CO 0.06 0.00 -1.96 0.54 -0.01 0.00 0.00 175.52 174.15 3fi0 n ARG 155 N -2.37 0.73 0.11 0.00 1.74 -0.17 -2.55 116.66 114.14 3fi0 n ARG 155 Ca -0.02 0.26 -0.00 0.00 -0.77 0.00 0.00 57.85 57.33 3fi0 n ARG 155 Cb 0.05 -1.72 0.29 0.00 -1.02 0.00 0.00 32.46 30.06 3fi0 n ARG 155 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 3fi0 h ASP 156 N 0.06 0.23 0.17 0.55 3.32 -0.10 -0.75 116.42 119.89 3fi0 h ASP 156 Ca -0.40 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 3fi0 h ASP 156 Cb 2.03 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.52 3fi0 h ASP 156 CO 0.08 0.53 -0.08 -0.07 -1.72 0.00 0.00 179.24 177.99 3fi0 h LEU 157 N 0.20 -0.19 -1.01 1.55 3.38 -1.26 -0.86 115.31 117.13 3fi0 h LEU 157 Ca 0.03 -0.35 0.11 0.00 0.09 0.00 0.00 57.88 57.75 3fi0 h LEU 157 Cb 0.65 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.37 3fi0 h LEU 157 CO 0.05 0.35 0.64 0.00 0.09 0.00 0.00 178.44 179.56 3fi0 h ALA 158 N -0.24 1.49 -0.38 1.53 0.00 -1.42 -0.80 119.26 119.44 3fi0 h ALA 158 Ca -0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3fi0 h ALA 158 Cb 0.53 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3fi0 h ALA 158 CO 0.04 0.29 0.14 1.49 0.00 0.00 0.00 179.25 181.20 3fi0 h GLU 159 N 1.05 0.57 -0.90 0.00 4.57 -1.14 -1.68 114.58 117.05 3fi0 h GLU 159 Ca 0.48 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.54 3fi0 h GLU 159 Cb 0.41 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.86 3fi0 h GLU 159 CO -0.24 0.56 0.53 -0.09 -1.18 0.00 0.00 179.01 178.60 3fi0 h ARG 160 N 0.46 1.23 0.19 1.92 2.43 0.18 -2.45 114.38 118.35 3fi0 h ARG 160 Ca 0.12 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 3fi0 h ARG 160 Cb 0.21 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3fi0 h ARG 160 CO -0.01 0.87 -0.09 0.35 -1.51 0.00 0.00 179.97 179.58 3fi0 h PHE 161 N 1.25 -0.24 0.00 2.20 3.57 -1.10 -2.89 116.94 119.73 3fi0 h PHE 161 Ca 0.32 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.82 3fi0 h PHE 161 Cb -0.03 0.08 0.00 0.00 2.79 0.00 0.00 35.95 38.78 3fi0 h PHE 161 CO 0.01 0.14 0.01 0.09 -2.23 0.00 0.00 178.31 176.32 3fi0 n ASN 162 N -5.02 0.35 -0.07 0.41 3.02 -0.64 -0.92 115.26 112.38 3fi0 n ASN 162 Ca -0.09 0.66 -0.11 0.00 -0.03 0.00 0.00 54.58 55.01 3fi0 n ASN 162 Cb 0.25 -0.70 -0.15 0.00 -0.61 0.00 0.00 39.78 38.57 3fi0 n ASN 162 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3fi0 n LYS 163 N -1.97 0.67 0.00 3.52 5.02 -0.93 -4.33 118.16 120.15 3fi0 n LYS 163 Ca -0.01 0.12 -0.20 0.00 -2.02 0.00 0.00 58.31 56.20 3fi0 n LYS 163 Cb 0.03 -1.62 -0.14 0.00 -0.02 0.00 0.00 35.03 33.28 3fi0 n LYS 163 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3fi0 h ARG 164 N 0.00 0.20 0.00 1.97 1.12 -1.15 -3.51 114.38 113.01 3fi0 h ARG 164 Ca -0.46 -0.34 0.00 0.00 -1.11 0.00 0.00 59.98 58.07 3fi0 h ARG 164 Cb 2.14 0.13 0.00 0.00 -0.01 0.00 0.00 29.97 32.22 3fi0 h ARG 164 CO 0.04 1.16 0.00 0.66 -3.11 0.00 0.00 179.97 178.72 3fi0 n TYR 165 N -4.18 0.00 0.00 2.20 4.01 -0.09 -5.13 117.16 113.97 3fi0 n TYR 165 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 3fi0 n TYR 165 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.80 3fi0 n TYR 165 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 3fi0 n LEU 168 N 0.00 0.00 -4.81 7.72 7.94 -1.26 -3.90 117.00 122.69 3fi0 n LEU 168 Ca 0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 54.53 3fi0 n LEU 168 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 3fi0 n LEU 168 CO 0.00 0.00 0.04 -0.36 -1.11 0.00 0.00 177.39 175.96 3fi0 s PHE 169 N 0.00 3.63 -0.19 1.96 0.08 -1.26 -5.01 117.98 117.19 3fi0 s PHE 169 Ca 0.00 0.82 -0.24 0.00 0.12 0.00 0.00 56.93 57.63 3fi0 s PHE 169 Cb 0.00 -2.27 -0.02 0.00 -0.57 0.00 0.00 43.02 40.17 3fi0 s PHE 169 CO 0.00 0.53 0.79 -0.08 -0.10 0.00 0.00 175.22 176.36 3fi0 s THR 170 N -0.58 4.90 -0.35 0.64 -1.32 -1.26 -4.98 115.64 112.68 3fi0 s THR 170 Ca 0.21 1.53 -0.29 0.00 -1.21 0.00 0.00 61.69 61.94 3fi0 s THR 170 Cb -0.15 -4.10 -0.00 0.00 -1.51 0.00 0.00 72.50 66.74 3fi0 s THR 170 CO 0.09 0.03 1.47 -0.63 -2.21 0.00 0.00 174.62 173.37 3fi0 s ILE 171 N 2.21 3.86 0.61 5.08 -1.09 -1.26 -4.62 121.20 125.99 3fi0 s ILE 171 Ca 0.36 0.91 -0.03 0.00 -2.23 0.00 0.00 60.65 59.66 3fi0 s ILE 171 Cb -0.16 -4.05 0.04 0.00 -1.58 0.00 0.00 42.46 36.70 3fi0 s ILE 171 CO 0.11 -0.60 0.88 -2.16 -1.23 0.00 0.00 174.94 171.95 3fi0 s PRO 172 N 4.85 2.48 0.04 2.79 0.04 -1.26 -4.91 135.00 139.03 3fi0 s PRO 172 Ca 0.64 -0.45 0.03 0.00 0.04 0.00 0.00 61.00 61.26 3fi0 s PRO 172 Cb -0.17 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.02 3fi0 s PRO 172 CO 0.30 -0.90 -0.10 -2.00 0.04 0.00 0.00 177.00 174.35 3fi0 s GLU 173 N -4.98 0.65 -0.33 4.56 2.12 0.23 -4.93 118.70 116.02 3fi0 s GLU 173 Ca 0.57 -0.69 -0.02 0.00 0.36 0.00 0.00 54.97 55.19 3fi0 s GLU 173 Cb -0.10 -0.55 0.07 0.00 0.26 0.00 0.00 34.13 33.80 3fi0 s GLU 173 CO 0.42 0.12 0.07 0.00 -0.54 0.00 0.00 175.26 175.33 3fi0 s ALA 174 N -1.03 2.93 0.08 6.30 0.00 -1.26 -0.21 121.76 128.57 3fi0 s ALA 174 Ca -0.04 -1.98 -0.06 0.00 0.00 0.00 0.00 51.96 49.87 3fi0 s ALA 174 Cb -0.08 -2.10 0.02 0.00 0.00 0.00 0.00 23.12 20.96 3fi0 s ALA 174 CO 0.01 -1.43 0.32 2.89 0.00 0.00 0.00 175.76 177.55 3fi0 n ARG 175 N 4.62 0.26 -3.26 0.00 1.85 -0.90 -4.90 116.66 114.33 3fi0 n ARG 175 Ca -0.10 -0.57 -0.05 0.00 -1.00 0.00 0.00 57.85 56.13 3fi0 n ARG 175 Cb 0.43 0.74 -0.04 0.00 -1.05 0.00 0.00 32.46 32.54 3fi0 n ARG 175 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3fi0 s ILE 176 N -2.49 -0.74 0.00 8.89 1.01 -1.26 -3.04 121.20 123.56 3fi0 s ILE 176 Ca 0.07 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.44 3fi0 s ILE 176 Cb -0.01 -0.75 0.00 0.00 0.01 0.00 0.00 42.46 41.71 3fi0 s ILE 176 CO 0.02 -0.21 0.00 -2.65 0.00 0.00 0.00 174.94 172.10 3fi0 n PRO 177 N 5.01 0.00 -3.63 2.79 -0.02 -1.26 -5.14 135.00 132.75 3fi0 n PRO 177 Ca 0.05 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.29 3fi0 n PRO 177 Cb 0.51 -0.52 -0.17 0.00 -0.02 0.00 0.00 33.50 33.30 3fi0 n PRO 177 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3fi0 s ARG 182 N 0.02 0.02 0.71 -0.52 3.52 -1.26 -4.94 118.95 116.50 3fi0 s ARG 182 Ca 0.00 0.05 -0.05 0.00 -0.13 0.00 0.00 55.73 55.60 3fi0 s ARG 182 Cb 0.00 -1.46 0.08 0.00 -1.56 0.00 0.00 34.95 32.02 3fi0 s ARG 182 CO 0.00 -0.58 1.00 0.42 -0.81 0.00 0.00 175.30 175.33 3fi0 s ILE 183 N 2.15 2.29 0.00 4.11 -1.09 -1.26 -5.07 121.20 122.33 3fi0 s ILE 183 Ca 0.03 -0.39 -0.00 0.00 -2.23 0.00 0.00 60.65 58.06 3fi0 s ILE 183 Cb -0.15 -2.90 -0.04 0.00 -1.58 0.00 0.00 42.46 37.79 3fi0 s ILE 183 CO -0.07 0.00 0.09 -0.55 -1.23 0.00 0.00 174.94 173.18 3fi0 s SER 185 N -4.59 5.76 0.47 3.58 0.15 0.40 -4.58 113.70 114.90 3fi0 s SER 185 Ca 0.62 0.16 0.28 0.00 0.70 0.00 0.00 55.95 57.71 3fi0 s SER 185 Cb -0.09 -1.67 0.85 0.00 -1.71 0.00 0.00 66.02 63.40 3fi0 s SER 185 CO 0.44 0.26 1.79 -0.07 1.20 0.00 0.00 173.24 176.87 3fi0 h LEU 186 N 4.01 0.00 0.02 3.45 3.38 -0.94 -2.77 115.31 122.45 3fi0 h LEU 186 Ca -0.49 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.13 3fi0 h LEU 186 Cb 1.18 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 3fi0 h LEU 186 CO 0.63 0.00 -2.21 1.33 0.09 0.00 0.00 178.44 178.29 3fi0 n VAL 187 N -3.02 1.51 -3.80 1.22 0.24 -1.26 -4.74 118.33 108.47 3fi0 n VAL 187 Ca 0.02 -0.76 -0.30 0.00 -2.04 0.00 0.00 64.34 61.27 3fi0 n VAL 187 Cb 0.41 -0.96 -0.14 0.00 -1.47 0.00 0.00 33.84 31.67 3fi0 n VAL 187 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3fi0 s ASP 188 N -6.05 4.12 0.00 -1.34 -1.08 -1.19 -4.96 116.67 106.17 3fi0 s ASP 188 Ca -0.16 -2.08 0.01 0.00 -0.52 0.00 0.00 52.55 49.80 3fi0 s ASP 188 Cb 0.07 -1.12 0.04 0.00 -1.46 0.00 0.00 42.92 40.45 3fi0 s ASP 188 CO 0.77 -0.36 0.92 -0.81 0.52 0.00 0.00 175.17 176.21 3fi0 n PRO 189 N 4.29 0.01 0.00 4.34 -0.04 -1.05 -0.82 135.00 141.73 3fi0 n PRO 189 Ca 0.02 0.38 0.13 0.00 -0.04 0.00 0.00 63.50 63.99 3fi0 n PRO 189 Cb 0.40 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.77 3fi0 n PRO 189 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3fi0 n THR 190 N -1.39 0.00 -4.76 0.52 -1.04 -1.26 -4.73 114.28 101.62 3fi0 n THR 190 Ca 0.00 -0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.74 3fi0 n THR 190 Cb 0.01 -0.06 -0.17 0.00 -1.82 0.00 0.00 70.33 68.29 3fi0 n THR 190 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3fi0 s LYS 191 N -2.98 2.07 0.00 -2.82 2.20 0.00 -5.01 119.74 113.21 3fi0 s LYS 191 Ca 0.13 -0.54 0.00 0.00 -0.36 0.00 0.00 55.97 55.20 3fi0 s LYS 191 Cb 0.18 -1.65 0.00 0.00 -1.51 0.00 0.00 37.83 34.85 3fi0 s LYS 191 CO 0.62 0.07 0.00 1.17 -0.36 0.00 0.00 175.35 176.85 3fi0 n LYS 192 N 3.73 0.00 0.00 4.03 4.81 -1.26 0.15 118.16 129.62 3fi0 n LYS 192 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.22 3fi0 n LYS 192 Cb 0.52 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.57 3fi0 n LYS 192 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3fi0 n SER 194 N 0.00 0.00 0.00 3.14 2.88 -1.26 -4.41 113.62 113.97 3fi0 n SER 194 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 3fi0 n SER 194 Cb 0.00 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 63.67 3fi0 n SER 194 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 3fi0 n LYS 195 N -0.17 0.03 -0.43 -1.46 2.85 -1.26 -1.67 118.16 116.05 3fi0 n LYS 195 Ca 0.00 0.31 0.06 0.00 -1.05 0.00 0.00 58.31 57.63 3fi0 n LYS 195 Cb 0.00 -1.50 0.24 0.00 -0.65 0.00 0.00 35.03 33.12 3fi0 n LYS 195 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3fi0 n SER 196 N -1.46 3.42 -4.72 -5.58 7.64 -1.26 -4.94 113.62 106.73 3fi0 n SER 196 Ca 0.03 -2.32 -0.42 0.00 1.01 0.00 0.00 58.87 57.17 3fi0 n SER 196 Cb 0.11 -0.48 -0.04 0.00 -1.01 0.00 0.00 64.21 62.79 3fi0 n SER 196 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3fi0 s ASP 197 N -0.75 7.32 0.20 6.43 -1.08 -0.67 -4.94 116.67 123.19 3fi0 s ASP 197 Ca 0.35 1.86 -0.10 0.00 -0.52 0.00 0.00 52.55 54.13 3fi0 s ASP 197 Cb 0.23 -2.58 0.22 0.00 -1.46 0.00 0.00 42.92 39.33 3fi0 s ASP 197 CO 0.16 -0.24 1.79 -0.65 0.52 0.00 0.00 175.17 176.74 3fi0 h PRO 198 N 6.14 0.56 -5.80 4.34 0.11 -1.92 -3.34 132.00 132.09 3fi0 h PRO 198 Ca -0.42 -0.03 -0.60 0.00 0.11 0.00 0.00 66.00 65.05 3fi0 h PRO 198 Cb 1.21 -0.13 -0.12 0.00 0.11 0.00 0.00 31.00 32.08 3fi0 h PRO 198 CO 0.75 0.37 0.69 1.21 -0.21 0.00 0.00 178.00 180.81 3fi0 s ASN 199 N -5.52 6.22 0.00 -2.05 3.04 -1.26 -4.88 114.94 110.49 3fi0 s ASN 199 Ca -0.13 -0.68 0.07 0.00 0.04 0.00 0.00 52.86 52.17 3fi0 s ASN 199 Cb 0.16 -2.46 0.38 0.00 -1.54 0.00 0.00 41.25 37.79 3fi0 s ASN 199 CO 0.75 -1.50 1.03 -0.81 -3.04 0.00 0.00 177.10 173.54 3fi0 n PRO 200 N 8.09 0.14 0.00 0.43 -0.04 -1.25 -1.19 135.00 141.18 3fi0 n PRO 200 Ca -0.00 0.16 0.13 0.00 -0.04 0.00 0.00 63.50 63.74 3fi0 n PRO 200 Cb 0.47 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.87 3fi0 n PRO 200 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3fi0 n LYS 201 N -1.20 0.55 0.15 0.54 5.02 -1.26 -3.86 118.16 118.10 3fi0 n LYS 201 Ca 0.04 -0.27 0.07 0.00 -2.02 0.00 0.00 58.31 56.13 3fi0 n LYS 201 Cb 0.05 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 33.63 3fi0 n LYS 201 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fi0 h ALA 202 N 3.47 0.77 -2.05 7.82 0.00 -1.52 -3.39 119.26 124.35 3fi0 h ALA 202 Ca 0.00 -0.28 -0.48 0.00 0.00 0.00 0.00 54.91 54.15 3fi0 h ALA 202 Cb 0.46 -0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.10 3fi0 h ALA 202 CO 0.00 0.35 -0.65 1.52 0.00 0.00 0.00 179.25 180.48 3fi0 s TYR 203 N -3.10 1.95 -0.06 0.00 -0.85 -1.25 -0.37 117.35 113.67 3fi0 s TYR 203 Ca 0.04 -0.80 0.05 0.00 -0.52 0.00 0.00 57.07 55.84 3fi0 s TYR 203 Cb 0.07 -1.19 -0.00 0.00 0.38 0.00 0.00 41.96 41.22 3fi0 s TYR 203 CO 0.73 0.18 -0.21 0.42 -1.52 0.00 0.00 175.55 175.15 3fi0 s ILE 204 N -3.12 1.77 0.14 -3.49 1.01 -1.26 -5.00 121.20 111.25 3fi0 s ILE 204 Ca 0.32 -0.88 -0.03 0.00 0.00 0.00 0.00 60.65 60.06 3fi0 s ILE 204 Cb 0.06 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 40.96 3fi0 s ILE 204 CO 0.13 0.50 0.35 -0.89 0.00 0.00 0.00 174.94 175.02 3fi0 s THR 205 N 0.12 5.22 0.24 2.92 2.01 -1.26 -1.50 115.64 123.38 3fi0 s THR 205 Ca -0.09 -0.15 0.35 0.00 0.31 0.00 0.00 61.69 62.12 3fi0 s THR 205 Cb -0.14 -3.65 0.37 0.00 0.01 0.00 0.00 72.50 69.08 3fi0 s THR 205 CO 0.05 0.00 2.07 -0.07 -0.69 0.00 0.00 174.62 175.98 3fi0 h LEU 206 N 2.66 0.00 -1.91 4.42 3.38 -2.01 -1.43 115.31 120.42 3fi0 h LEU 206 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3fi0 h LEU 206 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3fi0 h LEU 206 CO 0.72 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.43 3fi0 n LEU 207 N -2.83 2.59 -4.74 1.67 4.77 -1.26 -4.58 117.00 112.62 3fi0 n LEU 207 Ca -0.01 -1.24 -0.42 0.00 -0.03 0.00 0.00 56.01 54.32 3fi0 n LEU 207 Cb 0.14 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 3fi0 n LEU 207 CO 0.20 0.52 1.22 -1.81 -1.33 0.00 0.00 177.39 176.18 3fi0 s ASP 208 N -1.27 6.50 0.73 -1.43 1.01 -0.54 -4.98 116.67 116.70 3fi0 s ASP 208 Ca 0.22 2.78 -0.11 0.00 0.71 0.00 0.00 52.55 56.15 3fi0 s ASP 208 Cb 0.14 -2.62 0.03 0.00 1.01 0.00 0.00 42.92 41.49 3fi0 s ASP 208 CO 0.21 -0.84 1.08 1.51 0.21 0.00 0.00 175.17 177.34 3fi0 s ASP 209 N 0.71 5.13 0.32 0.27 1.47 -1.26 -4.78 116.67 118.54 3fi0 s ASP 209 Ca 0.65 1.32 0.07 0.00 1.18 0.00 0.00 52.55 55.78 3fi0 s ASP 209 Cb -0.45 -2.14 0.78 0.00 -0.34 0.00 0.00 42.92 40.77 3fi0 s ASP 209 CO 0.40 -1.56 1.80 0.00 0.68 0.00 0.00 175.17 176.49 3fi0 h ALA 210 N -0.81 1.75 -0.58 2.11 0.00 -1.96 -1.36 119.26 118.42 3fi0 h ALA 210 Ca -0.45 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 3fi0 h ALA 210 Cb 1.24 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 3fi0 h ALA 210 CO 0.60 -0.09 0.07 -0.22 0.00 0.00 0.00 179.25 179.61 3fi0 h LYS 211 N 0.73 0.94 -0.10 0.00 3.64 -2.00 -2.57 116.57 117.22 3fi0 h LYS 211 Ca 0.55 -0.24 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 3fi0 h LYS 211 Cb 0.90 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3fi0 h LYS 211 CO -0.33 0.89 -0.24 1.15 -2.27 0.00 0.00 179.45 178.65 3fi0 h THR 212 N 0.89 1.40 -0.60 1.00 2.02 -1.66 -2.07 112.91 113.88 3fi0 h THR 212 Ca 0.18 -1.55 0.07 0.00 0.77 0.00 0.00 66.41 65.87 3fi0 h THR 212 Cb 0.43 2.15 -0.06 0.00 -1.74 0.00 0.00 68.15 68.93 3fi0 h THR 212 CO 0.01 0.45 0.29 0.40 0.37 0.00 0.00 175.52 177.04 3fi0 h ILE 213 N -0.11 0.90 0.08 3.11 2.04 -1.30 -1.18 117.51 121.05 3fi0 h ILE 213 Ca -0.00 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 3fi0 h ILE 213 Cb 0.84 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3fi0 h ILE 213 CO 0.05 0.10 -0.04 -0.08 0.00 0.00 0.00 178.15 178.18 3fi0 h GLU 214 N 0.54 -0.11 0.00 2.37 4.81 -1.45 0.35 114.58 121.10 3fi0 h GLU 214 Ca 0.28 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.50 3fi0 h GLU 214 Cb 0.23 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 3fi0 h GLU 214 CO -0.21 0.01 -0.08 0.87 -0.73 0.00 0.00 179.01 178.87 3fi0 h LYS 215 N -0.20 0.00 0.25 1.92 1.57 -1.20 -1.06 116.57 117.84 3fi0 h LYS 215 Ca -0.01 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.44 3fi0 h LYS 215 Cb 0.17 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.52 3fi0 h LYS 215 CO 0.02 0.08 -1.47 0.87 -0.57 0.00 0.00 179.45 178.38 3fi0 h LYS 216 N 0.00 0.52 0.00 3.15 1.57 -0.87 -2.90 116.57 118.04 3fi0 h LYS 216 Ca -0.00 -0.89 -0.11 0.00 -1.87 0.00 0.00 60.65 57.77 3fi0 h LYS 216 Cb 0.45 0.33 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 3fi0 h LYS 216 CO 0.01 1.43 -0.54 0.82 -0.57 0.00 0.00 179.45 180.59 3fi0 h ILE 217 N 0.11 1.17 -0.01 1.86 1.08 -0.72 -3.11 117.51 117.89 3fi0 h ILE 217 Ca -0.26 -2.02 -0.14 0.00 -0.39 0.00 0.00 64.86 62.04 3fi0 h ILE 217 Cb 2.14 2.16 -0.02 0.00 -3.07 0.00 0.00 36.82 38.04 3fi0 h ILE 217 CO 0.26 0.53 -0.66 0.11 -0.69 0.00 0.00 178.15 177.71 3fi0 h LYS 218 N 0.00 0.05 -4.85 2.37 1.57 -1.26 -3.47 116.57 110.98 3fi0 h LYS 218 Ca -0.01 -0.04 -0.69 0.00 -1.87 0.00 0.00 60.65 58.04 3fi0 h LYS 218 Cb 1.12 0.01 -0.19 0.00 0.08 0.00 0.00 32.23 33.25 3fi0 h LYS 218 CO 0.07 0.69 0.04 -1.12 -0.57 0.00 0.00 179.45 178.56 3fi0 s SER 219 N -6.85 6.21 0.00 0.86 0.01 -1.10 -5.09 113.70 107.74 3fi0 s SER 219 Ca -0.02 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.17 3fi0 s SER 219 Cb 0.12 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 64.07 3fi0 s SER 219 CO 0.78 -0.93 0.19 -0.24 0.41 0.00 0.00 173.24 173.44 3fi0 n SER 224 N 6.15 0.38 -0.05 2.44 2.88 -1.26 -4.91 113.62 119.25 3fi0 n SER 224 Ca -0.08 -0.80 -0.14 0.00 -1.33 0.00 0.00 58.87 56.53 3fi0 n SER 224 Cb 0.44 0.14 -0.08 0.00 -0.75 0.00 0.00 64.21 63.97 3fi0 n SER 224 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3fi0 h GLU 225 N 0.00 0.39 0.00 -1.46 4.81 -2.06 -3.47 114.58 112.79 3fi0 h GLU 225 Ca 0.00 -0.24 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3fi0 h GLU 225 Cb 0.17 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3fi0 h GLU 225 CO 0.00 0.83 0.00 0.41 -0.73 0.00 0.00 179.01 179.52 3fi0 n GLY 226 N 0.37 1.07 3.72 1.92 0.00 -1.26 -5.05 105.19 105.96 3fi0 n GLY 226 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 3fi0 n GLY 226 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fi0 s THR 227 N -2.80 4.58 -1.21 2.61 -4.23 -1.26 -4.47 115.64 108.86 3fi0 s THR 227 Ca 0.00 -0.14 -0.13 0.00 -1.18 0.00 0.00 61.69 60.24 3fi0 s THR 227 Cb 0.00 -2.94 0.18 0.00 1.34 0.00 0.00 72.50 71.08 3fi0 s THR 227 CO 0.00 0.61 1.44 -0.38 -0.54 0.00 0.00 174.62 175.74 3fi0 n ILE 228 N 2.14 4.29 -4.40 2.99 2.08 -1.26 -4.95 119.36 120.26 3fi0 n ILE 228 Ca -0.19 -4.77 -0.20 0.00 0.56 0.00 0.00 62.75 58.15 3fi0 n ILE 228 Cb 0.54 -2.47 -0.10 0.00 -0.75 0.00 0.00 39.64 36.86 3fi0 n ILE 228 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 3fi0 s ARG 229 N 1.24 1.56 -0.23 0.38 0.52 -1.26 -4.59 118.95 116.57 3fi0 s ARG 229 Ca 0.42 -1.86 -0.02 0.00 -0.52 0.00 0.00 55.73 53.75 3fi0 s ARG 229 Cb -0.03 -0.62 0.01 0.00 0.52 0.00 0.00 34.95 34.83 3fi0 s ARG 229 CO -0.00 -0.23 -0.07 -0.47 0.02 0.00 0.00 175.30 174.55 3fi0 s TYR 230 N -3.48 2.99 0.00 -0.53 5.04 -1.26 -4.50 117.35 115.61 3fi0 s TYR 230 Ca 0.37 -1.32 0.00 0.00 -2.44 0.00 0.00 57.07 53.68 3fi0 s TYR 230 Cb 0.08 -2.07 0.00 0.00 0.35 0.00 0.00 41.96 40.33 3fi0 s TYR 230 CO 0.15 -0.67 0.00 0.41 -1.34 0.00 0.00 175.55 174.10 3fi0 n GLY 237 N 4.72 0.00 0.20 8.97 0.00 -1.26 -5.00 105.19 112.81 3fi0 n GLY 237 Ca -0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.93 3fi0 n GLY 237 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3fi0 h ILE 238 N 0.00 0.52 -0.02 -0.61 1.08 -1.97 -2.92 117.51 113.59 3fi0 h ILE 238 Ca 0.00 -1.44 -0.19 0.00 -0.39 0.00 0.00 64.86 62.83 3fi0 h ILE 238 Cb 0.00 2.03 -0.01 0.00 -3.07 0.00 0.00 36.82 35.77 3fi0 h ILE 238 CO 0.00 0.26 -0.84 0.28 -0.69 0.00 0.00 178.15 177.16 3fi0 h SER 239 N 0.00 0.34 -0.22 1.72 0.02 -1.95 -3.07 113.55 110.39 3fi0 h SER 239 Ca -0.00 -0.25 -0.20 0.00 -0.84 0.00 0.00 61.79 60.50 3fi0 h SER 239 Cb 1.01 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.45 3fi0 h SER 239 CO 0.03 1.03 -0.62 -1.13 -1.14 0.00 0.00 176.83 175.01 3fi0 h ASN 240 N 0.16 0.94 0.33 3.07 -1.24 -1.92 -1.98 115.58 114.94 3fi0 h ASN 240 Ca -0.04 -0.54 -0.07 0.00 0.71 0.00 0.00 56.30 56.36 3fi0 h ASN 240 Cb 1.44 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 40.21 3fi0 h ASN 240 CO 0.13 1.33 -0.34 -0.07 -1.29 0.00 0.00 177.43 177.20 3fi0 h LEU 241 N 0.61 0.01 -0.43 0.34 4.07 -1.61 -1.57 115.31 116.73 3fi0 h LEU 241 Ca -0.01 -0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.77 3fi0 h LEU 241 Cb 1.23 -0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.96 3fi0 h LEU 241 CO 0.13 0.34 -0.70 -0.07 -1.08 0.00 0.00 178.44 177.06 3fi0 h LEU 242 N 0.01 0.49 -0.95 1.67 3.38 -1.42 -0.94 115.31 117.54 3fi0 h LEU 242 Ca -0.00 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 3fi0 h LEU 242 Cb 0.60 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3fi0 h LEU 242 CO 0.04 1.05 -0.45 0.78 0.09 0.00 0.00 178.44 179.95 3fi0 h ASN 243 N 0.29 0.16 0.20 -0.43 2.35 -0.71 -0.88 115.58 116.56 3fi0 h ASN 243 Ca -0.03 -0.07 -0.32 0.00 -0.55 0.00 0.00 56.30 55.34 3fi0 h ASN 243 Cb 1.27 -0.04 0.04 0.00 0.05 0.00 0.00 38.32 39.63 3fi0 h ASN 243 CO 0.12 0.60 -1.36 0.40 -1.65 0.00 0.00 177.43 175.54 3fi0 h ILE 244 N 0.12 1.29 -0.57 2.81 2.04 -1.24 -2.93 117.51 119.03 3fi0 h ILE 244 Ca 0.01 -2.60 -0.06 0.00 1.00 0.00 0.00 64.86 63.21 3fi0 h ILE 244 Cb 0.85 2.92 -0.03 0.00 -0.74 0.00 0.00 36.82 39.83 3fi0 h ILE 244 CO 0.07 0.78 0.12 0.22 0.00 0.00 0.00 178.15 179.34 3fi0 h TYR 245 N 0.17 0.93 0.02 1.37 5.03 -1.07 -2.75 116.97 120.68 3fi0 h TYR 245 Ca -0.23 -0.10 -0.00 0.00 2.58 0.00 0.00 58.73 60.98 3fi0 h TYR 245 Cb 2.05 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 40.06 3fi0 h TYR 245 CO 0.13 0.79 -0.01 0.66 -1.32 0.00 0.00 178.16 178.40 3fi0 h SER 246 N 0.86 -0.03 -0.73 -2.11 4.64 -1.25 -2.64 113.55 112.29 3fi0 h SER 246 Ca 0.18 -0.72 0.06 0.00 -0.47 0.00 0.00 61.79 60.84 3fi0 h SER 246 Cb 0.34 0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 3fi0 h SER 246 CO 0.00 0.77 0.48 0.71 -0.87 0.00 0.00 176.83 177.92 3fi0 h THR 247 N -0.88 1.04 0.00 2.95 1.35 -1.59 1.16 112.91 116.95 3fi0 h THR 247 Ca -0.00 -0.27 -0.10 0.00 -0.55 0.00 0.00 66.41 65.49 3fi0 h THR 247 Cb 0.75 0.18 -0.02 0.00 -1.73 0.00 0.00 68.15 67.33 3fi0 h THR 247 CO 0.01 0.14 -0.67 -0.07 -0.25 0.00 0.00 175.52 174.68 3fi0 h LEU 248 N 0.79 0.00 0.00 3.87 3.38 -1.61 -3.37 115.31 118.37 3fi0 h LEU 248 Ca 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 3fi0 h LEU 248 Cb 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3fi0 h LEU 248 CO -0.10 0.42 -1.63 -1.54 0.09 0.00 0.00 178.44 175.68 3fi0 n SER 249 N -3.10 1.97 0.00 -0.43 3.41 -0.93 -4.96 113.62 109.57 3fi0 n SER 249 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3fi0 n SER 249 Cb 0.72 1.52 0.00 0.00 -0.26 0.00 0.00 64.21 66.19 3fi0 n SER 249 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fi0 n GLY 250 N 1.80 0.54 3.61 5.00 0.00 0.40 -5.05 105.19 111.50 3fi0 n GLY 250 Ca -0.04 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 3fi0 n GLY 250 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fi0 s GLN 251 N -2.64 3.06 0.86 1.61 -0.21 -1.15 -5.05 119.66 116.15 3fi0 s GLN 251 Ca 0.00 -0.47 -0.11 0.00 0.02 0.00 0.00 55.36 54.80 3fi0 s GLN 251 Cb 0.00 -2.76 0.11 0.00 1.00 0.00 0.00 33.01 31.36 3fi0 s GLN 251 CO 0.00 0.59 1.10 -1.54 -2.12 0.00 0.00 175.29 173.32 3fi0 s SER 252 N -0.59 3.73 -0.04 5.90 1.04 -1.26 -4.50 113.70 117.97 3fi0 s SER 252 Ca 0.09 1.71 -0.03 0.00 0.48 0.00 0.00 55.95 58.21 3fi0 s SER 252 Cb -0.12 -2.37 -0.27 0.00 0.10 0.00 0.00 66.02 63.36 3fi0 s SER 252 CO 0.02 -2.51 0.70 0.40 0.98 0.00 0.00 173.24 172.83 3fi0 h ILE 253 N -1.46 0.97 0.00 -1.02 2.04 -1.99 -2.00 117.51 114.06 3fi0 h ILE 253 Ca -0.47 -2.65 -0.03 0.00 1.00 0.00 0.00 64.86 62.71 3fi0 h ILE 253 Cb 1.26 2.66 -0.00 0.00 -0.74 0.00 0.00 36.82 40.00 3fi0 h ILE 253 CO 0.51 0.80 -0.14 -0.33 0.00 0.00 0.00 178.15 178.99 3fi0 h GLU 254 N 0.06 0.00 -0.11 2.37 3.07 -1.97 0.45 114.58 118.46 3fi0 h GLU 254 Ca -0.30 0.00 0.04 0.00 -0.50 0.00 0.00 59.36 58.60 3fi0 h GLU 254 Cb 2.03 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.88 3fi0 h GLU 254 CO 0.14 0.14 -0.36 1.49 -1.40 0.00 0.00 179.01 179.02 3fi0 h GLU 255 N 0.00 -0.43 0.00 2.33 4.81 -1.75 0.30 114.58 119.84 3fi0 h GLU 255 Ca -0.00 0.03 -0.20 0.00 -0.13 0.00 0.00 59.36 59.06 3fi0 h GLU 255 Cb 0.37 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 3fi0 h GLU 255 CO 0.02 -0.29 -0.99 -0.07 -0.73 0.00 0.00 179.01 176.95 3fi0 h LEU 256 N -0.45 0.00 -0.41 1.64 3.38 -0.74 0.13 115.31 118.86 3fi0 h LEU 256 Ca 0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 3fi0 h LEU 256 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3fi0 h LEU 256 CO -0.35 0.93 -0.07 -0.33 0.09 0.00 0.00 178.44 178.70 3fi0 h GLU 257 N 0.00 0.78 0.03 1.13 5.08 -0.18 0.24 114.58 121.67 3fi0 h GLU 257 Ca -0.03 -0.29 0.03 0.00 -1.00 0.00 0.00 59.36 58.07 3fi0 h GLU 257 Cb 1.73 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.89 3fi0 h GLU 257 CO 0.12 0.89 -0.24 0.00 -1.00 0.00 0.00 179.01 178.78 3fi0 h ARG 258 N 0.60 -0.38 -0.30 2.33 3.08 -0.85 -2.41 114.38 116.44 3fi0 h ARG 258 Ca 0.11 0.03 -0.17 0.00 0.07 0.00 0.00 59.98 60.02 3fi0 h ARG 258 Cb 0.59 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.72 3fi0 h ARG 258 CO 0.04 -0.25 -0.48 0.37 -1.07 0.00 0.00 179.97 178.57 3fi0 h GLN 259 N -0.39 0.82 -0.65 0.04 4.15 -0.37 -1.85 115.11 116.85 3fi0 h GLN 259 Ca 0.05 -0.48 0.00 0.00 0.77 0.00 0.00 58.65 58.99 3fi0 h GLN 259 Cb 0.46 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.19 3fi0 h GLN 259 CO -0.19 1.11 0.00 0.66 -1.93 0.00 0.00 178.83 178.48 3fi0 n TYR 260 N -4.02 1.66 -1.68 3.99 4.01 0.82 -4.96 117.16 116.99 3fi0 n TYR 260 Ca -0.03 -0.59 -0.42 0.00 -0.16 0.00 0.00 57.90 56.70 3fi0 n TYR 260 Cb 0.59 -0.40 -0.03 0.00 -0.31 0.00 0.00 39.34 39.18 3fi0 n TYR 260 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3fi0 n GLU 261 N 0.61 2.82 -0.55 -0.72 4.07 -0.70 -1.46 120.64 124.72 3fi0 n GLU 261 Ca 0.23 1.03 0.00 0.00 -0.06 0.00 0.00 57.16 58.36 3fi0 n GLU 261 Cb 0.99 -2.95 0.00 0.00 -0.06 0.00 0.00 31.44 29.43 3fi0 n GLU 261 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3fi0 n GLY 262 N 4.35 0.75 3.89 8.31 0.00 -1.26 -5.05 105.19 116.18 3fi0 n GLY 262 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 3fi0 n GLY 262 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fi0 s LYS 263 N -0.45 3.24 0.43 1.61 -0.14 -0.53 -5.13 119.74 118.77 3fi0 s LYS 263 Ca 0.00 -0.70 -0.04 0.00 -1.36 0.00 0.00 55.97 53.87 3fi0 s LYS 263 Cb 0.00 -2.85 0.09 0.00 -1.68 0.00 0.00 37.83 33.40 3fi0 s LYS 263 CO 0.00 0.51 0.59 0.41 -0.76 0.00 0.00 175.35 176.10 3fi0 n GLY 264 N -0.46 -0.28 0.10 -3.33 0.00 -1.26 -4.47 105.19 95.49 3fi0 n GLY 264 Ca -0.07 -1.85 -0.08 0.00 0.00 0.00 0.00 46.02 44.02 3fi0 n GLY 264 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3fi0 h TYR 265 N -0.93 0.17 -0.66 1.61 0.05 -1.98 -3.31 116.97 111.91 3fi0 h TYR 265 Ca -0.19 -0.10 0.12 0.00 0.05 0.00 0.00 58.73 58.60 3fi0 h TYR 265 Cb 0.61 -0.01 -0.09 0.00 1.01 0.00 0.00 36.73 38.25 3fi0 h TYR 265 CO 0.00 0.97 0.22 0.78 -1.05 0.00 0.00 178.16 179.08 3fi0 h GLY 266 N 2.25 0.93 1.86 3.88 0.00 -1.99 0.92 103.07 110.91 3fi0 h GLY 266 Ca -0.04 -0.09 -0.22 0.00 0.00 0.00 0.00 47.33 46.98 3fi0 h GLY 266 CO 0.13 -0.08 -1.03 -2.08 0.00 0.00 0.00 176.54 173.48 3fi0 h VAL 267 N 0.37 1.61 0.01 4.60 2.07 -1.99 -1.93 116.25 120.99 3fi0 h VAL 267 Ca 0.35 -3.15 0.01 0.00 0.82 0.00 0.00 66.70 64.74 3fi0 h VAL 267 Cb 0.50 2.79 -0.02 0.00 -1.52 0.00 0.00 31.29 33.04 3fi0 h VAL 267 CO -0.38 0.91 -0.08 0.15 0.02 0.00 0.00 177.57 178.18 3fi0 h PHE 268 N 0.04 -0.21 -0.21 1.57 3.57 -1.53 -0.28 116.94 119.89 3fi0 h PHE 268 Ca -0.05 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 3fi0 h PHE 268 Cb 1.76 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.58 3fi0 h PHE 268 CO 0.02 -0.13 0.06 0.87 -2.23 0.00 0.00 178.31 176.90 3fi0 h LYS 269 N -0.15 0.33 -0.85 1.11 1.57 -0.79 0.30 116.57 118.09 3fi0 h LYS 269 Ca 0.03 -0.08 0.18 0.00 -1.87 0.00 0.00 60.65 58.92 3fi0 h LYS 269 Cb 0.18 -0.05 -0.11 0.00 0.08 0.00 0.00 32.23 32.34 3fi0 h LYS 269 CO -0.08 0.44 0.38 0.00 -0.57 0.00 0.00 179.45 179.62 3fi0 h ALA 270 N 0.87 1.30 -0.24 3.86 0.00 -1.37 0.30 119.26 123.98 3fi0 h ALA 270 Ca 0.07 0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 3fi0 h ALA 270 Cb 0.25 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3fi0 h ALA 270 CO -0.00 -0.25 -0.47 -0.44 0.00 0.00 0.00 179.25 178.08 3fi0 h ASP 271 N 0.46 0.83 1.23 0.00 3.32 0.31 -3.14 116.42 119.43 3fi0 h ASP 271 Ca 0.50 -0.54 -0.16 0.00 0.02 0.00 0.00 57.03 56.85 3fi0 h ASP 271 Cb 0.86 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3fi0 h ASP 271 CO -0.46 1.22 -0.78 0.25 -1.72 0.00 0.00 179.24 177.74 3fi0 h LEU 272 N 0.48 0.00 -2.06 1.55 5.85 -0.16 -3.00 115.31 117.96 3fi0 h LEU 272 Ca 0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3fi0 h LEU 272 Cb 1.08 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 3fi0 h LEU 272 CO 0.11 0.72 -0.05 0.00 -0.34 0.00 0.00 178.44 178.87 3fi0 h ALA 273 N 1.28 1.70 0.00 1.25 0.00 -0.42 -2.16 119.26 120.91 3fi0 h ALA 273 Ca -0.02 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 3fi0 h ALA 273 Cb 1.57 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 3fi0 h ALA 273 CO 0.09 0.07 -1.14 1.96 0.00 0.00 0.00 179.25 180.23 3fi0 h GLN 274 N 0.00 0.00 -0.00 0.00 1.08 -1.48 -2.66 115.11 112.05 3fi0 h GLN 274 Ca -0.00 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.03 3fi0 h GLN 274 Cb 0.11 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.52 3fi0 h GLN 274 CO 0.01 0.34 -0.80 -0.39 -0.95 0.00 0.00 178.83 177.03 3fi0 h VAL 275 N 0.00 1.54 0.35 -0.54 -1.51 -1.36 -1.54 116.25 113.18 3fi0 h VAL 275 Ca -0.11 -2.63 -0.02 0.00 -1.23 0.00 0.00 66.70 62.71 3fi0 h VAL 275 Cb 1.50 2.43 0.00 0.00 -2.13 0.00 0.00 31.29 33.10 3fi0 h VAL 275 CO 0.05 0.76 -0.17 0.58 -1.23 0.00 0.00 177.57 177.56 3fi0 h VAL 276 N 0.04 0.00 -0.94 7.19 2.07 -1.48 -1.94 116.25 121.18 3fi0 h VAL 276 Ca -0.02 -0.43 0.24 0.00 0.82 0.00 0.00 66.70 67.32 3fi0 h VAL 276 Cb 1.41 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 31.05 3fi0 h VAL 276 CO 0.11 0.00 0.47 0.40 0.02 0.00 0.00 177.57 178.57 3fi0 h ILE 277 N -0.89 0.47 -0.07 4.57 2.04 -1.56 0.16 117.51 122.23 3fi0 h ILE 277 Ca -0.05 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.66 3fi0 h ILE 277 Cb 0.36 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.42 3fi0 h ILE 277 CO 0.08 0.08 0.05 -0.33 0.00 0.00 0.00 178.15 178.03 3fi0 h GLU 278 N 0.45 0.10 -0.68 2.37 3.07 -1.32 -1.62 114.58 116.94 3fi0 h GLU 278 Ca 0.61 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.45 3fi0 h GLU 278 Cb 1.18 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 3fi0 h GLU 278 CO -0.52 0.08 0.39 1.15 -1.40 0.00 0.00 179.01 178.71 3fi0 h THR 279 N 0.08 1.20 0.00 1.13 2.02 0.11 -3.04 112.91 114.41 3fi0 h THR 279 Ca 0.03 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.74 3fi0 h THR 279 Cb 0.01 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 3fi0 h THR 279 CO -0.01 0.21 -0.78 -0.07 0.37 0.00 0.00 175.52 175.25 3fi0 h LEU 280 N 0.95 0.00 0.16 2.58 3.38 -1.20 -3.39 115.31 117.78 3fi0 h LEU 280 Ca 0.24 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 58.01 3fi0 h LEU 280 Cb -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 3fi0 h LEU 280 CO -0.04 0.11 -0.37 -0.09 0.09 0.00 0.00 178.44 178.14 3fi0 h ARG 281 N 0.00 -0.60 -0.37 1.13 2.43 -1.17 0.70 114.38 116.50 3fi0 h ARG 281 Ca 0.00 0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3fi0 h ARG 281 Cb 0.78 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.45 3fi0 h ARG 281 CO 0.00 -0.40 0.22 -1.00 -1.51 0.00 0.00 179.97 177.29 3fi0 h PRO 282 N -0.62 0.50 0.23 0.20 0.13 -1.77 -1.56 132.00 129.11 3fi0 h PRO 282 Ca 0.02 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.11 3fi0 h PRO 282 Cb 0.64 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.63 3fi0 h PRO 282 CO -0.19 0.38 -0.36 0.82 -0.23 0.00 0.00 178.00 178.42 3fi0 h ILE 283 N 0.49 0.26 -0.16 -3.56 2.04 -1.66 -1.64 117.51 113.28 3fi0 h ILE 283 Ca 0.13 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.04 3fi0 h ILE 283 Cb 0.00 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 3fi0 h ILE 283 CO -0.03 0.00 0.14 1.56 0.00 0.00 0.00 178.15 179.82 3fi0 h GLN 284 N -0.66 0.00 -0.12 2.37 4.20 0.47 -1.91 115.11 119.46 3fi0 h GLN 284 Ca 0.00 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 3fi0 h GLN 284 Cb 0.64 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 3fi0 h GLN 284 CO -0.14 0.00 -0.14 1.49 -0.67 0.00 0.00 178.83 179.37 3fi0 h GLU 285 N 0.00 0.30 0.00 1.46 4.81 -0.33 -3.15 114.58 117.67 3fi0 h GLU 285 Ca 0.08 -0.17 -0.15 0.00 -0.13 0.00 0.00 59.36 58.99 3fi0 h GLU 285 Cb 0.35 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 3fi0 h GLU 285 CO -0.00 0.72 -0.78 0.00 -0.73 0.00 0.00 179.01 178.22 3fi0 h ARG 286 N -0.10 0.00 -0.30 1.92 3.08 -1.23 -2.91 114.38 114.85 3fi0 h ARG 286 Ca 0.02 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.13 3fi0 h ARG 286 Cb 0.67 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.64 3fi0 h ARG 286 CO 0.03 0.67 -0.33 -0.92 -1.07 0.00 0.00 179.97 178.35 3fi0 h TYR 287 N 0.00 -0.92 -0.80 3.04 3.20 -1.40 0.62 116.97 120.72 3fi0 h TYR 287 Ca -0.03 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 3fi0 h TYR 287 Cb 1.56 0.45 -0.04 0.00 1.54 0.00 0.00 36.73 40.24 3fi0 h TYR 287 CO 0.00 -0.39 0.41 0.45 -1.64 0.00 0.00 178.16 176.98 3fi0 h HIS 288 N -0.31 1.12 -0.41 -3.82 3.86 -1.60 -2.06 115.15 111.94 3fi0 h HIS 288 Ca 0.14 -0.04 0.06 0.00 -1.16 0.00 0.00 60.37 59.37 3fi0 h HIS 288 Cb 0.54 -0.35 -0.05 0.00 1.06 0.00 0.00 27.41 28.61 3fi0 h HIS 288 CO -0.50 0.80 0.10 1.25 0.86 0.00 0.00 177.93 180.44 3fi0 h HIS 289 N 1.13 0.16 0.00 2.45 -0.00 -0.60 -2.71 115.15 115.58 3fi0 h HIS 289 Ca 0.28 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.67 3fi0 h HIS 289 Cb 0.08 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.47 3fi0 h HIS 289 CO 0.01 0.03 0.00 0.91 -0.00 0.00 0.00 177.93 178.88 3fi0 n TRP 290 N -5.08 0.00 0.00 5.26 7.02 0.19 -2.56 117.44 122.28 3fi0 n TRP 290 Ca 0.03 -0.15 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 3fi0 n TRP 290 Cb 0.18 -0.23 0.00 0.00 -2.42 0.00 0.00 31.31 28.84 3fi0 n TRP 290 CO 0.00 0.00 0.00 -0.85 -2.02 0.00 0.00 177.69 174.82 3fi0 n GLU 292 N 1.48 0.00 -4.11 -0.99 0.28 -1.02 -4.67 120.64 111.61 3fi0 n GLU 292 Ca 0.00 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.75 3fi0 n GLU 292 Cb 0.09 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 32.91 3fi0 n GLU 292 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3fi0 s SER 293 N 0.00 5.44 0.00 -1.84 0.15 -1.06 -5.00 113.70 111.39 3fi0 s SER 293 Ca 0.00 -0.20 0.20 0.00 0.70 0.00 0.00 55.95 56.64 3fi0 s SER 293 Cb 0.00 -1.38 0.55 0.00 -1.71 0.00 0.00 66.02 63.48 3fi0 s SER 293 CO 0.00 0.03 1.45 -1.84 1.20 0.00 0.00 173.24 174.08 3fi0 n GLU 294 N -0.63 2.07 0.09 5.44 0.28 -1.26 -3.90 120.64 122.73 3fi0 n GLU 294 Ca -0.08 -1.63 0.09 0.00 -0.16 0.00 0.00 57.16 55.37 3fi0 n GLU 294 Cb 0.56 -1.42 0.41 0.00 1.43 0.00 0.00 31.44 32.42 3fi0 n GLU 294 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 3fi0 n GLU 295 N 0.84 0.11 -0.06 3.44 4.07 -1.26 -3.43 120.64 124.35 3fi0 n GLU 295 Ca 0.17 0.45 -0.22 0.00 -0.06 0.00 0.00 57.16 57.50 3fi0 n GLU 295 Cb 0.43 -1.77 -0.13 0.00 -0.06 0.00 0.00 31.44 29.92 3fi0 n GLU 295 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 3fi0 n LEU 296 N -1.99 2.24 0.11 4.31 7.94 -1.25 -2.06 117.00 126.29 3fi0 n LEU 296 Ca 0.01 0.31 0.06 0.00 -1.11 0.00 0.00 56.01 55.28 3fi0 n LEU 296 Cb 0.14 -1.03 0.30 0.00 0.53 0.00 0.00 43.42 43.36 3fi0 n LEU 296 CO 0.13 0.56 0.70 0.47 -1.11 0.00 0.00 177.39 178.15 3fi0 n ASP 297 N -3.98 0.28 -0.07 1.96 10.43 -1.24 -2.18 116.55 121.75 3fi0 n ASP 297 Ca -0.33 0.56 -0.20 0.00 2.57 0.00 0.00 54.79 57.38 3fi0 n ASP 297 Cb 0.86 -0.56 -0.13 0.00 1.84 0.00 0.00 41.12 43.13 3fi0 n ASP 297 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3fi0 n ARG 298 N -1.88 0.69 0.07 -1.24 3.00 -1.17 -3.29 116.66 112.84 3fi0 n ARG 298 Ca -0.01 0.22 0.03 0.00 -0.01 0.00 0.00 57.85 58.09 3fi0 n ARG 298 Cb 0.16 -1.61 0.42 0.00 0.00 0.00 0.00 32.46 31.43 3fi0 n ARG 298 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 3fi0 h VAL 299 N -0.07 1.13 -0.23 1.55 2.07 -1.11 -1.78 116.25 117.81 3fi0 h VAL 299 Ca -0.51 -0.46 -0.19 0.00 0.82 0.00 0.00 66.70 66.36 3fi0 h VAL 299 Cb 1.91 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 3fi0 h VAL 299 CO -0.04 0.16 -0.59 -0.07 0.02 0.00 0.00 177.57 177.05 3fi0 h LEU 300 N 0.38 0.92 0.05 2.57 3.38 -1.58 -1.68 115.31 119.35 3fi0 h LEU 300 Ca 0.09 -0.57 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 3fi0 h LEU 300 Cb 0.15 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3fi0 h LEU 300 CO -0.00 1.32 -0.02 0.44 0.09 0.00 0.00 178.44 180.27 3fi0 h ASP 301 N 0.56 -0.05 -1.01 -0.43 5.19 -1.51 -0.81 116.42 118.36 3fi0 h ASP 301 Ca -0.01 -0.08 0.26 0.00 -0.62 0.00 0.00 57.03 56.58 3fi0 h ASP 301 Cb 1.21 0.01 -0.12 0.00 0.18 0.00 0.00 39.33 40.61 3fi0 h ASP 301 CO 0.13 0.05 0.60 -0.33 -3.12 0.00 0.00 179.24 176.57 3fi0 h GLU 302 N -0.16 0.51 -0.08 3.56 5.08 -1.28 -0.67 114.58 121.55 3fi0 h GLU 302 Ca -0.01 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.10 3fi0 h GLU 302 Cb 0.14 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.28 3fi0 h GLU 302 CO 0.01 0.34 -0.82 0.78 -1.00 0.00 0.00 179.01 178.32 3fi0 h GLY 303 N 0.52 0.77 1.44 -3.84 0.00 -0.77 -0.52 103.07 100.66 3fi0 h GLY 303 Ca 0.65 -1.19 -0.14 0.00 0.00 0.00 0.00 47.33 46.65 3fi0 h GLY 303 CO -0.47 1.06 -0.42 0.00 0.00 0.00 0.00 176.54 176.70 3fi0 h ALA 304 N 0.46 0.79 0.23 3.60 0.00 -0.65 -0.26 119.26 123.44 3fi0 h ALA 304 Ca -0.08 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 3fi0 h ALA 304 Cb 1.47 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3fi0 h ALA 304 CO 0.17 0.66 -0.11 0.93 0.00 0.00 0.00 179.25 180.89 3fi0 h GLU 305 N 0.50 -0.30 -1.01 0.00 5.08 -1.19 2.67 114.58 120.33 3fi0 h GLU 305 Ca 0.04 0.02 0.23 0.00 -1.00 0.00 0.00 59.36 58.65 3fi0 h GLU 305 Cb 0.94 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 30.15 3fi0 h GLU 305 CO 0.08 0.04 0.61 0.87 -1.00 0.00 0.00 179.01 179.62 3fi0 h LYS 306 N -0.71 0.58 0.05 2.33 1.57 -1.06 0.15 116.57 119.48 3fi0 h LYS 306 Ca -0.03 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.51 3fi0 h LYS 306 Cb 0.49 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3fi0 h LYS 306 CO 0.05 0.38 -1.08 0.00 -0.57 0.00 0.00 179.45 178.23 3fi0 h ALA 307 N 1.68 0.17 -0.11 3.86 0.00 -0.85 -3.24 119.26 120.77 3fi0 h ALA 307 Ca 0.61 -1.01 0.03 0.00 0.00 0.00 0.00 54.91 54.54 3fi0 h ALA 307 Cb 1.19 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 19.45 3fi0 h ALA 307 CO -0.41 0.62 0.17 -0.97 0.00 0.00 0.00 179.25 178.66 3fi0 h ASN 308 N -0.67 0.00 0.22 0.00 -0.00 0.51 0.12 115.58 115.76 3fi0 h ASN 308 Ca -0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.03 3fi0 h ASN 308 Cb 1.46 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.78 3fi0 h ASN 308 CO -0.04 0.00 -0.11 0.03 -0.00 0.00 0.00 177.43 177.31 3fi0 h ARG 309 N 0.00 -0.29 -0.43 6.67 3.08 -0.82 -1.85 114.38 120.74 3fi0 h ARG 309 Ca 0.05 0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 3fi0 h ARG 309 Cb 0.39 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 3fi0 h ARG 309 CO -0.00 0.09 0.05 0.28 -1.07 0.00 0.00 179.97 179.33 3fi0 h VAL 310 N -0.86 1.25 0.00 2.04 2.07 -1.36 -3.17 116.25 116.22 3fi0 h VAL 310 Ca -0.03 -0.92 -0.10 0.00 0.82 0.00 0.00 66.70 66.47 3fi0 h VAL 310 Cb 0.51 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3fi0 h VAL 310 CO 0.05 0.32 -0.50 0.00 0.02 0.00 0.00 177.57 177.46 3fi0 h ALA 311 N 0.93 1.10 -0.19 1.67 0.00 -0.91 -3.15 119.26 118.70 3fi0 h ALA 311 Ca 0.13 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 3fi0 h ALA 311 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3fi0 h ALA 311 CO 0.01 0.62 -0.38 0.77 0.00 0.00 0.00 179.25 180.27 3fi0 h SER 312 N 0.00 0.45 0.00 0.00 0.02 -1.31 -2.68 113.55 110.03 3fi0 h SER 312 Ca -0.00 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 3fi0 h SER 312 Cb 0.92 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.34 3fi0 h SER 312 CO 0.06 0.79 0.00 1.21 -1.14 0.00 0.00 176.83 177.76 3fi0 n GLU 313 N -4.04 0.44 0.00 3.45 4.07 -1.19 -2.10 120.64 121.27 3fi0 n GLU 313 Ca -0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.09 3fi0 n GLU 313 Cb 0.48 -1.26 0.00 0.00 -0.06 0.00 0.00 31.44 30.60 3fi0 n GLU 313 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 3fi0 n VAL 315 N 0.61 0.00 -0.09 6.31 0.31 -1.01 -1.44 118.33 123.02 3fi0 n VAL 315 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 3fi0 n VAL 315 Cb 0.18 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.12 3fi0 n VAL 315 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3fi0 h ARG 316 N 0.00 0.13 -1.62 5.55 1.12 -1.70 -1.50 114.38 116.36 3fi0 h ARG 316 Ca 0.00 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.86 3fi0 h ARG 316 Cb 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 29.97 29.93 3fi0 h ARG 316 CO 0.00 0.09 0.00 1.63 -3.11 0.00 0.00 179.97 178.58 3fi0 n LYS 317 N -5.13 0.41 0.00 0.20 5.02 -0.52 -2.09 118.16 116.05 3fi0 n LYS 317 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 3fi0 n LYS 317 Cb 0.16 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.88 3fi0 n LYS 317 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3fi0 n GLU 319 N 0.88 0.00 -0.26 1.97 1.02 -0.56 -1.67 120.64 122.02 3fi0 n GLU 319 Ca 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.21 3fi0 n GLU 319 Cb 0.21 0.00 0.21 0.00 -0.02 0.00 0.00 31.44 31.83 3fi0 n GLU 319 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3fi0 h GLN 320 N 0.00 0.36 -0.24 3.49 5.75 -1.66 3.76 115.11 126.57 3fi0 h GLN 320 Ca 0.00 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 3fi0 h GLN 320 Cb 0.00 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.47 3fi0 h GLN 320 CO 0.00 0.24 0.00 0.00 -2.65 0.00 0.00 178.83 176.42 3fi0 n ALA 321 N -2.56 1.68 -2.37 3.38 0.00 -0.67 -4.71 120.51 115.26 3fi0 n ALA 321 Ca 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.55 3fi0 n ALA 321 Cb 0.48 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.97 3fi0 n ALA 321 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fi0 n GLY 323 N 0.15 1.36 3.71 0.00 0.00 1.23 -4.99 105.19 106.65 3fi0 n GLY 323 Ca 0.00 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 3fi0 n GLY 323 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fi0 s LEU 324 N -2.27 4.26 0.00 0.99 1.43 -0.01 -4.92 118.68 118.16 3fi0 s LEU 324 Ca 0.05 0.80 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 3fi0 s LEU 324 Cb 0.25 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.77 3fi0 s LEU 324 CO -0.07 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.09 3fi0 n GLY 325 N 3.36 2.08 0.00 -3.19 0.00 -1.26 -4.61 105.19 101.57 3fi0 n GLY 325 Ca -0.07 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3fi0 n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86