#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 5.37 -0.05 -0.18 2.01 -1.26 -0.86 115.64 120.67 3fi0 s THR 3 Ca 0.00 0.16 0.05 0.00 0.31 0.00 0.00 61.69 62.21 3fi0 s THR 3 Cb 0.00 -3.35 -0.02 0.00 0.01 0.00 0.00 72.50 69.15 3fi0 s THR 3 CO 0.00 0.60 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.69 3fi0 s ILE 4 N -0.84 2.44 -0.14 1.82 1.01 0.25 -1.09 121.20 124.66 3fi0 s ILE 4 Ca 0.14 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.86 3fi0 s ILE 4 Cb -0.12 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.46 3fi0 s ILE 4 CO 0.03 0.57 -0.16 0.12 0.00 0.00 0.00 174.94 175.51 3fi0 s PHE 5 N -0.40 2.21 -0.14 3.97 2.19 -1.01 -0.03 117.98 124.77 3fi0 s PHE 5 Ca 0.04 -1.19 0.02 0.00 0.33 0.00 0.00 56.93 56.13 3fi0 s PHE 5 Cb -0.12 -1.59 0.01 0.00 -1.31 0.00 0.00 43.02 40.01 3fi0 s PHE 5 CO 0.02 -0.62 -0.20 0.45 1.83 0.00 0.00 175.22 176.69 3fi0 s SER 6 N 1.28 2.95 -0.34 6.13 0.15 0.50 -4.21 113.70 120.17 3fi0 s SER 6 Ca 0.01 -0.57 -0.07 0.00 0.70 0.00 0.00 55.95 56.02 3fi0 s SER 6 Cb -0.14 -1.36 0.03 0.00 -1.71 0.00 0.00 66.02 62.84 3fi0 s SER 6 CO -0.08 0.05 0.12 -0.83 1.20 0.00 0.00 173.24 173.70 3fi0 s GLY 7 N 0.96 1.85 -0.20 9.45 0.00 -1.26 0.11 107.32 118.23 3fi0 s GLY 7 Ca -0.04 -1.70 -0.08 0.00 0.00 0.00 0.00 44.72 42.90 3fi0 s GLY 7 CO -0.04 0.77 0.09 -0.42 0.00 0.00 0.00 173.10 173.50 3fi0 s ILE 8 N 1.45 4.94 -0.06 0.90 -1.09 0.16 -4.87 121.20 122.63 3fi0 s ILE 8 Ca -0.00 0.03 -0.19 0.00 -2.23 0.00 0.00 60.65 58.25 3fi0 s ILE 8 Cb -0.19 -3.25 -0.14 0.00 -1.58 0.00 0.00 42.46 37.30 3fi0 s ILE 8 CO 0.04 0.43 0.77 1.56 -1.23 0.00 0.00 174.94 176.50 3fi0 h GLN 9 N 6.96 -0.23 0.00 2.79 1.08 -1.87 -0.91 115.11 122.93 3fi0 h GLN 9 Ca -0.38 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 3fi0 h GLN 9 Cb 1.17 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 3fi0 h GLN 9 CO 0.69 0.15 0.00 0.25 -0.95 0.00 0.00 178.83 178.98 3fi0 n THR 15 N -4.93 0.00 0.91 -0.54 -2.24 -1.26 -4.95 114.28 101.28 3fi0 n THR 15 Ca -0.07 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 3fi0 n THR 15 Cb 0.25 0.00 0.54 0.00 -2.10 0.00 0.00 70.33 69.02 3fi0 n THR 15 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 3fi0 n ILE 16 N 3.51 0.31 0.00 2.28 -5.35 -0.80 -1.17 119.36 118.14 3fi0 n ILE 16 Ca 0.00 0.08 -0.17 0.00 -0.27 0.00 0.00 62.75 62.38 3fi0 n ILE 16 Cb 0.00 -0.66 -0.13 0.00 -1.74 0.00 0.00 39.64 37.11 3fi0 n ILE 16 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 3fi0 h GLY 17 N 4.14 0.29 1.06 3.28 0.00 -1.92 -3.15 103.07 106.77 3fi0 h GLY 17 Ca 0.00 -0.61 -0.16 0.00 0.00 0.00 0.00 47.33 46.56 3fi0 h GLY 17 CO 0.00 0.54 -0.42 3.43 0.00 0.00 0.00 176.54 180.09 3fi0 h ASN 18 N -0.41 0.88 -0.07 0.19 2.35 -1.87 0.51 115.58 117.16 3fi0 h ASN 18 Ca -0.08 -0.51 -0.06 0.00 -0.55 0.00 0.00 56.30 55.11 3fi0 h ASN 18 Cb 1.32 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 3fi0 h ASN 18 CO 0.10 1.22 -0.11 0.22 -1.65 0.00 0.00 177.43 177.20 3fi0 h TYR 19 N 0.57 0.39 0.00 1.19 3.20 -1.35 -2.44 116.97 118.53 3fi0 h TYR 19 Ca 0.03 -0.05 -0.13 0.00 3.14 0.00 0.00 58.73 61.72 3fi0 h TYR 19 Cb 1.02 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 3fi0 h TYR 19 CO 0.07 0.48 -1.34 -0.89 -1.64 0.00 0.00 178.16 174.84 3fi0 n ILE 20 N -4.25 1.05 -0.06 1.81 5.41 -1.17 -1.96 119.36 120.20 3fi0 n ILE 20 Ca 0.00 -0.66 -0.22 0.00 1.00 0.00 0.00 62.75 62.87 3fi0 n ILE 20 Cb 0.29 -0.64 -0.13 0.00 -0.71 0.00 0.00 39.64 38.45 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 -0.71 0.00 7.39 0.00 0.16 -3.78 105.19 109.61 3fi0 n GLY 21 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.26 1.50 -0.08 4.61 0.00 -0.94 -2.26 120.51 120.09 3fi0 n ALA 22 Ca -0.33 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.01 3fi0 n ALA 22 Cb 0.85 0.10 -0.15 0.00 0.00 0.00 0.00 19.45 20.24 3fi0 n ALA 22 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3fi0 n LEU 23 N -1.27 0.54 0.03 0.00 7.94 -1.10 -4.57 117.00 118.58 3fi0 n LEU 23 Ca 0.00 0.12 -0.01 0.00 -1.11 0.00 0.00 56.01 55.00 3fi0 n LEU 23 Cb 0.20 0.25 -0.09 0.00 0.53 0.00 0.00 43.42 44.31 3fi0 n LEU 23 CO 0.00 0.51 -0.29 -0.09 -1.11 0.00 0.00 177.39 176.41 3fi0 h ARG 24 N 0.00 0.00 0.00 1.96 2.43 -1.67 -1.01 114.38 116.09 3fi0 h ARG 24 Ca -0.47 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 3fi0 h ARG 24 Cb 2.15 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.70 3fi0 h ARG 24 CO 0.04 0.33 0.00 1.04 -1.51 0.00 0.00 179.97 179.87 3fi0 n GLN 25 N -2.93 0.13 0.12 0.20 3.00 -1.26 -3.84 117.38 112.80 3fi0 n GLN 25 Ca -0.10 0.46 0.12 0.00 -0.01 0.00 0.00 57.00 57.47 3fi0 n GLN 25 Cb 0.87 -1.81 0.08 0.00 0.00 0.00 0.00 30.24 29.38 3fi0 n GLN 25 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 3fi0 h PHE 26 N 0.00 0.00 -0.11 1.08 0.04 -1.42 0.47 116.94 117.00 3fi0 h PHE 26 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 3fi0 h PHE 26 Cb 0.22 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 3fi0 h PHE 26 CO 0.00 0.00 -0.00 0.28 -0.60 0.00 0.00 178.31 177.99 3fi0 h VAL 27 N 0.00 1.08 0.05 -0.55 2.07 -1.67 -2.95 116.25 114.28 3fi0 h VAL 27 Ca 0.00 -0.29 -0.36 0.00 0.82 0.00 0.00 66.70 66.87 3fi0 h VAL 27 Cb 0.95 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 3fi0 h VAL 27 CO 0.00 0.10 -2.03 -0.62 0.02 0.00 0.00 177.57 175.03 3fi0 n GLU 28 N -4.44 0.67 0.20 1.57 -0.58 0.25 -4.23 120.64 114.07 3fi0 n GLU 28 Ca -0.01 0.30 0.08 0.00 -0.42 0.00 0.00 57.16 57.11 3fi0 n GLU 28 Cb 0.14 -1.64 0.31 0.00 -0.57 0.00 0.00 31.44 29.68 3fi0 n GLU 28 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3fi0 h LEU 29 N -0.33 0.00 -0.12 -4.62 3.38 -0.33 -2.85 115.31 110.44 3fi0 h LEU 29 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3fi0 h LEU 29 Cb 1.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.54 3fi0 h LEU 29 CO -0.09 0.30 0.09 0.00 0.09 0.00 0.00 178.44 178.82 3fi0 n GLN 30 N -3.33 0.01 -0.04 1.13 10.64 -1.11 -0.41 117.38 124.26 3fi0 n GLN 30 Ca 0.01 0.43 -0.01 0.00 -1.83 0.00 0.00 57.00 55.60 3fi0 n GLN 30 Cb 0.53 -1.63 -0.15 0.00 -0.86 0.00 0.00 30.24 28.13 3fi0 n GLN 30 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 3fi0 n HIS 31 N -1.49 0.21 0.23 2.61 8.25 -1.07 -4.37 115.22 119.58 3fi0 n HIS 31 Ca -0.00 0.07 0.04 0.00 -0.26 0.00 0.00 57.72 57.57 3fi0 n HIS 31 Cb 0.09 -0.87 0.05 0.00 1.12 0.00 0.00 29.99 30.39 3fi0 n HIS 31 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 3fi0 n GLU 32 N -2.63 0.84 -4.19 -0.41 0.28 -0.05 -4.97 120.64 109.51 3fi0 n GLU 32 Ca -0.19 -1.22 -0.12 0.00 -0.16 0.00 0.00 57.16 55.47 3fi0 n GLU 32 Cb 0.91 -1.17 -0.10 0.00 1.43 0.00 0.00 31.44 32.51 3fi0 n GLU 32 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 3fi0 s TYR 33 N -0.77 1.00 -0.47 -1.84 1.51 0.45 -4.62 117.35 112.61 3fi0 s TYR 33 Ca 0.12 -0.87 -0.21 0.00 -1.01 0.00 0.00 57.07 55.09 3fi0 s TYR 33 Cb 0.07 -0.55 0.04 0.00 -0.11 0.00 0.00 41.96 41.41 3fi0 s TYR 33 CO 0.11 -0.09 0.69 1.21 -1.11 0.00 0.00 175.55 176.36 3fi0 s ASN 34 N -3.08 6.31 -0.07 2.29 3.04 -0.04 -4.60 114.94 118.79 3fi0 s ASN 34 Ca 0.13 -0.47 -0.05 0.00 0.04 0.00 0.00 52.86 52.52 3fi0 s ASN 34 Cb 0.05 -2.33 -0.04 0.00 -1.54 0.00 0.00 41.25 37.38 3fi0 s ASN 34 CO -0.03 -0.89 0.14 0.00 -3.04 0.00 0.00 177.10 173.29 3fi0 s TYR 36 N -1.14 2.02 -0.35 0.00 2.02 0.95 -1.16 117.35 119.68 3fi0 s TYR 36 Ca 0.20 -0.97 0.02 0.00 -0.37 0.00 0.00 57.07 55.95 3fi0 s TYR 36 Cb -0.12 -1.45 0.10 0.00 -0.40 0.00 0.00 41.96 40.08 3fi0 s TYR 36 CO 0.10 -0.50 0.08 -0.06 -1.57 0.00 0.00 175.55 173.60 3fi0 s PHE 37 N 1.03 3.69 -0.25 2.71 0.40 0.38 -0.37 117.98 125.57 3fi0 s PHE 37 Ca -0.06 -2.82 -0.10 0.00 -0.60 0.00 0.00 56.93 53.36 3fi0 s PHE 37 Cb -0.15 -2.93 -0.05 0.00 0.51 0.00 0.00 43.02 40.40 3fi0 s PHE 37 CO -0.02 -0.95 0.15 0.00 0.70 0.00 0.00 175.22 175.09 3fi0 s ILE 39 N 1.37 4.31 -1.41 0.00 1.01 0.32 0.35 121.20 127.16 3fi0 s ILE 39 Ca 0.07 0.11 -0.14 0.00 0.00 0.00 0.00 60.65 60.68 3fi0 s ILE 39 Cb -0.15 -4.61 0.01 0.00 0.01 0.00 0.00 42.46 37.72 3fi0 s ILE 39 CO 0.07 -1.27 2.26 1.33 0.00 0.00 0.00 174.94 177.32 3fi0 n VAL 40 N 6.14 3.36 0.24 2.92 0.24 -0.35 -0.30 118.33 130.58 3fi0 n VAL 40 Ca 0.00 -2.84 0.07 0.00 -2.04 0.00 0.00 64.34 59.54 3fi0 n VAL 40 Cb 0.47 -2.58 0.57 0.00 -1.47 0.00 0.00 33.84 30.83 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 6.10 0.00 0.60 -1.34 2.03 -1.92 -2.63 116.42 119.26 3fi0 h ASP 41 Ca 0.58 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.75 3fi0 h ASP 41 Cb 0.61 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.09 3fi0 h ASP 41 CO 1.89 0.15 -0.62 1.56 -1.03 0.00 0.00 179.24 181.19 3fi0 h GLN 42 N 0.00 0.02 0.00 4.15 4.20 -1.95 -2.69 115.11 118.84 3fi0 h GLN 42 Ca -0.00 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.61 3fi0 h GLN 42 Cb 0.29 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 3fi0 h GLN 42 CO 0.02 0.63 -0.39 0.45 -0.67 0.00 0.00 178.83 178.88 3fi0 h HIS 43 N 0.01 0.00 -0.18 2.96 3.86 -1.87 -3.26 115.15 116.67 3fi0 h HIS 43 Ca -0.01 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.09 3fi0 h HIS 43 Cb 1.10 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.56 3fi0 h HIS 43 CO 0.00 0.39 -0.36 0.00 0.86 0.00 0.00 177.93 178.82 3fi0 h ALA 44 N 1.61 1.05 0.00 2.45 0.00 -1.28 -2.98 119.26 120.11 3fi0 h ALA 44 Ca -0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3fi0 h ALA 44 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3fi0 h ALA 44 CO 0.05 0.59 0.00 0.44 0.00 0.00 0.00 179.25 180.33 3fi0 n ILE 45 N -4.06 0.00 0.32 0.00 -5.35 -1.21 -2.84 119.36 106.23 3fi0 n ILE 45 Ca -0.01 0.00 0.15 0.00 -0.27 0.00 0.00 62.75 62.62 3fi0 n ILE 45 Cb 0.46 -0.33 0.63 0.00 -1.74 0.00 0.00 39.64 38.66 3fi0 n ILE 45 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 3fi0 h THR 46 N 0.00 0.00 -2.66 7.28 1.35 -1.71 -3.43 112.91 113.74 3fi0 h THR 46 Ca 0.00 -0.38 -0.49 0.00 -0.55 0.00 0.00 66.41 64.99 3fi0 h THR 46 Cb 0.00 1.27 -0.14 0.00 -1.73 0.00 0.00 68.15 67.55 3fi0 h THR 46 CO 0.00 0.00 -0.70 0.68 -0.25 0.00 0.00 175.52 175.25 3fi0 s VAL 47 N -3.55 1.75 -0.06 6.82 -7.23 -1.13 -4.57 120.40 112.42 3fi0 s VAL 47 Ca 0.02 -2.17 -0.38 0.00 -1.81 0.00 0.00 61.98 57.64 3fi0 s VAL 47 Cb 0.09 -2.33 -0.16 0.00 0.56 0.00 0.00 36.38 34.54 3fi0 s VAL 47 CO 0.48 -0.39 1.55 1.87 -0.31 0.00 0.00 175.10 178.30 3fi0 n TRP 48 N -0.54 1.83 -4.68 2.82 -0.00 -1.26 -4.99 117.44 110.63 3fi0 n TRP 48 Ca -0.06 0.53 -0.23 0.00 -0.00 0.00 0.00 57.50 57.74 3fi0 n TRP 48 Cb 0.62 -2.42 -0.15 0.00 -0.00 0.00 0.00 31.31 29.36 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 1.95 1.20 -0.16 5.87 -1.52 -1.26 -5.03 119.66 120.71 3fi0 s GLN 49 Ca 0.90 -0.52 -0.29 0.00 -1.95 0.00 0.00 55.36 53.50 3fi0 s GLN 49 Cb -0.96 -1.16 -0.03 0.00 -0.22 0.00 0.00 33.01 30.64 3fi0 s GLN 49 CO 0.54 0.31 1.52 0.34 -0.25 0.00 0.00 175.29 177.75 3fi0 s ASP 50 N -0.32 6.63 0.36 5.90 3.68 -1.26 -4.93 116.67 126.73 3fi0 s ASP 50 Ca 0.05 1.82 0.07 0.00 2.13 0.00 0.00 52.55 56.62 3fi0 s ASP 50 Cb -0.06 -2.53 0.78 0.00 -1.45 0.00 0.00 42.92 39.66 3fi0 s ASP 50 CO -0.00 -1.02 1.92 -0.65 0.13 0.00 0.00 175.17 175.55 3fi0 h PRO 51 N 9.64 0.70 -0.11 4.34 0.11 -1.99 0.04 132.00 144.73 3fi0 h PRO 51 Ca -0.33 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 65.55 3fi0 h PRO 51 Cb 1.15 -0.16 0.01 0.00 0.11 0.00 0.00 31.00 32.11 3fi0 h PRO 51 CO 0.98 0.47 -0.66 1.25 -0.21 0.00 0.00 178.00 179.83 3fi0 h HIS 52 N 0.73 0.88 -0.23 0.65 -0.00 -1.99 -2.13 115.15 113.05 3fi0 h HIS 52 Ca 0.37 -0.40 -0.05 0.00 -0.00 0.00 0.00 60.37 60.29 3fi0 h HIS 52 Cb 0.47 -0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 27.73 3fi0 h HIS 52 CO -0.00 1.21 -0.09 1.49 -0.00 0.00 0.00 177.93 180.53 3fi0 h GLU 53 N 0.31 0.37 0.67 5.26 4.81 -1.69 -2.15 114.58 122.15 3fi0 h GLU 53 Ca -0.05 -0.09 -0.03 0.00 -0.13 0.00 0.00 59.36 59.06 3fi0 h GLU 53 Cb 1.30 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.64 3fi0 h GLU 53 CO 0.14 0.47 -0.32 1.25 -0.73 0.00 0.00 179.01 179.82 3fi0 h LEU 54 N 0.35 -0.76 -1.86 1.64 5.85 -0.94 0.46 115.31 120.04 3fi0 h LEU 54 Ca 0.07 0.03 0.20 0.00 0.84 0.00 0.00 57.88 59.02 3fi0 h LEU 54 Cb 0.39 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 3fi0 h LEU 54 CO 0.02 -0.41 0.64 -0.09 -0.34 0.00 0.00 178.44 178.26 3fi0 h ARG 55 N -1.18 0.00 0.04 1.25 9.65 -1.32 -1.20 114.38 121.63 3fi0 h ARG 55 Ca -0.09 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 58.67 3fi0 h ARG 55 Cb 0.69 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.27 3fi0 h ARG 55 CO 0.15 0.00 -0.59 0.37 2.80 0.00 0.00 179.97 182.70 3fi0 h GLN 56 N 0.00 0.09 0.00 0.20 4.15 -1.20 -3.28 115.11 115.06 3fi0 h GLN 56 Ca 0.33 -0.15 0.00 0.00 0.77 0.00 0.00 58.65 59.60 3fi0 h GLN 56 Cb 1.61 0.06 0.00 0.00 0.21 0.00 0.00 27.48 29.36 3fi0 h GLN 56 CO -0.00 1.07 0.00 -0.91 -1.93 0.00 0.00 178.83 177.06 3fi0 h ASN 57 N -0.79 0.00 -0.09 -0.69 2.35 0.22 -2.40 115.58 114.19 3fi0 h ASN 57 Ca -0.14 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 3fi0 h ASN 57 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.66 3fi0 h ASN 57 CO -0.00 0.00 -0.24 0.40 -1.65 0.00 0.00 177.43 175.94 3fi0 h ILE 58 N 0.00 1.41 0.08 2.81 2.04 -1.39 -2.58 117.51 119.89 3fi0 h ILE 58 Ca 0.00 -1.58 -0.00 0.00 1.00 0.00 0.00 64.86 64.27 3fi0 h ILE 58 Cb 0.25 2.21 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 3fi0 h ILE 58 CO 0.00 0.45 -0.04 0.03 0.00 0.00 0.00 178.15 178.59 3fi0 h ARG 59 N -0.16 -0.11 -0.83 2.37 3.08 -1.52 -2.39 114.38 114.82 3fi0 h ARG 59 Ca -0.01 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.07 3fi0 h ARG 59 Cb 0.85 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.89 3fi0 h ARG 59 CO 0.05 0.15 0.55 0.00 -1.07 0.00 0.00 179.97 179.66 3fi0 h ARG 60 N -0.37 1.06 -0.70 0.04 3.08 -1.56 -0.39 114.38 115.54 3fi0 h ARG 60 Ca -0.01 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 3fi0 h ARG 60 Cb 0.32 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3fi0 h ARG 60 CO 0.02 0.70 0.20 1.25 -1.07 0.00 0.00 179.97 181.07 3fi0 h LEU 61 N 1.09 1.03 -0.34 3.04 5.85 -1.41 -0.12 115.31 124.45 3fi0 h LEU 61 Ca 0.31 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 3fi0 h LEU 61 Cb -0.07 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.68 3fi0 h LEU 61 CO -0.08 0.97 0.02 0.00 -0.34 0.00 0.00 178.44 179.01 3fi0 h ALA 62 N 1.09 0.46 -0.43 1.25 0.00 -0.79 -2.61 119.26 118.24 3fi0 h ALA 62 Ca 0.22 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3fi0 h ALA 62 Cb 0.33 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3fi0 h ALA 62 CO -0.00 0.20 -0.08 0.00 0.00 0.00 0.00 179.25 179.37 3fi0 h ALA 63 N 0.87 1.06 -0.58 0.00 0.00 -0.93 -2.18 119.26 117.51 3fi0 h ALA 63 Ca 0.10 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 3fi0 h ALA 63 Cb 0.42 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3fi0 h ALA 63 CO 0.01 0.58 0.12 -0.07 0.00 0.00 0.00 179.25 179.89 3fi0 h LEU 64 N 0.68 0.86 -0.53 0.00 3.38 -0.94 0.38 115.31 119.14 3fi0 h LEU 64 Ca 0.12 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.79 3fi0 h LEU 64 Cb 0.54 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3fi0 h LEU 64 CO 0.03 0.85 -0.22 1.88 0.09 0.00 0.00 178.44 181.08 3fi0 h TYR 65 N 0.87 1.10 -0.40 1.13 -1.99 -1.21 0.24 116.97 116.71 3fi0 h TYR 65 Ca 0.18 -0.26 -0.10 0.00 2.00 0.00 0.00 58.73 60.55 3fi0 h TYR 65 Cb 0.35 -0.26 -0.01 0.00 2.00 0.00 0.00 36.73 38.81 3fi0 h TYR 65 CO 0.02 1.08 -0.14 -0.07 -0.00 0.00 0.00 178.16 179.05 3fi0 h LEU 66 N 0.83 0.81 -0.41 3.88 3.38 -1.00 -0.36 115.31 122.44 3fi0 h LEU 66 Ca 0.11 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 3fi0 h LEU 66 Cb 0.79 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3fi0 h LEU 66 CO 0.07 1.01 -0.02 0.00 0.09 0.00 0.00 178.44 179.58 3fi0 h ALA 67 N 0.83 0.56 0.00 1.53 0.00 -0.08 -2.86 119.26 119.24 3fi0 h ALA 67 Ca 0.10 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3fi0 h ALA 67 Cb 0.67 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3fi0 h ALA 67 CO 0.05 0.36 -0.01 0.28 0.00 0.00 0.00 179.25 179.93 3fi0 h VAL 68 N 0.57 0.40 0.00 0.00 2.07 -0.50 -3.45 116.25 115.33 3fi0 h VAL 68 Ca 0.11 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3fi0 h VAL 68 Cb 0.51 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 3fi0 h VAL 68 CO 0.02 0.01 0.00 0.61 0.02 0.00 0.00 177.57 178.23 3fi0 n GLY 69 N -1.22 -0.20 3.61 2.17 0.00 -1.08 -4.94 105.19 103.53 3fi0 n GLY 69 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.73 3.64 -0.33 -0.61 -1.09 -0.15 -4.74 121.20 117.19 3fi0 s ILE 70 Ca 0.00 0.68 -0.27 0.00 -2.23 0.00 0.00 60.65 58.83 3fi0 s ILE 70 Cb 0.00 -3.80 0.01 0.00 -1.58 0.00 0.00 42.46 37.09 3fi0 s ILE 70 CO 0.00 -0.47 0.97 -0.62 -1.23 0.00 0.00 174.94 173.59 3fi0 s ASP 71 N 5.04 6.80 0.29 3.58 -1.08 -1.26 -4.42 116.67 125.62 3fi0 s ASP 71 Ca 0.73 0.84 0.22 0.00 -0.52 0.00 0.00 52.55 53.82 3fi0 s ASP 71 Cb -0.21 -2.49 1.06 0.00 -1.46 0.00 0.00 42.92 39.82 3fi0 s ASP 71 CO 0.32 -0.81 1.68 -0.81 0.52 0.00 0.00 175.17 176.07 3fi0 n PRO 72 N 6.68 0.16 0.07 4.34 -0.04 -1.26 -1.27 135.00 143.69 3fi0 n PRO 72 Ca 0.09 0.53 0.08 0.00 -0.04 0.00 0.00 63.50 64.16 3fi0 n PRO 72 Cb 0.48 -1.91 -0.04 0.00 -0.04 0.00 0.00 33.50 31.99 3fi0 n PRO 72 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3fi0 n THR 73 N -2.24 0.72 -0.01 0.52 -2.24 -1.26 -4.07 114.28 105.71 3fi0 n THR 73 Ca 0.00 -0.59 0.04 0.00 -2.27 0.00 0.00 64.05 61.24 3fi0 n THR 73 Cb 0.13 -0.41 -0.13 0.00 -2.10 0.00 0.00 70.33 67.82 3fi0 n THR 73 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fi0 n GLN 74 N -2.70 0.65 -4.17 -0.78 1.13 -0.78 -5.00 117.38 105.74 3fi0 n GLN 74 Ca -0.03 -0.02 -0.11 0.00 -1.94 0.00 0.00 57.00 54.90 3fi0 n GLN 74 Cb 0.63 -1.63 -0.10 0.00 0.11 0.00 0.00 30.24 29.26 3fi0 n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fi0 s ALA 75 N -3.14 0.99 -0.30 -1.58 0.00 -0.40 -4.53 121.76 112.80 3fi0 s ALA 75 Ca -0.06 -1.58 -0.09 0.00 0.00 0.00 0.00 51.96 50.23 3fi0 s ALA 75 Cb 0.10 1.23 -0.01 0.00 0.00 0.00 0.00 23.12 24.45 3fi0 s ALA 75 CO 0.85 -0.58 0.13 0.99 0.00 0.00 0.00 175.76 177.15 3fi0 s THR 76 N -4.12 4.46 -0.23 0.00 2.01 -0.31 -4.45 115.64 113.00 3fi0 s THR 76 Ca 0.34 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 61.89 3fi0 s THR 76 Cb 0.07 -3.25 0.02 0.00 0.01 0.00 0.00 72.50 69.34 3fi0 s THR 76 CO 0.09 0.10 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.80 3fi0 s LEU 77 N 1.59 2.86 0.22 4.42 2.96 -1.26 0.14 118.68 129.62 3fi0 s LEU 77 Ca 0.04 -0.78 -0.08 0.00 -0.22 0.00 0.00 54.13 53.10 3fi0 s LEU 77 Cb -0.17 -1.61 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 3fi0 s LEU 77 CO 0.05 -0.08 0.33 0.72 -1.32 0.00 0.00 176.35 176.05 3fi0 s PHE 78 N 1.32 0.66 -0.24 5.38 -0.71 -0.30 -4.14 117.98 119.94 3fi0 s PHE 78 Ca 0.02 -0.97 -0.12 0.00 -1.04 0.00 0.00 56.93 54.82 3fi0 s PHE 78 Cb -0.15 -0.11 -0.05 0.00 -1.21 0.00 0.00 43.02 41.50 3fi0 s PHE 78 CO -0.07 -0.83 0.23 0.42 -1.34 0.00 0.00 175.22 173.63 3fi0 s ILE 79 N -4.06 5.30 0.13 -4.49 1.01 -1.26 -0.52 121.20 117.30 3fi0 s ILE 79 Ca 0.28 0.32 -0.29 0.00 0.00 0.00 0.00 60.65 60.96 3fi0 s ILE 79 Cb 0.03 -3.57 -0.09 0.00 0.01 0.00 0.00 42.46 38.84 3fi0 s ILE 79 CO 0.09 0.29 1.49 -0.61 0.00 0.00 0.00 174.94 176.20 3fi0 h GLN 80 N 7.71 -0.21 0.00 2.79 4.15 -1.00 -0.74 115.11 127.81 3fi0 h GLN 80 Ca -0.36 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.07 3fi0 h GLN 80 Cb 1.17 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.91 3fi0 h GLN 80 CO 0.65 -0.14 0.38 0.66 -1.93 0.00 0.00 178.83 178.44 3fi0 h SER 81 N -0.22 0.00 0.42 -0.69 4.64 -1.95 0.12 113.55 115.87 3fi0 h SER 81 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3fi0 h SER 81 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3fi0 h SER 81 CO -0.66 0.00 -0.11 -0.62 -0.87 0.00 0.00 176.83 174.58 3fi0 n GLU 82 N -2.51 0.59 -3.93 4.77 1.02 -0.28 -4.33 120.64 115.96 3fi0 n GLU 82 Ca -0.01 -0.18 -0.32 0.00 -0.02 0.00 0.00 57.16 56.63 3fi0 n GLU 82 Cb 0.41 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.20 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 -2.53 2.66 0.39 2.62 1.01 0.03 -4.96 120.40 119.61 3fi0 s VAL 83 Ca 0.27 -2.82 0.33 0.00 0.00 0.00 0.00 61.98 59.77 3fi0 s VAL 83 Cb 0.20 -2.87 0.33 0.00 0.00 0.00 0.00 36.38 34.04 3fi0 s VAL 83 CO 0.48 -0.73 2.01 -0.65 0.00 0.00 0.00 175.10 176.22 3fi0 h PRO 84 N 7.10 0.00 0.00 2.72 0.11 -1.80 -2.25 132.00 137.87 3fi0 h PRO 84 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3fi0 h PRO 84 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3fi0 h PRO 84 CO 0.63 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.42 3fi0 h ALA 85 N 1.81 1.00 -0.14 -0.75 0.00 -1.92 -2.34 119.26 116.92 3fi0 h ALA 85 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3fi0 h ALA 85 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3fi0 h ALA 85 CO 0.00 0.00 -0.37 0.45 0.00 0.00 0.00 179.25 179.33 3fi0 h HIS 86 N 0.00 0.65 -0.04 0.00 3.86 -1.73 -2.12 115.15 115.77 3fi0 h HIS 86 Ca 0.00 -0.25 -0.17 0.00 -1.16 0.00 0.00 60.37 58.79 3fi0 h HIS 86 Cb 0.08 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 3fi0 h HIS 86 CO 0.00 0.99 -0.74 0.00 0.86 0.00 0.00 177.93 179.04 3fi0 h ALA 87 N 0.54 0.67 -0.07 2.45 0.00 -1.65 -2.02 119.26 119.17 3fi0 h ALA 87 Ca -0.01 -0.63 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 3fi0 h ALA 87 Cb 0.98 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 3fi0 h ALA 87 CO 0.08 0.81 0.00 1.96 0.00 0.00 0.00 179.25 182.10 3fi0 h GLN 88 N 0.17 0.12 -0.10 0.00 4.20 -1.48 -2.91 115.11 115.11 3fi0 h GLN 88 Ca -0.03 -0.04 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 3fi0 h GLN 88 Cb 1.31 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.06 3fi0 h GLN 88 CO 0.12 0.38 -0.43 0.00 -0.67 0.00 0.00 178.83 178.22 3fi0 h ALA 89 N 0.74 1.09 -0.16 3.87 0.00 -1.43 -2.96 119.26 120.40 3fi0 h ALA 89 Ca 0.02 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 3fi0 h ALA 89 Cb 0.32 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3fi0 h ALA 89 CO 0.00 0.60 -0.17 0.00 0.00 0.00 0.00 179.25 179.69 3fi0 h ALA 90 N 1.37 1.42 0.00 0.00 0.00 -1.34 -1.36 119.26 119.35 3fi0 h ALA 90 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3fi0 h ALA 90 Cb 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3fi0 h ALA 90 CO 0.07 0.40 0.00 1.87 0.00 0.00 0.00 179.25 181.59 3fi0 n TRP 91 N -4.23 0.00 0.00 0.00 -0.00 -1.10 -1.26 117.44 110.85 3fi0 n TRP 91 Ca -0.01 -0.03 0.00 0.00 -0.00 0.00 0.00 57.50 57.46 3fi0 n TRP 91 Cb 0.30 -0.06 0.00 0.00 -0.00 0.00 0.00 31.31 31.55 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 0.38 0.00 -0.00 5.87 4.77 -0.51 -2.36 117.00 125.15 3fi0 n LEU 93 Ca 0.00 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.12 3fi0 n LEU 93 Cb 0.11 0.00 0.63 0.00 -2.33 0.00 0.00 43.42 41.83 3fi0 n LEU 93 CO 0.00 0.00 0.96 0.00 -1.33 0.00 0.00 177.39 177.02 3fi0 n GLN 94 N 0.00 0.03 0.05 3.23 6.02 -0.39 -1.92 117.38 124.40 3fi0 n GLN 94 Ca 0.00 -0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.10 3fi0 n GLN 94 Cb 0.00 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.76 3fi0 n GLN 94 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3fi0 h ILE 96 N 0.00 0.82 -4.05 0.00 1.08 -1.78 -3.48 117.51 110.11 3fi0 h ILE 96 Ca 0.00 -2.63 -0.45 0.00 -0.39 0.00 0.00 64.86 61.39 3fi0 h ILE 96 Cb 0.86 2.46 -0.02 0.00 -3.07 0.00 0.00 36.82 37.05 3fi0 h ILE 96 CO 0.00 0.60 0.33 0.54 -0.69 0.00 0.00 178.15 178.93 3fi0 s VAL 97 N -2.59 4.42 0.06 1.67 0.11 -0.81 -5.07 120.40 118.19 3fi0 s VAL 97 Ca -0.09 1.44 -0.05 0.00 -2.93 0.00 0.00 61.98 60.34 3fi0 s VAL 97 Cb 0.08 -3.61 -0.05 0.00 -1.53 0.00 0.00 36.38 31.27 3fi0 s VAL 97 CO 0.81 -0.34 0.30 -0.31 -3.33 0.00 0.00 175.10 172.24 3fi0 s TYR 98 N -2.20 3.54 0.22 1.54 2.02 -1.26 -4.95 117.35 116.26 3fi0 s TYR 98 Ca 0.61 0.54 -0.09 0.00 -0.37 0.00 0.00 57.07 57.77 3fi0 s TYR 98 Cb -0.09 -1.98 0.25 0.00 -0.40 0.00 0.00 41.96 39.74 3fi0 s TYR 98 CO 0.15 0.55 1.82 0.82 -1.57 0.00 0.00 175.55 177.32 3fi0 h ILE 99 N 2.59 1.01 -0.91 2.71 1.08 -1.97 -1.97 117.51 120.04 3fi0 h ILE 99 Ca -0.48 -0.27 0.12 0.00 -0.39 0.00 0.00 64.86 63.85 3fi0 h ILE 99 Cb 1.18 0.16 -0.07 0.00 -3.07 0.00 0.00 36.82 35.02 3fi0 h ILE 99 CO 0.69 0.14 0.59 1.23 -0.69 0.00 0.00 178.15 180.11 3fi0 h GLY 100 N 0.77 1.33 1.14 5.37 0.00 -1.99 -1.02 103.07 108.68 3fi0 h GLY 100 Ca 0.31 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 47.16 3fi0 h GLY 100 CO -0.17 0.14 -0.22 0.83 0.00 0.00 0.00 176.54 177.12 3fi0 h GLU 101 N 0.82 0.98 -0.27 4.80 5.08 -1.77 -2.31 114.58 121.90 3fi0 h GLU 101 Ca 0.45 -0.42 -0.10 0.00 -1.00 0.00 0.00 59.36 58.29 3fi0 h GLU 101 Cb 0.57 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 3fi0 h GLU 101 CO -0.21 1.09 -0.26 -0.07 -1.00 0.00 0.00 179.01 178.56 3fi0 h LEU 102 N 0.84 0.54 0.00 1.33 3.38 -1.03 -2.91 115.31 117.46 3fi0 h LEU 102 Ca 0.11 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3fi0 h LEU 102 Cb 0.79 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3fi0 h LEU 102 CO 0.07 0.79 -0.01 -0.33 0.09 0.00 0.00 178.44 179.05 3fi0 h GLU 103 N 0.47 0.00 -5.97 1.13 5.08 -1.25 -3.46 114.58 110.58 3fi0 h GLU 103 Ca 0.07 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.87 3fi0 h GLU 103 Cb 0.70 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.87 3fi0 h GLU 103 CO 0.05 0.00 1.52 1.03 -1.00 0.00 0.00 179.01 180.61 3fi0 s ARG 104 N -3.19 3.47 0.00 2.33 0.52 -0.88 -4.98 118.95 116.22 3fi0 s ARG 104 Ca 0.08 -1.19 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 3fi0 s ARG 104 Cb 0.06 -5.35 0.00 0.00 0.52 0.00 0.00 34.95 30.18 3fi0 s ARG 104 CO 0.66 -2.48 0.00 2.41 0.02 0.00 0.00 175.30 175.91 3fi0 n THR 106 N 6.97 0.00 0.00 0.02 -1.04 -1.26 -5.09 114.28 113.88 3fi0 n THR 106 Ca 0.38 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.39 3fi0 n THR 106 Cb 0.49 0.17 0.00 0.00 -1.82 0.00 0.00 70.33 69.17 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 -0.64 1.20 0.00 -2.82 3.00 -1.26 -5.30 117.38 111.56 3fi0 n GLN 107 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3fi0 n GLN 107 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.25 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 -0.54 0.00 -1.73 5.09 0.31 -1.26 -5.11 118.33 115.10 3fi0 n VAL 118 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 3fi0 n VAL 118 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 3.07 0.30 4.52 3.41 -1.26 -4.85 113.62 118.81 3fi0 n SER 119 Ca 0.00 1.19 0.17 0.00 -0.26 0.00 0.00 58.87 59.97 3fi0 n SER 119 Cb 0.00 -1.54 0.96 0.00 -0.26 0.00 0.00 64.21 63.37 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 2.55 1.24 -0.31 7.33 0.00 -2.02 -2.92 119.26 125.13 3fi0 h ALA 120 Ca -0.48 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.41 3fi0 h ALA 120 Cb 1.27 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3fi0 h ALA 120 CO 0.62 0.04 0.21 0.78 0.00 0.00 0.00 179.25 180.90 3fi0 h GLY 121 N 0.38 0.40 2.00 0.00 0.00 -1.88 -0.79 103.07 103.18 3fi0 h GLY 121 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 3fi0 h GLY 121 CO 0.00 0.14 0.00 1.41 0.00 0.00 0.00 176.54 178.09 3fi0 h LEU 122 N 0.38 0.00 0.01 3.11 -0.00 -1.76 -1.09 115.31 115.95 3fi0 h LEU 122 Ca 0.12 0.00 -0.38 0.00 -0.00 0.00 0.00 57.88 57.63 3fi0 h LEU 122 Cb 0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.62 3fi0 h LEU 122 CO -0.03 0.00 -2.38 -0.11 -0.00 0.00 0.00 178.44 175.92 3fi0 n LEU 123 N -2.89 1.47 -0.93 1.67 7.94 -0.41 -4.63 117.00 119.21 3fi0 n LEU 123 Ca -0.00 -0.03 0.09 0.00 -1.11 0.00 0.00 56.01 54.95 3fi0 n LEU 123 Cb 0.22 -0.21 0.19 0.00 0.53 0.00 0.00 43.42 44.16 3fi0 n LEU 123 CO 0.23 0.70 0.66 0.35 -1.11 0.00 0.00 177.39 178.22 3fi0 n THR 124 N -3.02 0.71 0.26 1.96 -2.24 -0.55 -4.48 114.28 106.92 3fi0 n THR 124 Ca -0.38 -0.85 0.15 0.00 -2.27 0.00 0.00 64.05 60.70 3fi0 n THR 124 Cb 1.08 0.76 0.61 0.00 -2.10 0.00 0.00 70.33 70.67 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 3.31 0.00 -0.78 4.78 -0.00 -1.45 -3.30 116.97 119.52 3fi0 h TYR 125 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 58.73 58.76 3fi0 h TYR 125 Cb 0.83 0.00 -0.05 0.00 0.00 0.00 0.00 36.73 37.52 3fi0 h TYR 125 CO 0.26 0.06 0.50 -1.35 -0.00 0.00 0.00 178.16 177.63 3fi0 h PRO 126 N 0.00 0.95 0.00 0.10 0.11 -1.86 -1.40 132.00 129.89 3fi0 h PRO 126 Ca -0.00 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3fi0 h PRO 126 Cb 0.59 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.48 3fi0 h PRO 126 CO 0.01 0.63 0.00 -1.35 -0.21 0.00 0.00 178.00 177.08 3fi0 h PRO 127 N 0.98 0.00 -1.00 1.05 0.11 -1.91 -1.52 132.00 129.71 3fi0 h PRO 127 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 3fi0 h PRO 127 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3fi0 h PRO 127 CO -0.11 0.00 0.00 -0.11 -0.21 0.00 0.00 178.00 177.57 3fi0 n LEU 128 N -2.84 2.10 0.00 2.35 7.94 -0.53 -1.87 117.00 124.15 3fi0 n LEU 128 Ca 0.00 -1.05 0.00 0.00 -1.11 0.00 0.00 56.01 53.85 3fi0 n LEU 128 Cb 0.22 -0.50 0.00 0.00 0.53 0.00 0.00 43.42 43.67 3fi0 n LEU 128 CO 0.23 0.39 0.00 0.00 -1.11 0.00 0.00 177.39 176.89 3fi0 n ALA 130 N 0.28 0.00 -0.08 1.96 0.00 -0.57 -0.41 120.51 121.70 3fi0 n ALA 130 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 3fi0 n ALA 130 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.82 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 0.34 -0.70 0.00 0.00 -1.64 0.63 119.26 117.90 3fi0 h ALA 131 Ca 0.00 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 3fi0 h ALA 131 Cb 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.62 3fi0 h ALA 131 CO 0.00 -0.23 -0.55 -0.44 0.00 0.00 0.00 179.25 178.04 3fi0 h ASP 132 N 0.32 -1.92 0.80 0.00 3.32 -1.01 0.35 116.42 118.29 3fi0 h ASP 132 Ca 0.11 0.28 -0.04 0.00 0.02 0.00 0.00 57.03 57.40 3fi0 h ASP 132 Cb 0.01 0.83 0.01 0.00 0.22 0.00 0.00 39.33 40.40 3fi0 h ASP 132 CO -0.06 -0.32 -0.38 0.40 -1.72 0.00 0.00 179.24 177.16 3fi0 h ILE 133 N -0.19 0.00 -0.57 0.35 2.04 -1.71 -3.31 117.51 114.11 3fi0 h ILE 133 Ca 0.14 -0.21 0.11 0.00 1.00 0.00 0.00 64.86 65.90 3fi0 h ILE 133 Cb 0.52 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.56 3fi0 h ILE 133 CO -0.77 0.00 0.39 -0.07 0.00 0.00 0.00 178.15 177.70 3fi0 h LEU 134 N -1.29 0.26 -1.87 1.44 3.38 0.50 -2.85 115.31 114.88 3fi0 h LEU 134 Ca -0.11 0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.07 3fi0 h LEU 134 Cb 0.82 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 3fi0 h LEU 134 CO 0.18 0.15 0.53 -0.07 0.09 0.00 0.00 178.44 179.32 3fi0 h LEU 135 N 0.29 0.11 -3.05 1.67 3.38 -1.01 -2.50 115.31 114.20 3fi0 h LEU 135 Ca 0.27 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3fi0 h LEU 135 Cb 0.67 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3fi0 h LEU 135 CO -0.06 0.05 0.00 -1.22 0.09 0.00 0.00 178.44 177.30 3fi0 n TYR 136 N -4.37 1.03 -3.74 1.13 4.01 -1.08 -4.43 117.16 109.71 3fi0 n TYR 136 Ca 0.15 -0.61 -0.28 0.00 -0.16 0.00 0.00 57.90 56.99 3fi0 n TYR 136 Cb 0.75 -0.17 0.03 0.00 -0.31 0.00 0.00 39.34 39.64 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 0.70 -4.90 -4.77 7.72 4.13 -0.94 -4.89 115.26 112.32 3fi0 n ASN 137 Ca 0.21 -0.67 -0.39 0.00 1.68 0.00 0.00 54.58 55.41 3fi0 n ASN 137 Cb 0.72 -3.92 -0.02 0.00 -1.54 0.00 0.00 39.78 35.02 3fi0 n ASN 137 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 3fi0 s THR 138 N -3.23 2.96 -0.21 3.41 -4.23 -1.25 -4.68 115.64 108.41 3fi0 s THR 138 Ca 0.60 0.87 0.05 0.00 -1.18 0.00 0.00 61.69 62.03 3fi0 s THR 138 Cb -0.30 -3.52 -0.21 0.00 1.34 0.00 0.00 72.50 69.81 3fi0 s THR 138 CO 0.74 0.14 -0.00 0.47 -0.54 0.00 0.00 174.62 175.43 3fi0 n ASP 139 N 0.40 1.46 -4.23 3.99 8.00 -0.25 -4.32 116.55 121.60 3fi0 n ASP 139 Ca 0.02 -0.01 -0.26 0.00 0.71 0.00 0.00 54.79 55.25 3fi0 n ASP 139 Cb 0.44 -0.12 -0.15 0.00 -0.02 0.00 0.00 41.12 41.27 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 1.62 -0.20 0.53 1.01 -0.60 -0.92 121.20 120.11 3fi0 s ILE 140 Ca -0.25 -1.00 0.00 0.00 0.00 0.00 0.00 60.65 59.40 3fi0 s ILE 140 Cb 0.08 -1.37 0.05 0.00 0.01 0.00 0.00 42.46 41.22 3fi0 s ILE 140 CO 0.70 0.35 -0.07 -0.69 0.00 0.00 0.00 174.94 175.22 3fi0 s VAL 141 N -0.61 1.44 -1.06 2.92 1.01 0.27 -2.40 120.40 121.97 3fi0 s VAL 141 Ca 0.08 -0.94 -0.22 0.00 0.00 0.00 0.00 61.98 60.89 3fi0 s VAL 141 Cb -0.08 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.73 3fi0 s VAL 141 CO 0.00 0.08 1.61 -2.16 0.00 0.00 0.00 175.10 174.64 3fi0 s PRO 142 N 1.47 3.43 0.04 2.72 0.04 -1.24 -1.09 135.00 140.38 3fi0 s PRO 142 Ca -0.02 -1.15 0.01 0.00 0.04 0.00 0.00 61.00 59.88 3fi0 s PRO 142 Cb -0.17 -5.34 -0.03 0.00 0.04 0.00 0.00 34.50 29.01 3fi0 s PRO 142 CO -0.08 -2.51 -0.05 0.14 0.04 0.00 0.00 177.00 174.55 3fi0 s VAL 143 N 6.01 0.31 0.00 -0.36 -7.23 -1.26 -4.84 120.40 113.04 3fi0 s VAL 143 Ca 0.53 -1.20 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 3fi0 s VAL 143 Cb -0.00 -0.70 0.00 0.00 0.56 0.00 0.00 36.38 36.24 3fi0 s VAL 143 CO -0.04 -0.58 0.00 0.61 -0.31 0.00 0.00 175.10 174.78 3fi0 n GLY 144 N 1.16 -3.64 0.11 2.32 0.00 -1.26 -4.62 105.19 99.26 3fi0 n GLY 144 Ca -0.21 -1.20 0.12 0.00 0.00 0.00 0.00 46.02 44.73 3fi0 n GLY 144 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3fi0 h GLU 145 N 0.00 0.00 -0.03 1.61 4.39 -2.01 -3.24 114.58 115.29 3fi0 h GLU 145 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3fi0 h GLU 145 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3fi0 h GLU 145 CO 0.00 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 177.45 3fi0 n ASP 146 N -2.38 0.62 -0.00 1.42 5.75 -1.26 -3.47 116.55 117.23 3fi0 n ASP 146 Ca 0.04 -1.34 0.03 0.00 -0.01 0.00 0.00 54.79 53.51 3fi0 n ASP 146 Cb 0.47 -0.02 -0.05 0.00 -1.03 0.00 0.00 41.12 40.49 3fi0 n ASP 146 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3fi0 n GLN 147 N -0.46 2.44 -0.17 0.11 1.13 -1.22 -4.64 117.38 114.56 3fi0 n GLN 147 Ca 0.19 -0.03 0.23 0.00 -1.94 0.00 0.00 57.00 55.44 3fi0 n GLN 147 Cb 0.19 -1.00 0.62 0.00 0.11 0.00 0.00 30.24 30.16 3fi0 n GLN 147 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 3fi0 h LYS 148 N 0.00 0.18 -0.28 -1.09 2.10 -1.68 0.74 116.57 116.54 3fi0 h LYS 148 Ca 0.00 -0.01 -0.07 0.00 -2.00 0.00 0.00 60.65 58.57 3fi0 h LYS 148 Cb 0.24 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.52 3fi0 h LYS 148 CO 0.00 0.12 -0.13 0.37 -2.00 0.00 0.00 179.45 177.81 3fi0 h GLN 149 N 0.19 0.48 0.00 0.07 4.15 -1.82 0.17 115.11 118.35 3fi0 h GLN 149 Ca 0.41 -0.14 -0.02 0.00 0.77 0.00 0.00 58.65 59.67 3fi0 h GLN 149 Cb 1.33 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.96 3fi0 h GLN 149 CO -0.08 0.61 -0.11 0.45 -1.93 0.00 0.00 178.83 177.76 3fi0 h HIS 150 N 0.45 0.00 0.13 3.99 3.86 0.12 -2.94 115.15 120.76 3fi0 h HIS 150 Ca 0.08 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 59.00 3fi0 h HIS 150 Cb 0.49 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.96 3fi0 h HIS 150 CO 0.02 0.11 -1.51 0.82 0.86 0.00 0.00 177.93 178.23 3fi0 h ILE 151 N 0.00 1.00 -0.74 2.45 1.08 -0.04 -2.99 117.51 118.27 3fi0 h ILE 151 Ca -0.00 -2.43 0.03 0.00 -0.39 0.00 0.00 64.86 62.07 3fi0 h ILE 151 Cb 0.89 2.73 -0.04 0.00 -3.07 0.00 0.00 36.82 37.32 3fi0 h ILE 151 CO 0.01 0.75 0.49 -0.33 -0.69 0.00 0.00 178.15 178.39 3fi0 h GLU 152 N -0.19 0.90 -0.15 2.37 4.39 -0.77 0.24 114.58 121.37 3fi0 h GLU 152 Ca -0.32 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.30 3fi0 h GLU 152 Cb 1.85 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 30.29 3fi0 h GLU 152 CO 0.09 0.60 -0.03 1.25 -1.16 0.00 0.00 179.01 179.75 3fi0 h LEU 153 N 0.93 0.29 -1.37 1.33 5.85 -1.62 0.16 115.31 120.88 3fi0 h LEU 153 Ca 0.29 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.58 3fi0 h LEU 153 Cb 0.01 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3fi0 h LEU 153 CO -0.08 0.59 -0.30 0.00 -0.34 0.00 0.00 178.44 178.30 3fi0 h THR 154 N -0.02 1.03 -0.32 1.05 1.03 -1.28 0.25 112.91 114.64 3fi0 h THR 154 Ca 0.04 -1.11 -0.14 0.00 -0.01 0.00 0.00 66.41 65.19 3fi0 h THR 154 Cb 0.46 1.63 -0.00 0.00 -1.07 0.00 0.00 68.15 69.17 3fi0 h THR 154 CO 0.01 0.30 -0.33 0.03 -0.01 0.00 0.00 175.52 175.52 3fi0 h ARG 155 N 0.00 0.79 -0.33 0.00 3.08 -0.31 -1.42 114.38 116.20 3fi0 h ARG 155 Ca -0.00 -0.42 -0.06 0.00 0.07 0.00 0.00 59.98 59.57 3fi0 h ARG 155 Cb 0.61 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 3fi0 h ARG 155 CO 0.04 1.05 -0.01 -0.44 -1.07 0.00 0.00 179.97 179.54 3fi0 h ASP 156 N 0.56 0.58 -0.73 7.04 3.32 -0.09 -2.19 116.42 124.91 3fi0 h ASP 156 Ca 0.05 -0.32 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 3fi0 h ASP 156 Cb 0.91 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 3fi0 h ASP 156 CO 0.08 0.75 0.34 -0.07 -1.72 0.00 0.00 179.24 178.62 3fi0 h LEU 157 N 0.38 0.97 -0.11 1.55 3.38 -0.49 -0.61 115.31 120.38 3fi0 h LEU 157 Ca 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3fi0 h LEU 157 Cb 0.46 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3fi0 h LEU 157 CO 0.02 0.84 0.03 0.00 0.09 0.00 0.00 178.44 179.41 3fi0 h ALA 158 N 1.17 0.14 -0.53 1.53 0.00 -1.21 -2.43 119.26 117.92 3fi0 h ALA 158 Ca 0.25 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3fi0 h ALA 158 Cb 0.14 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 3fi0 h ALA 158 CO -0.03 -0.22 0.24 1.49 0.00 0.00 0.00 179.25 180.73 3fi0 h GLU 159 N -0.03 0.45 -0.94 0.00 4.81 -1.21 -0.13 114.58 117.52 3fi0 h GLU 159 Ca 0.03 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3fi0 h GLU 159 Cb 0.26 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.49 3fi0 h GLU 159 CO 0.00 0.29 0.62 -0.09 -0.73 0.00 0.00 179.01 179.10 3fi0 h ARG 160 N 0.46 1.25 -0.16 1.92 2.43 -0.99 -1.45 114.38 117.83 3fi0 h ARG 160 Ca 0.25 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.21 3fi0 h ARG 160 Cb 0.21 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3fi0 h ARG 160 CO -0.21 0.83 -0.38 0.35 -1.51 0.00 0.00 179.97 179.06 3fi0 h PHE 161 N 1.28 0.69 0.00 2.20 3.57 -1.00 -2.66 116.94 121.02 3fi0 h PHE 161 Ca 0.34 -0.26 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 3fi0 h PHE 161 Cb -0.14 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 3fi0 h PHE 161 CO 0.00 1.01 -0.04 -0.91 -2.23 0.00 0.00 178.31 176.14 3fi0 h ASN 162 N 0.18 0.00 0.43 0.41 2.35 -0.63 -1.61 115.58 116.72 3fi0 h ASN 162 Ca -0.00 0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.44 3fi0 h ASN 162 Cb 0.99 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.38 3fi0 h ASN 162 CO 0.08 0.04 -1.38 0.11 -1.65 0.00 0.00 177.43 174.63 3fi0 h LYS 163 N 0.00 0.42 0.26 0.81 1.57 -1.24 -2.95 116.57 115.44 3fi0 h LYS 163 Ca -0.00 -0.72 -0.01 0.00 -1.87 0.00 0.00 60.65 58.05 3fi0 h LYS 163 Cb 0.07 0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3fi0 h LYS 163 CO 0.00 1.34 -0.12 -0.09 -0.57 0.00 0.00 179.45 180.02 3fi0 h ARG 164 N 0.11 -0.33 0.00 3.15 1.12 -0.96 -3.41 114.38 114.07 3fi0 h ARG 164 Ca -0.20 0.02 -0.32 0.00 -1.11 0.00 0.00 59.98 58.37 3fi0 h ARG 164 Cb 2.08 0.08 -0.06 0.00 -0.01 0.00 0.00 29.97 32.06 3fi0 h ARG 164 CO 0.24 0.03 -2.19 0.66 -3.11 0.00 0.00 179.97 175.60 3fi0 n TYR 165 N -5.05 0.00 0.00 2.20 4.01 -0.70 -5.11 117.16 112.51 3fi0 n TYR 165 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 3fi0 n TYR 165 Cb 0.26 -0.80 0.00 0.00 -0.31 0.00 0.00 39.34 38.49 3fi0 n TYR 165 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fi0 n GLY 166 N 2.43 2.27 3.53 2.72 0.00 -1.11 -5.07 105.19 109.96 3fi0 n GLY 166 Ca -0.37 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 3fi0 n GLY 166 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fi0 s GLU 167 N -1.70 3.46 -0.20 1.61 0.41 -1.26 -4.20 118.70 116.82 3fi0 s GLU 167 Ca 0.00 -1.01 -0.05 0.00 -0.41 0.00 0.00 54.97 53.51 3fi0 s GLU 167 Cb 0.00 -4.93 -0.11 0.00 -1.78 0.00 0.00 34.13 27.32 3fi0 s GLU 167 CO 0.00 -2.09 -0.22 -0.11 -0.49 0.00 0.00 175.26 172.35 3fi0 n LEU 168 N 8.50 2.21 -4.69 1.80 7.94 -1.26 -5.03 117.00 126.47 3fi0 n LEU 168 Ca 0.22 0.08 -0.35 0.00 -1.11 0.00 0.00 56.01 54.85 3fi0 n LEU 168 Cb 0.50 -0.65 -0.09 0.00 0.53 0.00 0.00 43.42 43.71 3fi0 n LEU 168 CO 0.64 0.63 -0.29 -0.36 -1.11 0.00 0.00 177.39 176.90 3fi0 s PHE 169 N -2.39 3.21 -0.52 1.96 0.08 -1.26 -5.01 117.98 114.06 3fi0 s PHE 169 Ca -0.28 0.19 -0.21 0.00 0.12 0.00 0.00 56.93 56.75 3fi0 s PHE 169 Cb 0.09 -1.84 0.05 0.00 -0.57 0.00 0.00 43.02 40.75 3fi0 s PHE 169 CO 0.41 0.44 0.75 0.95 -0.10 0.00 0.00 175.22 177.67 3fi0 s THR 170 N -0.71 4.69 0.15 0.64 -4.23 -1.26 -4.98 115.64 109.94 3fi0 s THR 170 Ca 0.11 -0.17 -0.32 0.00 -1.18 0.00 0.00 61.69 60.13 3fi0 s THR 170 Cb -0.12 -4.38 -0.12 0.00 1.34 0.00 0.00 72.50 69.22 3fi0 s THR 170 CO 0.02 -0.91 1.74 -0.38 -0.54 0.00 0.00 174.62 174.55 3fi0 n ILE 171 N 5.85 0.15 -2.34 2.99 2.08 -1.26 -4.57 119.36 122.27 3fi0 n ILE 171 Ca -0.03 -0.03 -0.27 0.00 0.56 0.00 0.00 62.75 62.98 3fi0 n ILE 171 Cb 0.46 -1.93 0.03 0.00 -0.75 0.00 0.00 39.64 37.45 3fi0 n ILE 171 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 3fi0 s PRO 172 N 1.79 2.94 0.01 0.38 0.04 -1.26 -4.88 135.00 134.02 3fi0 s PRO 172 Ca 0.79 0.07 -0.04 0.00 0.04 0.00 0.00 61.00 61.86 3fi0 s PRO 172 Cb -0.54 -2.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.75 3fi0 s PRO 172 CO 0.36 -0.72 0.07 -2.00 0.04 0.00 0.00 177.00 174.74 3fi0 s GLU 173 N -5.03 0.39 -0.39 4.56 2.12 -0.10 -4.89 118.70 115.35 3fi0 s GLU 173 Ca 0.54 -0.46 0.04 0.00 0.36 0.00 0.00 54.97 55.45 3fi0 s GLU 173 Cb -0.11 0.15 0.11 0.00 0.26 0.00 0.00 34.13 34.55 3fi0 s GLU 173 CO 0.46 -0.08 0.12 0.00 -0.54 0.00 0.00 175.26 175.21 3fi0 s ALA 174 N -1.33 2.94 -0.26 6.30 0.00 -1.26 0.97 121.76 129.11 3fi0 s ALA 174 Ca -0.14 -2.71 -0.25 0.00 0.00 0.00 0.00 51.96 48.85 3fi0 s ALA 174 Cb -0.08 -2.01 0.07 0.00 0.00 0.00 0.00 23.12 21.10 3fi0 s ALA 174 CO 0.00 -1.79 0.74 -0.98 0.00 0.00 0.00 175.76 173.73 3fi0 s ARG 175 N 0.58 0.83 -0.26 0.00 1.70 -0.25 -4.87 118.95 116.67 3fi0 s ARG 175 Ca 0.13 0.94 -0.20 0.00 -0.47 0.00 0.00 55.73 56.13 3fi0 s ARG 175 Cb -0.21 0.40 -0.02 0.00 -0.57 0.00 0.00 34.95 34.55 3fi0 s ARG 175 CO -0.06 -0.11 0.61 0.42 -1.08 0.00 0.00 175.30 175.08 3fi0 s ILE 176 N 0.30 4.99 0.36 4.99 1.01 -1.26 -3.62 121.20 127.97 3fi0 s ILE 176 Ca -0.00 1.05 -0.23 0.00 0.00 0.00 0.00 60.65 61.46 3fi0 s ILE 176 Cb -0.05 -3.92 -0.10 0.00 0.01 0.00 0.00 42.46 38.40 3fi0 s ILE 176 CO 0.01 0.02 0.93 -2.84 0.00 0.00 0.00 174.94 173.06 3fi0 s PRO 177 N 2.48 4.41 -1.51 2.79 0.02 -1.26 -3.57 135.00 138.35 3fi0 s PRO 177 Ca 0.25 1.20 -0.05 0.00 0.02 0.00 0.00 61.00 62.43 3fi0 s PRO 177 Cb -0.15 -2.53 0.04 0.00 0.02 0.00 0.00 34.50 31.88 3fi0 s PRO 177 CO 0.09 0.15 0.42 1.63 -0.33 0.00 0.00 177.00 178.96 3fi0 n LYS 178 N 0.03 -2.73 -1.70 5.54 4.76 -1.26 -4.76 118.16 118.04 3fi0 n LYS 178 Ca 0.04 0.33 -0.44 0.00 -2.87 0.00 0.00 58.31 55.37 3fi0 n LYS 178 Cb 0.52 -4.47 -0.03 0.00 -1.84 0.00 0.00 35.03 29.21 3fi0 n LYS 178 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3fi0 n VAL 179 N -4.43 0.05 -1.16 -0.18 0.31 -1.23 -4.83 118.33 106.86 3fi0 n VAL 179 Ca -0.22 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3fi0 n VAL 179 Cb 0.64 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 3fi0 n VAL 179 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fi0 n GLY 180 N 3.67 0.04 3.96 2.92 0.00 -0.96 -5.08 105.19 109.74 3fi0 n GLY 180 Ca 0.16 -1.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.16 3fi0 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fi0 s ALA 181 N -3.32 3.80 -0.82 4.61 0.00 -1.25 -4.84 121.76 119.94 3fi0 s ALA 181 Ca 0.00 -1.21 -0.17 0.00 0.00 0.00 0.00 51.96 50.59 3fi0 s ALA 181 Cb 0.00 -2.14 0.16 0.00 0.00 0.00 0.00 23.12 21.14 3fi0 s ALA 181 CO 0.00 -0.67 0.90 -0.98 0.00 0.00 0.00 175.76 175.01 3fi0 s ARG 182 N -4.73 3.50 0.87 0.00 1.04 -1.26 -4.51 118.95 113.86 3fi0 s ARG 182 Ca 0.55 -1.98 -0.13 0.00 -1.04 0.00 0.00 55.73 53.13 3fi0 s ARG 182 Cb -0.10 -4.59 0.13 0.00 -2.04 0.00 0.00 34.95 28.35 3fi0 s ARG 182 CO 0.39 -1.53 1.24 0.42 -0.04 0.00 0.00 175.30 175.78 3fi0 s ILE 183 N 1.62 2.01 -0.12 4.99 -1.09 -1.26 -5.05 121.20 122.30 3fi0 s ILE 183 Ca 0.22 -0.02 -0.06 0.00 -2.23 0.00 0.00 60.65 58.57 3fi0 s ILE 183 Cb -0.11 -2.99 -0.04 0.00 -1.58 0.00 0.00 42.46 37.74 3fi0 s ILE 183 CO -0.06 0.00 0.08 -0.94 -1.23 0.00 0.00 174.94 172.79 3fi0 s SER 185 N -4.72 5.90 0.52 3.58 1.04 -0.75 -4.61 113.70 114.67 3fi0 s SER 185 Ca 0.67 0.30 0.19 0.00 0.48 0.00 0.00 55.95 57.59 3fi0 s SER 185 Cb -0.08 -1.86 1.31 0.00 0.10 0.00 0.00 66.02 65.49 3fi0 s SER 185 CO 0.51 0.36 2.10 -0.07 0.98 0.00 0.00 173.24 177.12 3fi0 h LEU 186 N 5.36 0.00 0.00 2.42 3.38 0.10 -2.97 115.31 123.60 3fi0 h LEU 186 Ca -0.50 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.09 3fi0 h LEU 186 Cb 1.20 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.89 3fi0 h LEU 186 CO 0.59 0.00 -2.38 1.33 0.09 0.00 0.00 178.44 178.07 3fi0 n VAL 187 N -4.49 1.45 -3.86 1.22 0.24 -1.26 -4.75 118.33 106.87 3fi0 n VAL 187 Ca 0.01 -0.74 -0.36 0.00 -2.04 0.00 0.00 64.34 61.21 3fi0 n VAL 187 Cb 0.25 -0.90 -0.13 0.00 -1.47 0.00 0.00 33.84 31.58 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 -5.97 4.94 0.59 -1.34 -1.08 -1.12 -4.98 116.67 107.71 3fi0 s ASP 188 Ca -0.20 -1.13 0.29 0.00 -0.52 0.00 0.00 52.55 50.99 3fi0 s ASP 188 Cb 0.07 -1.76 1.61 0.00 -1.46 0.00 0.00 42.92 41.39 3fi0 s ASP 188 CO 0.74 -0.25 2.05 -0.65 0.52 0.00 0.00 175.17 177.57 3fi0 h PRO 189 N 8.08 0.00 0.00 4.34 0.11 -1.86 -2.73 132.00 139.94 3fi0 h PRO 189 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3fi0 h PRO 189 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3fi0 h PRO 189 CO 0.56 0.00 -1.09 2.41 -0.21 0.00 0.00 178.00 179.67 3fi0 n THR 190 N -3.77 0.30 -2.92 -1.15 -1.04 -1.26 -4.72 114.28 99.73 3fi0 n THR 190 Ca 0.03 -0.37 -0.27 0.00 -2.04 0.00 0.00 64.05 61.40 3fi0 n THR 190 Cb 0.41 -0.02 -0.01 0.00 -1.82 0.00 0.00 70.33 68.89 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 -3.28 3.56 0.00 -2.82 2.20 -1.03 -4.99 119.74 113.38 3fi0 s LYS 191 Ca 0.01 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.70 3fi0 s LYS 191 Cb 0.13 -2.48 0.00 0.00 -1.51 0.00 0.00 37.83 33.97 3fi0 s LYS 191 CO 0.80 -0.06 0.00 1.17 -0.36 0.00 0.00 175.35 176.90 3fi0 n LYS 192 N -1.91 0.00 -3.55 4.03 0.00 -1.26 -1.80 118.16 113.67 3fi0 n LYS 192 Ca -0.01 0.15 0.01 0.00 0.00 0.00 0.00 58.31 58.46 3fi0 n LYS 192 Cb 0.55 -0.56 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 3fi0 n LYS 192 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3fi0 s SER 194 N -2.44 -0.29 0.45 3.14 0.15 -1.26 -4.57 113.70 108.87 3fi0 s SER 194 Ca 0.00 0.45 0.29 0.00 0.70 0.00 0.00 55.95 57.39 3fi0 s SER 194 Cb 0.00 1.19 1.11 0.00 -1.71 0.00 0.00 66.02 66.61 3fi0 s SER 194 CO 0.00 -0.07 1.86 0.07 1.20 0.00 0.00 173.24 176.30 3fi0 h LYS 195 N 6.07 0.00 -3.84 5.44 2.10 -1.99 -3.18 116.57 121.17 3fi0 h LYS 195 Ca -0.24 0.00 -0.75 0.00 -2.00 0.00 0.00 60.65 57.66 3fi0 h LYS 195 Cb 1.16 0.00 -0.16 0.00 -0.90 0.00 0.00 32.23 32.33 3fi0 h LYS 195 CO 0.18 0.00 1.81 0.43 -2.00 0.00 0.00 179.45 179.86 3fi0 n SER 196 N -2.84 5.16 -3.99 7.07 7.64 -1.26 -4.98 113.62 120.42 3fi0 n SER 196 Ca 0.02 -3.08 -0.18 0.00 1.01 0.00 0.00 58.87 56.63 3fi0 n SER 196 Cb 0.33 -1.50 -0.15 0.00 -1.01 0.00 0.00 64.21 61.88 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 1.35 0.94 -0.01 6.43 -1.08 -1.20 -5.06 116.67 118.04 3fi0 s ASP 197 Ca 0.40 -0.14 0.14 0.00 -0.52 0.00 0.00 52.55 52.43 3fi0 s ASP 197 Cb 0.06 -0.15 -0.20 0.00 -1.46 0.00 0.00 42.92 41.17 3fi0 s ASP 197 CO 0.01 0.08 0.73 -0.65 0.52 0.00 0.00 175.17 175.85 3fi0 h PRO 198 N 6.08 0.00 -5.60 4.34 0.11 -1.93 -3.39 132.00 131.61 3fi0 h PRO 198 Ca -0.31 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.18 3fi0 h PRO 198 Cb 1.18 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.16 3fi0 h PRO 198 CO 0.50 0.44 0.24 1.21 -0.21 0.00 0.00 178.00 180.17 3fi0 s ASN 199 N -6.01 6.47 0.22 -2.05 3.04 -1.26 -4.96 114.94 110.40 3fi0 s ASN 199 Ca -0.04 0.21 0.24 0.00 0.04 0.00 0.00 52.86 53.32 3fi0 s ASN 199 Cb 0.08 -2.35 0.92 0.00 -1.54 0.00 0.00 41.25 38.36 3fi0 s ASN 199 CO 0.82 -0.65 1.73 -0.81 -3.04 0.00 0.00 177.10 175.14 3fi0 n PRO 200 N 6.20 0.20 0.13 0.43 -0.04 -1.26 -1.82 135.00 138.84 3fi0 n PRO 200 Ca 0.00 0.34 0.12 0.00 -0.04 0.00 0.00 63.50 63.92 3fi0 n PRO 200 Cb 0.48 -1.82 0.50 0.00 -0.04 0.00 0.00 33.50 32.62 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 -2.18 0.18 0.10 0.54 5.02 -1.26 -3.17 118.16 117.39 3fi0 n LYS 201 Ca 0.03 0.46 -0.04 0.00 -2.02 0.00 0.00 58.31 56.74 3fi0 n LYS 201 Cb 0.29 -1.88 0.02 0.00 -0.02 0.00 0.00 35.03 33.45 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 2.23 0.64 -1.88 7.82 0.00 -1.73 -3.39 119.26 122.94 3fi0 h ALA 202 Ca 0.00 -0.72 -0.55 0.00 0.00 0.00 0.00 54.91 53.64 3fi0 h ALA 202 Cb 0.30 -0.13 -0.13 0.00 0.00 0.00 0.00 17.79 17.83 3fi0 h ALA 202 CO 0.00 0.99 -0.62 1.52 0.00 0.00 0.00 179.25 181.14 3fi0 s TYR 203 N -3.11 2.22 -0.03 0.00 -0.85 -1.19 0.14 117.35 114.53 3fi0 s TYR 203 Ca 0.00 -0.78 0.04 0.00 -0.52 0.00 0.00 57.07 55.81 3fi0 s TYR 203 Cb 0.11 -1.47 -0.00 0.00 0.38 0.00 0.00 41.96 40.98 3fi0 s TYR 203 CO 0.79 0.26 -0.14 0.42 -1.52 0.00 0.00 175.55 175.36 3fi0 s ILE 204 N -2.98 1.15 0.11 -3.49 1.01 -1.26 -4.98 121.20 110.76 3fi0 s ILE 204 Ca 0.35 -0.58 0.02 0.00 0.00 0.00 0.00 60.65 60.44 3fi0 s ILE 204 Cb 0.08 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 3fi0 s ILE 204 CO 0.16 0.33 0.21 -0.89 0.00 0.00 0.00 174.94 174.76 3fi0 s THR 205 N -0.04 5.14 -0.11 2.92 2.01 -1.26 -1.91 115.64 122.38 3fi0 s THR 205 Ca -0.00 -0.65 0.29 0.00 0.31 0.00 0.00 61.69 61.64 3fi0 s THR 205 Cb -0.09 -3.58 0.31 0.00 0.01 0.00 0.00 72.50 69.16 3fi0 s THR 205 CO 0.01 0.01 1.87 -0.07 -0.69 0.00 0.00 174.62 175.75 3fi0 h LEU 206 N 2.63 0.00 -1.13 4.42 3.38 -2.00 -1.99 115.31 120.62 3fi0 h LEU 206 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3fi0 h LEU 206 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3fi0 h LEU 206 CO 0.70 0.00 -0.27 0.18 0.09 0.00 0.00 178.44 179.14 3fi0 n LEU 207 N -2.61 1.94 -4.66 1.67 4.77 -1.26 -4.67 117.00 112.19 3fi0 n LEU 207 Ca 0.00 -0.83 -0.41 0.00 -0.03 0.00 0.00 56.01 54.75 3fi0 n LEU 207 Cb 0.20 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.30 3fi0 n LEU 207 CO 0.20 0.36 0.74 0.47 -1.33 0.00 0.00 177.39 177.84 3fi0 n ASP 208 N 0.20 1.94 -4.90 -1.43 8.00 -0.75 -4.96 116.55 114.65 3fi0 n ASP 208 Ca 0.08 1.07 -0.28 0.00 0.71 0.00 0.00 54.79 56.38 3fi0 n ASP 208 Cb 0.40 -1.43 0.02 0.00 -0.02 0.00 0.00 41.12 40.08 3fi0 n ASP 208 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 3fi0 s ASP 209 N -0.64 5.96 0.29 -2.24 1.47 -1.26 -4.86 116.67 115.40 3fi0 s ASP 209 Ca 0.62 0.94 0.05 0.00 1.18 0.00 0.00 52.55 55.34 3fi0 s ASP 209 Cb -0.53 -2.06 0.72 0.00 -0.34 0.00 0.00 42.92 40.70 3fi0 s ASP 209 CO 0.57 -0.85 1.74 0.00 0.68 0.00 0.00 175.17 177.31 3fi0 h ALA 210 N -0.07 1.55 -0.53 2.11 0.00 -1.98 -1.24 119.26 119.11 3fi0 h ALA 210 Ca -0.46 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 3fi0 h ALA 210 Cb 1.22 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 3fi0 h ALA 210 CO 0.61 -0.18 0.25 -0.22 0.00 0.00 0.00 179.25 179.71 3fi0 h LYS 211 N 0.60 0.76 -0.16 0.00 3.64 -2.00 -2.30 116.57 117.12 3fi0 h LYS 211 Ca 0.56 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.82 3fi0 h LYS 211 Cb 0.96 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 3fi0 h LYS 211 CO -0.43 0.64 0.06 1.15 -2.27 0.00 0.00 179.45 178.59 3fi0 h THR 212 N 0.70 1.16 -0.03 1.00 2.02 -1.63 -2.44 112.91 113.68 3fi0 h THR 212 Ca 0.18 -0.48 0.03 0.00 0.77 0.00 0.00 66.41 66.91 3fi0 h THR 212 Cb 0.13 1.19 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 3fi0 h THR 212 CO -0.02 0.15 -0.20 0.40 0.37 0.00 0.00 175.52 176.22 3fi0 h ILE 213 N 0.09 0.52 -0.73 3.11 2.04 -1.29 0.86 117.51 122.12 3fi0 h ILE 213 Ca 0.05 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.04 3fi0 h ILE 213 Cb 0.18 0.52 -0.09 0.00 -0.74 0.00 0.00 36.82 36.70 3fi0 h ILE 213 CO -0.00 0.00 0.31 -0.08 0.00 0.00 0.00 178.15 178.37 3fi0 h GLU 214 N -0.30 0.46 -0.03 2.37 4.81 -1.35 0.23 114.58 120.78 3fi0 h GLU 214 Ca 0.07 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 59.06 3fi0 h GLU 214 Cb 0.39 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.67 3fi0 h GLU 214 CO -0.21 0.31 -0.88 0.87 -0.73 0.00 0.00 179.01 178.37 3fi0 h LYS 215 N 0.48 0.42 -0.49 1.92 1.79 -1.01 0.43 116.57 120.10 3fi0 h LYS 215 Ca 0.39 -0.41 -0.05 0.00 -2.18 0.00 0.00 60.65 58.39 3fi0 h LYS 215 Cb 0.54 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.28 3fi0 h LYS 215 CO -0.36 1.07 0.09 0.87 -1.08 0.00 0.00 179.45 180.04 3fi0 h LYS 216 N 0.25 0.76 -0.07 3.15 1.57 -0.03 -0.07 116.57 122.12 3fi0 h LYS 216 Ca -0.06 -0.16 -0.18 0.00 -1.87 0.00 0.00 60.65 58.37 3fi0 h LYS 216 Cb 1.50 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 33.71 3fi0 h LYS 216 CO 0.15 0.71 -0.66 0.82 -0.57 0.00 0.00 179.45 179.90 3fi0 h ILE 217 N 0.73 1.35 -0.40 1.86 1.08 -0.93 -3.17 117.51 118.03 3fi0 h ILE 217 Ca 0.16 -1.98 -0.00 0.00 -0.39 0.00 0.00 64.86 62.65 3fi0 h ILE 217 Cb 0.31 2.28 -0.02 0.00 -3.07 0.00 0.00 36.82 36.32 3fi0 h ILE 217 CO 0.00 0.60 0.24 0.11 -0.69 0.00 0.00 178.15 178.41 3fi0 h LYS 218 N 0.19 0.54 -4.86 2.37 1.57 -0.63 -3.49 116.57 112.25 3fi0 h LYS 218 Ca -0.06 -0.04 -0.69 0.00 -1.87 0.00 0.00 60.65 57.99 3fi0 h LYS 218 Cb 1.32 -0.12 -0.19 0.00 0.08 0.00 0.00 32.23 33.33 3fi0 h LYS 218 CO 0.13 0.38 0.16 -1.12 -0.57 0.00 0.00 179.45 178.44 3fi0 s SER 219 N -6.69 6.19 0.00 0.86 0.01 -0.06 -5.07 113.70 108.94 3fi0 s SER 219 Ca -0.08 -1.24 0.00 0.00 1.31 0.00 0.00 55.95 55.93 3fi0 s SER 219 Cb 0.17 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 64.09 3fi0 s SER 219 CO 0.73 -1.11 0.13 -0.24 0.41 0.00 0.00 173.24 173.16 3fi0 n SER 224 N 6.49 0.26 -0.14 2.44 2.88 -1.26 -4.94 113.62 119.34 3fi0 n SER 224 Ca -0.08 -0.59 -0.08 0.00 -1.33 0.00 0.00 58.87 56.79 3fi0 n SER 224 Cb 0.44 0.45 0.00 0.00 -0.75 0.00 0.00 64.21 64.34 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 0.61 0.00 -1.46 4.81 -2.07 -3.46 114.58 113.01 3fi0 h GLU 225 Ca 0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3fi0 h GLU 225 Cb 0.05 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.32 3fi0 h GLU 225 CO 0.00 0.52 0.00 0.41 -0.73 0.00 0.00 179.01 179.21 3fi0 n GLY 226 N -0.92 0.65 3.42 1.92 0.00 -1.26 -5.00 105.19 104.00 3fi0 n GLY 226 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.64 3.36 -1.28 2.61 -4.23 -1.26 -4.60 115.64 107.60 3fi0 s THR 227 Ca 0.00 -0.55 -0.18 0.00 -1.18 0.00 0.00 61.69 59.77 3fi0 s THR 227 Cb 0.00 -2.43 0.03 0.00 1.34 0.00 0.00 72.50 71.44 3fi0 s THR 227 CO 0.00 0.51 1.83 -0.38 -0.54 0.00 0.00 174.62 176.04 3fi0 n ILE 228 N 3.50 3.49 -4.74 2.99 -0.00 -1.26 -4.91 119.36 118.44 3fi0 n ILE 228 Ca -0.18 -3.57 -0.26 0.00 -0.00 0.00 0.00 62.75 58.75 3fi0 n ILE 228 Cb 0.53 -2.35 -0.15 0.00 -0.00 0.00 0.00 39.64 37.68 3fi0 n ILE 228 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 3fi0 s ARG 229 N 4.53 1.44 -0.34 0.38 0.52 -1.26 -4.69 118.95 119.53 3fi0 s ARG 229 Ca 0.56 -0.85 -0.22 0.00 -0.52 0.00 0.00 55.73 54.69 3fi0 s ARG 229 Cb 0.05 -1.49 0.00 0.00 0.52 0.00 0.00 34.95 34.02 3fi0 s ARG 229 CO 0.07 0.39 0.74 -0.47 0.02 0.00 0.00 175.30 176.06 3fi0 s TYR 230 N -0.69 3.16 0.00 -0.53 6.14 -1.26 -4.50 117.35 119.67 3fi0 s TYR 230 Ca 0.07 0.61 0.00 0.00 0.64 0.00 0.00 57.07 58.39 3fi0 s TYR 230 Cb -0.08 -3.25 0.00 0.00 0.42 0.00 0.00 41.96 39.04 3fi0 s TYR 230 CO 0.01 -0.63 0.00 0.41 0.64 0.00 0.00 175.55 175.98 3fi0 n GLY 237 N 4.43 0.00 0.05 8.97 0.00 -1.26 -5.04 105.19 112.35 3fi0 n GLY 237 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 1.21 -1.00 -0.61 1.08 -1.98 -1.54 117.51 114.66 3fi0 h ILE 238 Ca 0.00 -0.61 0.22 0.00 -0.39 0.00 0.00 64.86 64.09 3fi0 h ILE 238 Cb 0.00 1.61 -0.10 0.00 -3.07 0.00 0.00 36.82 35.26 3fi0 h ILE 238 CO 0.00 0.16 0.63 0.28 -0.69 0.00 0.00 178.15 178.52 3fi0 h SER 239 N -0.25 0.60 -0.12 1.72 0.02 -1.97 0.32 113.55 113.87 3fi0 h SER 239 Ca 0.00 0.09 -0.11 0.00 -0.84 0.00 0.00 61.79 60.93 3fi0 h SER 239 Cb 0.26 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3fi0 h SER 239 CO 0.00 0.18 -0.35 -1.13 -1.14 0.00 0.00 176.83 174.39 3fi0 h ASN 240 N 0.56 0.52 -0.94 3.07 -1.24 -1.93 -1.77 115.58 113.86 3fi0 h ASN 240 Ca 0.57 -0.59 0.05 0.00 0.71 0.00 0.00 56.30 57.04 3fi0 h ASN 240 Cb 1.18 -0.15 -0.06 0.00 0.73 0.00 0.00 38.32 40.01 3fi0 h ASN 240 CO -0.33 1.02 0.61 -0.07 -1.29 0.00 0.00 177.43 177.37 3fi0 h LEU 241 N 0.05 0.99 -1.48 0.34 4.07 -0.01 -0.45 115.31 118.83 3fi0 h LEU 241 Ca -0.01 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.90 3fi0 h LEU 241 Cb 0.97 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.48 3fi0 h LEU 241 CO 0.08 0.66 -0.27 -0.07 -1.08 0.00 0.00 178.44 177.76 3fi0 h LEU 242 N 1.15 0.00 0.08 1.67 3.38 -0.37 -1.97 115.31 119.25 3fi0 h LEU 242 Ca 0.39 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 58.07 3fi0 h LEU 242 Cb 0.08 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.85 3fi0 h LEU 242 CO -0.15 0.27 -1.21 0.78 0.09 0.00 0.00 178.44 178.22 3fi0 h ASN 243 N 0.00 0.79 -0.09 -0.43 2.35 -0.19 -1.69 115.58 116.32 3fi0 h ASN 243 Ca -0.00 -0.73 -0.01 0.00 -0.55 0.00 0.00 56.30 55.01 3fi0 h ASN 243 Cb 0.51 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.62 3fi0 h ASN 243 CO 0.03 1.54 0.01 0.40 -1.65 0.00 0.00 177.43 177.77 3fi0 h ILE 244 N 0.25 1.22 0.12 2.81 2.04 -1.19 -2.45 117.51 120.30 3fi0 h ILE 244 Ca -0.17 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 3fi0 h ILE 244 Cb 1.89 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 39.45 3fi0 h ILE 244 CO 0.23 0.19 -0.16 0.22 0.00 0.00 0.00 178.15 178.62 3fi0 h TYR 245 N -0.08 -0.46 -0.70 1.37 5.03 -1.44 -1.58 116.97 119.10 3fi0 h TYR 245 Ca 0.03 0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.46 3fi0 h TYR 245 Cb 0.29 0.19 -0.13 0.00 1.55 0.00 0.00 36.73 38.63 3fi0 h TYR 245 CO 0.02 -0.21 -0.36 1.03 -1.32 0.00 0.00 178.16 177.32 3fi0 h SER 246 N -0.29 -1.27 -0.16 -2.11 0.87 -1.35 0.26 113.55 109.49 3fi0 h SER 246 Ca -0.01 0.25 -0.10 0.00 -1.23 0.00 0.00 61.79 60.69 3fi0 h SER 246 Cb 0.27 0.64 -0.01 0.00 -0.44 0.00 0.00 62.40 62.85 3fi0 h SER 246 CO -0.05 -0.30 -0.23 0.71 -0.53 0.00 0.00 176.83 176.43 3fi0 h THR 247 N -0.12 1.27 -0.01 2.23 1.35 -1.45 -0.30 112.91 115.87 3fi0 h THR 247 Ca 0.26 -1.29 -0.23 0.00 -0.55 0.00 0.00 66.41 64.60 3fi0 h THR 247 Cb 0.56 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 3fi0 h THR 247 CO -0.77 0.42 -0.94 -0.07 -0.25 0.00 0.00 175.52 173.92 3fi0 h LEU 248 N 0.54 0.60 0.09 3.87 3.38 -0.47 -3.37 115.31 119.96 3fi0 h LEU 248 Ca 0.08 -0.47 -0.30 0.00 0.09 0.00 0.00 57.88 57.28 3fi0 h LEU 248 Cb 0.69 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3fi0 h LEU 248 CO 0.05 1.27 -1.61 0.77 0.09 0.00 0.00 178.44 179.01 3fi0 h SER 249 N 0.27 0.31 0.00 -0.43 4.64 -0.50 -3.49 113.55 114.35 3fi0 h SER 249 Ca -0.08 -0.81 0.00 0.00 -0.47 0.00 0.00 61.79 60.42 3fi0 h SER 249 Cb 1.57 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 3fi0 h SER 249 CO 0.17 1.69 0.00 0.61 -0.87 0.00 0.00 176.83 178.42 3fi0 n GLY 250 N 1.77 1.24 3.71 -0.77 0.00 -0.13 -5.08 105.19 105.93 3fi0 n GLY 250 Ca -0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.20 -0.02 0.41 1.61 -0.21 -1.21 -4.99 119.66 115.05 3fi0 s GLN 251 Ca 0.00 0.09 0.08 0.00 0.02 0.00 0.00 55.36 55.55 3fi0 s GLN 251 Cb 0.00 -1.72 -0.02 0.00 1.00 0.00 0.00 33.01 32.27 3fi0 s GLN 251 CO 0.00 -2.94 0.40 -1.54 -2.12 0.00 0.00 175.29 169.09 3fi0 s SER 252 N -3.98 5.16 0.00 5.90 1.04 -1.26 -4.54 113.70 116.01 3fi0 s SER 252 Ca 0.68 -0.68 0.27 0.00 0.48 0.00 0.00 55.95 56.70 3fi0 s SER 252 Cb -0.12 -0.60 1.28 0.00 0.10 0.00 0.00 66.02 66.68 3fi0 s SER 252 CO 0.55 -0.66 1.91 -0.38 0.98 0.00 0.00 173.24 175.64 3fi0 n ILE 253 N -1.59 0.12 -0.04 -1.02 5.41 -1.26 -0.83 119.36 120.16 3fi0 n ILE 253 Ca 0.04 0.03 -0.01 0.00 1.00 0.00 0.00 62.75 63.81 3fi0 n ILE 253 Cb 0.61 -0.57 -0.10 0.00 -0.71 0.00 0.00 39.64 38.87 3fi0 n ILE 253 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 3fi0 n GLU 254 N -1.38 1.33 -0.24 0.38 0.28 -1.26 -2.52 120.64 117.23 3fi0 n GLU 254 Ca 0.10 -0.05 0.25 0.00 -0.16 0.00 0.00 57.16 57.30 3fi0 n GLU 254 Cb 0.26 -1.31 0.62 0.00 1.43 0.00 0.00 31.44 32.44 3fi0 n GLU 254 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 3fi0 h GLU 255 N 0.00 0.20 0.00 3.44 4.81 -1.84 -1.79 114.58 119.40 3fi0 h GLU 255 Ca -0.19 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 58.88 3fi0 h GLU 255 Cb 1.26 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 3fi0 h GLU 255 CO 0.01 0.13 -2.02 1.28 -0.73 0.00 0.00 179.01 177.68 3fi0 n LEU 256 N -4.40 0.00 0.17 1.64 4.77 -0.01 -2.89 117.00 116.28 3fi0 n LEU 256 Ca 0.20 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.22 3fi0 n LEU 256 Cb 0.88 0.20 0.28 0.00 -2.33 0.00 0.00 43.42 42.46 3fi0 n LEU 256 CO 0.34 0.20 0.62 -0.33 -1.33 0.00 0.00 177.39 176.89 3fi0 h GLU 257 N 0.00 0.00 -0.02 3.23 5.08 -1.50 -3.15 114.58 118.22 3fi0 h GLU 257 Ca -0.22 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.92 3fi0 h GLU 257 Cb 1.44 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.68 3fi0 h GLU 257 CO 0.01 0.46 -0.89 0.00 -1.00 0.00 0.00 179.01 177.59 3fi0 h ARG 258 N 0.00 0.38 0.00 2.33 3.08 -1.41 -3.23 114.38 115.53 3fi0 h ARG 258 Ca -0.00 -0.39 -0.04 0.00 0.07 0.00 0.00 59.98 59.62 3fi0 h ARG 258 Cb 0.95 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 3fi0 h ARG 258 CO 0.06 1.06 -0.19 0.37 -1.07 0.00 0.00 179.97 180.20 3fi0 h GLN 259 N 0.22 0.00 -3.01 0.04 4.15 -1.50 -3.38 115.11 111.63 3fi0 h GLN 259 Ca -0.06 0.00 -0.62 0.00 0.77 0.00 0.00 58.65 58.74 3fi0 h GLN 259 Cb 1.51 0.00 -0.41 0.00 0.21 0.00 0.00 27.48 28.79 3fi0 h GLN 259 CO 0.15 0.19 -0.68 0.71 -1.93 0.00 0.00 178.83 177.27 3fi0 s TYR 260 N -4.23 2.76 -0.08 3.99 2.02 -1.20 -4.88 117.35 115.73 3fi0 s TYR 260 Ca -0.03 -2.95 0.07 0.00 -0.37 0.00 0.00 57.07 53.79 3fi0 s TYR 260 Cb 0.14 -2.27 -0.09 0.00 -0.40 0.00 0.00 41.96 39.33 3fi0 s TYR 260 CO 0.64 -0.68 0.02 -1.91 -1.57 0.00 0.00 175.55 172.05 3fi0 n GLU 261 N 2.68 2.69 0.00 -0.62 4.07 -1.26 -4.52 120.64 123.68 3fi0 n GLU 261 Ca 0.16 -0.00 0.06 0.00 -0.06 0.00 0.00 57.16 57.32 3fi0 n GLU 261 Cb 0.36 -1.20 0.05 0.00 -0.06 0.00 0.00 31.44 30.59 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 2.54 -0.20 3.24 8.31 0.00 -1.26 -5.05 105.19 112.77 3fi0 n GLY 262 Ca -0.13 -0.35 -0.25 0.00 0.00 0.00 0.00 46.02 45.28 3fi0 n GLY 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fi0 n LYS 263 N 0.61 -1.61 -4.43 1.61 4.76 -1.26 -5.11 118.16 112.73 3fi0 n LYS 263 Ca 0.07 -1.70 -0.21 0.00 -2.87 0.00 0.00 58.31 53.60 3fi0 n LYS 263 Cb 0.30 -1.25 -0.09 0.00 -1.84 0.00 0.00 35.03 32.15 3fi0 n LYS 263 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3fi0 s GLY 264 N -5.14 2.19 0.53 0.72 0.00 -1.26 -4.89 107.32 99.48 3fi0 s GLY 264 Ca 0.64 -1.70 0.27 0.00 0.00 0.00 0.00 44.72 43.93 3fi0 s GLY 264 CO 0.46 -1.74 1.97 -0.97 0.00 0.00 0.00 173.10 172.82 3fi0 h TYR 265 N 2.07 0.00 -0.70 1.90 0.05 -1.99 -2.69 116.97 115.61 3fi0 h TYR 265 Ca -0.37 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.42 3fi0 h TYR 265 Cb 1.26 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.96 3fi0 h TYR 265 CO 0.94 0.00 0.46 0.78 -1.05 0.00 0.00 178.16 179.30 3fi0 h GLY 266 N 0.00 0.99 1.59 3.88 0.00 -1.98 0.19 103.07 107.74 3fi0 h GLY 266 Ca 0.29 -0.37 -0.28 0.00 0.00 0.00 0.00 47.33 46.98 3fi0 h GLY 266 CO -0.00 0.35 -1.27 -0.39 0.00 0.00 0.00 176.54 175.23 3fi0 h VAL 267 N 0.94 1.47 -0.18 4.60 -1.51 -1.91 -2.25 116.25 117.42 3fi0 h VAL 267 Ca 0.26 -3.03 -0.00 0.00 -1.23 0.00 0.00 66.70 62.70 3fi0 h VAL 267 Cb -0.10 2.95 -0.01 0.00 -2.13 0.00 0.00 31.29 32.00 3fi0 h VAL 267 CO -0.06 0.89 0.10 0.15 -1.23 0.00 0.00 177.57 177.41 3fi0 h PHE 268 N 0.08 0.25 -0.87 5.19 3.57 -1.44 0.14 116.94 123.86 3fi0 h PHE 268 Ca -0.15 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.34 3fi0 h PHE 268 Cb 1.99 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 40.61 3fi0 h PHE 268 CO 0.07 0.24 0.51 0.87 -2.23 0.00 0.00 178.31 177.76 3fi0 h LYS 269 N 0.19 1.20 -0.16 1.11 1.57 -0.67 0.74 116.57 120.55 3fi0 h LYS 269 Ca 0.06 -0.12 -0.13 0.00 -1.87 0.00 0.00 60.65 58.59 3fi0 h LYS 269 Cb 0.07 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3fi0 h LYS 269 CO -0.01 0.86 -0.47 0.00 -0.57 0.00 0.00 179.45 179.25 3fi0 h ALA 270 N 1.27 0.90 -0.02 3.86 0.00 -1.15 0.10 119.26 124.22 3fi0 h ALA 270 Ca 0.31 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3fi0 h ALA 270 Cb -0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3fi0 h ALA 270 CO -0.05 0.65 -0.04 -0.44 0.00 0.00 0.00 179.25 179.37 3fi0 h ASP 271 N 0.32 0.07 -0.04 0.00 3.32 -0.52 -2.90 116.42 116.67 3fi0 h ASP 271 Ca 0.02 -0.54 0.02 0.00 0.02 0.00 0.00 57.03 56.55 3fi0 h ASP 271 Cb 0.95 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.46 3fi0 h ASP 271 CO 0.08 0.60 -0.07 0.25 -1.72 0.00 0.00 179.24 178.38 3fi0 h LEU 272 N -0.45 -0.20 -1.75 1.55 5.85 -0.83 -1.36 115.31 118.13 3fi0 h LEU 272 Ca 0.00 0.04 0.28 0.00 0.84 0.00 0.00 57.88 59.04 3fi0 h LEU 272 Cb 0.58 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 3fi0 h LEU 272 CO 0.01 -0.09 0.70 0.00 -0.34 0.00 0.00 178.44 178.72 3fi0 h ALA 273 N 0.93 2.66 0.00 1.25 0.00 -1.02 0.68 119.26 123.77 3fi0 h ALA 273 Ca 0.04 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.72 3fi0 h ALA 273 Cb 0.15 0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.00 3fi0 h ALA 273 CO -0.10 -0.98 -0.96 1.96 0.00 0.00 0.00 179.25 179.16 3fi0 h GLN 274 N 0.17 0.46 0.00 0.00 1.08 -1.05 -2.73 115.11 113.03 3fi0 h GLN 274 Ca 0.52 -0.50 -0.14 0.00 -1.45 0.00 0.00 58.65 57.09 3fi0 h GLN 274 Cb 1.73 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 29.28 3fi0 h GLN 274 CO -0.11 1.15 -0.65 -0.39 -0.95 0.00 0.00 178.83 177.88 3fi0 h VAL 275 N 0.26 1.42 -0.13 -0.54 -1.51 -0.28 -0.51 116.25 114.95 3fi0 h VAL 275 Ca -0.09 -2.24 -0.22 0.00 -1.23 0.00 0.00 66.70 62.92 3fi0 h VAL 275 Cb 1.60 2.22 0.01 0.00 -2.13 0.00 0.00 31.29 33.00 3fi0 h VAL 275 CO 0.17 0.63 -0.77 0.58 -1.23 0.00 0.00 177.57 176.96 3fi0 h VAL 276 N 0.00 1.29 -0.50 7.19 2.07 -1.22 -1.75 116.25 123.32 3fi0 h VAL 276 Ca -0.01 -1.98 -0.10 0.00 0.82 0.00 0.00 66.70 65.43 3fi0 h VAL 276 Cb 1.17 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 32.97 3fi0 h VAL 276 CO 0.08 0.62 -0.10 0.40 0.02 0.00 0.00 177.57 178.59 3fi0 h ILE 277 N 0.47 1.26 -0.61 4.57 2.04 -1.47 -1.85 117.51 121.93 3fi0 h ILE 277 Ca -0.06 -1.22 0.10 0.00 1.00 0.00 0.00 64.86 64.68 3fi0 h ILE 277 Cb 1.40 0.99 -0.08 0.00 -0.74 0.00 0.00 36.82 38.39 3fi0 h ILE 277 CO 0.16 0.43 0.20 -0.33 0.00 0.00 0.00 178.15 178.60 3fi0 h GLU 278 N 0.82 0.35 0.10 2.37 4.39 -1.00 -1.21 114.58 120.40 3fi0 h GLU 278 Ca 0.13 -0.02 -0.25 0.00 0.34 0.00 0.00 59.36 59.57 3fi0 h GLU 278 Cb 0.63 -0.08 0.02 0.00 -0.10 0.00 0.00 28.75 29.23 3fi0 h GLU 278 CO 0.04 0.23 -1.03 1.15 -1.16 0.00 0.00 179.01 178.25 3fi0 h THR 279 N 0.36 1.36 0.00 1.13 2.02 -1.10 -3.27 112.91 113.41 3fi0 h THR 279 Ca 0.31 -2.39 -0.09 0.00 0.77 0.00 0.00 66.41 65.01 3fi0 h THR 279 Cb 0.42 2.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.59 3fi0 h THR 279 CO -0.34 0.71 -0.41 -0.07 0.37 0.00 0.00 175.52 175.78 3fi0 h LEU 280 N 0.07 0.00 0.15 2.58 3.38 -1.34 -3.38 115.31 116.78 3fi0 h LEU 280 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.82 3fi0 h LEU 280 Cb 1.74 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.46 3fi0 h LEU 280 CO 0.20 0.41 -0.38 -0.09 0.09 0.00 0.00 178.44 178.67 3fi0 h ARG 281 N 0.00 -0.57 -0.05 1.13 2.43 -1.26 0.36 114.38 116.42 3fi0 h ARG 281 Ca -0.00 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3fi0 h ARG 281 Cb 1.12 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.80 3fi0 h ARG 281 CO 0.05 -0.38 0.05 -1.00 -1.51 0.00 0.00 179.97 177.18 3fi0 h PRO 282 N -0.59 0.00 0.08 0.20 0.13 -1.74 -2.52 132.00 127.55 3fi0 h PRO 282 Ca -0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3fi0 h PRO 282 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 3fi0 h PRO 282 CO -0.17 0.00 -0.04 0.82 -0.23 0.00 0.00 178.00 178.38 3fi0 h ILE 283 N 0.00 1.20 0.00 -3.56 2.04 -1.58 -2.91 117.51 112.70 3fi0 h ILE 283 Ca 0.02 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.56 3fi0 h ILE 283 Cb 0.12 2.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 3fi0 h ILE 283 CO -0.00 0.31 -0.09 1.56 0.00 0.00 0.00 178.15 179.92 3fi0 h GLN 284 N -0.73 0.00 0.73 2.37 4.20 -0.76 -0.42 115.11 120.51 3fi0 h GLN 284 Ca -0.01 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 3fi0 h GLN 284 Cb 0.58 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 3fi0 h GLN 284 CO 0.02 0.09 -0.43 0.93 -0.67 0.00 0.00 178.83 178.77 3fi0 h GLU 285 N 0.00 -1.05 0.00 1.46 5.08 -1.40 -1.37 114.58 117.30 3fi0 h GLU 285 Ca -0.00 0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 3fi0 h GLU 285 Cb 0.21 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 3fi0 h GLU 285 CO 0.01 -0.70 -0.27 0.00 -1.00 0.00 0.00 179.01 177.06 3fi0 h ARG 286 N -1.09 0.00 -0.44 2.33 3.08 -1.28 -2.65 114.38 114.34 3fi0 h ARG 286 Ca -0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 3fi0 h ARG 286 Cb 0.86 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.89 3fi0 h ARG 286 CO 0.11 0.27 0.24 -0.92 -1.07 0.00 0.00 179.97 178.60 3fi0 h TYR 287 N 0.00 0.60 0.00 3.04 3.20 -0.86 -1.80 116.97 121.15 3fi0 h TYR 287 Ca -0.00 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.78 3fi0 h TYR 287 Cb 0.51 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3fi0 h TYR 287 CO 0.00 0.45 -0.33 0.45 -1.64 0.00 0.00 178.16 177.09 3fi0 h HIS 288 N 0.58 0.00 0.00 -3.82 3.86 -0.92 -2.80 115.15 112.05 3fi0 h HIS 288 Ca 0.16 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.23 3fi0 h HIS 288 Cb 0.05 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 3fi0 h HIS 288 CO -0.02 0.33 -0.66 0.45 0.86 0.00 0.00 177.93 178.90 3fi0 h HIS 289 N 0.00 0.00 0.00 2.45 3.86 -1.15 -3.02 115.15 117.29 3fi0 h HIS 289 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3fi0 h HIS 289 Cb 0.72 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.19 3fi0 h HIS 289 CO 0.00 0.66 0.00 0.91 0.86 0.00 0.00 177.93 180.36 3fi0 n TRP 290 N -3.52 0.00 0.00 2.45 7.02 -0.72 -2.71 117.44 119.96 3fi0 n TRP 290 Ca -0.00 -0.56 0.00 0.00 -1.02 0.00 0.00 57.50 55.92 3fi0 n TRP 290 Cb 0.70 -0.29 0.00 0.00 -2.42 0.00 0.00 31.31 29.31 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 0.74 0.00 -3.18 -0.99 0.28 -1.14 -4.56 120.64 111.78 3fi0 n GLU 292 Ca 0.00 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.80 3fi0 n GLU 292 Cb 0.46 0.00 0.03 0.00 1.43 0.00 0.00 31.44 33.36 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 5.22 0.00 -1.84 0.15 -1.10 -5.00 113.70 111.12 3fi0 s SER 293 Ca 0.00 -0.75 0.15 0.00 0.70 0.00 0.00 55.95 56.05 3fi0 s SER 293 Cb 0.00 -0.09 0.05 0.00 -1.71 0.00 0.00 66.02 64.27 3fi0 s SER 293 CO 0.00 -1.05 0.87 -0.62 1.20 0.00 0.00 173.24 173.64 3fi0 n GLU 294 N -1.99 1.49 0.10 5.44 1.02 -1.26 -4.35 120.64 121.10 3fi0 n GLU 294 Ca 0.10 -1.04 -0.12 0.00 -0.02 0.00 0.00 57.16 56.08 3fi0 n GLU 294 Cb 0.61 -1.25 -0.05 0.00 -0.02 0.00 0.00 31.44 30.73 3fi0 n GLU 294 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3fi0 h GLU 295 N 2.19 -0.38 -0.79 3.49 4.39 -1.94 -2.24 114.58 119.31 3fi0 h GLU 295 Ca 0.00 0.03 0.14 0.00 0.34 0.00 0.00 59.36 59.86 3fi0 h GLU 295 Cb 0.55 0.09 -0.14 0.00 -0.10 0.00 0.00 28.75 29.15 3fi0 h GLU 295 CO 0.00 -0.25 -0.26 -0.11 -1.16 0.00 0.00 179.01 177.23 3fi0 n LEU 296 N -5.34 -0.41 0.15 1.33 7.94 -1.26 0.26 117.00 119.68 3fi0 n LEU 296 Ca -0.06 1.36 0.13 0.00 -1.11 0.00 0.00 56.01 56.33 3fi0 n LEU 296 Cb 0.25 -0.36 0.52 0.00 0.53 0.00 0.00 43.42 44.36 3fi0 n LEU 296 CO 0.26 -1.26 0.88 0.44 -1.11 0.00 0.00 177.39 176.60 3fi0 h ASP 297 N 0.00 0.00 0.28 1.96 5.19 -1.69 -2.51 116.42 119.65 3fi0 h ASP 297 Ca 0.32 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 56.40 3fi0 h ASP 297 Cb 0.52 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.98 3fi0 h ASP 297 CO -0.79 0.00 -1.95 0.54 -3.12 0.00 0.00 179.24 173.92 3fi0 n ARG 298 N -2.39 0.67 0.19 3.56 3.00 0.73 -2.80 116.66 119.63 3fi0 n ARG 298 Ca 0.02 0.23 0.07 0.00 -0.01 0.00 0.00 57.85 58.16 3fi0 n ARG 298 Cb 0.26 -1.71 0.34 0.00 0.00 0.00 0.00 32.46 31.35 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 0.02 0.79 0.00 1.55 2.07 -0.62 -1.93 116.25 118.13 3fi0 h VAL 299 Ca -0.38 -1.46 -0.25 0.00 0.82 0.00 0.00 66.70 65.43 3fi0 h VAL 299 Cb 2.05 1.92 -0.04 0.00 -1.52 0.00 0.00 31.29 33.70 3fi0 h VAL 299 CO 0.06 0.34 -1.38 -0.07 0.02 0.00 0.00 177.57 176.54 3fi0 h LEU 300 N 0.00 0.00 -0.32 2.57 3.38 -1.58 -2.47 115.31 116.89 3fi0 h LEU 300 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 3fi0 h LEU 300 Cb 0.89 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 3fi0 h LEU 300 CO 0.04 0.97 -0.44 0.44 0.09 0.00 0.00 178.44 179.54 3fi0 h ASP 301 N 0.00 0.94 1.19 -0.43 3.32 -1.36 -2.48 116.42 117.60 3fi0 h ASP 301 Ca -0.16 -0.50 -0.08 0.00 0.02 0.00 0.00 57.03 56.31 3fi0 h ASP 301 Cb 1.89 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 41.16 3fi0 h ASP 301 CO 0.10 1.26 -0.37 -0.08 -1.72 0.00 0.00 179.24 178.42 3fi0 h GLU 302 N 0.64 0.00 -0.07 3.56 4.81 -1.44 -2.14 114.58 119.95 3fi0 h GLU 302 Ca 0.03 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.16 3fi0 h GLU 302 Cb 1.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3fi0 h GLU 302 CO 0.10 0.37 -0.35 0.78 -0.73 0.00 0.00 179.01 179.18 3fi0 h GLY 303 N 2.75 0.39 2.00 1.92 0.00 -1.36 -1.99 103.07 106.78 3fi0 h GLY 303 Ca -0.00 -0.56 -0.06 0.00 0.00 0.00 0.00 47.33 46.70 3fi0 h GLY 303 CO 0.05 0.50 -0.29 0.00 0.00 0.00 0.00 176.54 176.80 3fi0 h ALA 304 N 0.42 1.19 0.10 3.60 0.00 -1.45 -1.58 119.26 121.54 3fi0 h ALA 304 Ca -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3fi0 h ALA 304 Cb 1.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3fi0 h ALA 304 CO 0.07 0.37 -0.05 1.49 0.00 0.00 0.00 179.25 181.13 3fi0 h GLU 305 N 0.00 -0.14 -0.74 0.00 4.81 -1.36 0.14 114.58 117.30 3fi0 h GLU 305 Ca -0.00 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.38 3fi0 h GLU 305 Cb 0.66 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.98 3fi0 h GLU 305 CO 0.04 0.37 0.28 0.87 -0.73 0.00 0.00 179.01 179.84 3fi0 h LYS 306 N -0.78 0.41 -0.19 1.92 1.57 -1.31 -2.05 116.57 116.13 3fi0 h LYS 306 Ca -0.01 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 3fi0 h LYS 306 Cb 0.57 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 3fi0 h LYS 306 CO 0.02 0.27 -0.31 0.00 -0.57 0.00 0.00 179.45 178.87 3fi0 h ALA 307 N 1.54 0.30 0.00 3.86 0.00 -1.28 -2.98 119.26 120.70 3fi0 h ALA 307 Ca 0.41 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3fi0 h ALA 307 Cb 0.62 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 3fi0 h ALA 307 CO -0.41 0.32 -0.03 -0.91 0.00 0.00 0.00 179.25 178.23 3fi0 h ASN 308 N 0.22 0.00 0.09 0.00 -0.26 -0.29 0.20 115.58 115.54 3fi0 h ASN 308 Ca 0.02 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.75 3fi0 h ASN 308 Cb 0.89 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.15 3fi0 h ASN 308 CO 0.07 0.03 -0.05 -0.09 -1.06 0.00 0.00 177.43 176.33 3fi0 h ARG 309 N 0.00 -0.12 -0.20 0.81 2.43 -1.24 0.36 114.38 116.42 3fi0 h ARG 309 Ca -0.00 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 3fi0 h ARG 309 Cb 0.09 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 3fi0 h ARG 309 CO 0.00 0.38 -0.08 0.28 -1.51 0.00 0.00 179.97 179.04 3fi0 h VAL 310 N -0.72 1.30 -0.52 0.20 2.07 -1.38 -2.98 116.25 114.22 3fi0 h VAL 310 Ca -0.01 -1.10 -0.07 0.00 0.82 0.00 0.00 66.70 66.33 3fi0 h VAL 310 Cb 0.55 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 3fi0 h VAL 310 CO 0.02 0.33 0.05 0.00 0.02 0.00 0.00 177.57 177.99 3fi0 h ALA 311 N 0.71 0.69 -0.38 1.67 0.00 -1.06 -3.14 119.26 117.75 3fi0 h ALA 311 Ca 0.05 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.74 3fi0 h ALA 311 Cb 0.55 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3fi0 h ALA 311 CO 0.03 0.46 0.13 1.03 0.00 0.00 0.00 179.25 180.89 3fi0 h SER 312 N 0.75 0.13 0.00 0.00 0.87 -0.30 -1.84 113.55 113.16 3fi0 h SER 312 Ca 0.15 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 3fi0 h SER 312 Cb 0.45 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 3fi0 h SER 312 CO 0.02 0.11 0.00 1.21 -0.53 0.00 0.00 176.83 177.64 3fi0 n GLU 313 N -5.02 0.00 0.00 2.24 4.07 -1.13 -1.95 120.64 118.85 3fi0 n GLU 313 Ca 0.02 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.12 3fi0 n GLU 313 Cb 0.14 -1.10 0.00 0.00 -0.06 0.00 0.00 31.44 30.42 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 0.60 0.00 -0.28 6.31 0.31 -0.69 -1.67 118.33 122.91 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 0.00 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.00 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 1.17 -1.13 5.55 2.43 -1.65 -0.59 114.38 120.15 3fi0 h ARG 316 Ca 0.00 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 3fi0 h ARG 316 Cb 0.00 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 3fi0 h ARG 316 CO 0.00 0.96 0.00 1.63 -1.51 0.00 0.00 179.97 181.05 3fi0 n LYS 317 N -4.27 0.47 0.00 0.20 5.02 -0.67 -1.57 118.16 117.34 3fi0 n LYS 317 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3fi0 n LYS 317 Cb 0.20 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 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 0.58 0.00 0.26 1.97 1.02 -0.23 -1.84 120.64 122.40 3fi0 n GLU 319 Ca 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.22 3fi0 n GLU 319 Cb 0.19 0.00 0.63 0.00 -0.02 0.00 0.00 31.44 32.24 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 0.00 -0.84 3.49 5.75 -1.53 0.78 115.11 122.76 3fi0 h GLN 320 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3fi0 h GLN 320 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 3fi0 h GLN 320 CO 0.00 0.03 0.00 0.00 -2.65 0.00 0.00 178.83 176.21 3fi0 n ALA 321 N -2.53 2.49 -2.45 3.38 0.00 -0.77 -4.82 120.51 115.80 3fi0 n ALA 321 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.38 3fi0 n ALA 321 Cb 0.11 -1.00 0.07 0.00 0.00 0.00 0.00 19.45 18.63 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 0.08 1.53 3.70 0.00 0.00 0.25 -4.97 105.19 105.77 3fi0 n GLY 323 Ca 0.00 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.78 4.22 0.00 0.99 1.43 0.24 -4.93 118.68 117.86 3fi0 s LEU 324 Ca 0.06 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 53.85 3fi0 s LEU 324 Cb 0.30 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.91 3fi0 s LEU 324 CO -0.09 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.07 3fi0 n GLY 325 N 3.52 0.72 0.00 -3.19 0.00 -1.26 -4.61 105.19 100.37 3fi0 n GLY 325 Ca -0.08 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3fi0 n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86