#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f6p n ARG 2 N 0.00 0.00 -1.91 2.12 0.63 -1.26 -4.86 116.66 111.39 1f6p n ARG 2 Ca 0.00 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.51 1f6p n ARG 2 Cb 0.00 -0.76 -0.03 0.00 0.45 0.00 0.00 32.46 32.12 1f6p n ARG 2 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1f6p s ASP 3 N -0.71 6.55 0.00 6.15 -1.08 -1.26 -4.92 116.67 121.40 1f6p s ASP 3 Ca 0.49 2.71 0.09 0.00 -0.52 0.00 0.00 52.55 55.32 1f6p s ASP 3 Cb -0.70 -2.61 0.23 0.00 -1.46 0.00 0.00 42.92 38.38 1f6p s ASP 3 CO 0.42 -0.82 1.14 0.18 0.52 0.00 0.00 175.17 176.61 1f6p n LEU 4 N 3.25 2.62 -4.87 -1.34 4.77 -1.26 -4.86 117.00 115.31 1f6p n LEU 4 Ca 0.11 -1.80 -0.30 0.00 -0.03 0.00 0.00 56.01 53.98 1f6p n LEU 4 Cb 0.38 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 41.34 1f6p n LEU 4 CO 0.62 0.63 0.74 -0.54 -1.33 0.00 0.00 177.39 177.51 1f6p s LYS 5 N -0.96 3.12 0.00 3.23 1.02 -1.26 -4.92 119.74 119.97 1f6p s LYS 5 Ca 0.19 0.61 0.00 0.00 0.02 0.00 0.00 55.97 56.78 1f6p s LYS 5 Cb 0.10 -2.04 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 1f6p s LYS 5 CO 0.14 -0.88 0.00 0.41 -0.92 0.00 0.00 175.35 174.10 1f6p n GLY 6 N -2.82 0.05 3.40 -3.33 0.00 -0.92 -4.91 105.19 96.67 1f6p n GLY 6 Ca 0.07 -1.95 -0.37 0.00 0.00 0.00 0.00 46.02 43.77 1f6p n GLY 6 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f6p s ILE 7 N 0.00 4.20 -0.12 -0.61 -1.09 -1.26 -0.31 121.20 122.01 1f6p s ILE 7 Ca 0.00 -0.44 0.01 0.00 -2.23 0.00 0.00 60.65 57.99 1f6p s ILE 7 Cb 0.00 -3.08 -0.01 0.00 -1.58 0.00 0.00 42.46 37.79 1f6p s ILE 7 CO 0.00 0.19 -0.15 -0.36 -1.23 0.00 0.00 174.94 173.38 1f6p s PHE 8 N 1.56 2.75 0.25 3.97 0.40 -0.53 0.12 117.98 126.51 1f6p s PHE 8 Ca 0.05 -0.67 -0.21 0.00 -0.60 0.00 0.00 56.93 55.49 1f6p s PHE 8 Cb -0.16 -1.80 -0.09 0.00 0.51 0.00 0.00 43.02 41.48 1f6p s PHE 8 CO 0.03 -0.21 0.79 -1.12 0.70 0.00 0.00 175.22 175.41 1f6p s SER 9 N 0.26 7.13 -0.53 1.36 0.01 -0.65 -1.39 113.70 119.88 1f6p s SER 9 Ca -0.10 1.53 -0.24 0.00 1.31 0.00 0.00 55.95 58.44 1f6p s SER 9 Cb -0.16 -2.46 0.04 0.00 0.21 0.00 0.00 66.02 63.65 1f6p s SER 9 CO 0.06 -0.00 0.94 0.00 0.41 0.00 0.00 173.24 174.65 1f6p s ALA 10 N -1.56 3.17 0.07 1.44 0.00 0.27 -1.20 121.76 123.95 1f6p s ALA 10 Ca 0.45 -1.14 -0.30 0.00 0.00 0.00 0.00 51.96 50.97 1f6p s ALA 10 Cb -0.17 -3.72 -0.09 0.00 0.00 0.00 0.00 23.12 19.14 1f6p s ALA 10 CO 0.22 -2.33 1.83 -1.17 0.00 0.00 0.00 175.76 174.30 1f6p s LEU 11 N 3.93 4.40 0.51 0.00 2.96 -0.72 -4.59 118.68 125.18 1f6p s LEU 11 Ca 0.32 2.63 -0.07 0.00 -0.22 0.00 0.00 54.13 56.79 1f6p s LEU 11 Cb -0.12 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1f6p s LEU 11 CO 0.21 -0.99 0.85 -0.76 -1.32 0.00 0.00 176.35 174.33 1f6p s LEU 12 N 3.40 3.54 -0.00 -0.68 1.02 -1.26 -3.25 118.68 121.45 1f6p s LEU 12 Ca 0.81 1.06 0.05 0.00 0.02 0.00 0.00 54.13 56.08 1f6p s LEU 12 Cb -0.43 -4.04 -0.03 0.00 0.02 0.00 0.00 46.19 41.72 1f6p s LEU 12 CO 0.37 -0.64 -0.16 -0.69 0.02 0.00 0.00 176.35 175.25 1f6p s VAL 13 N -2.83 2.95 -0.17 -1.59 1.01 -1.26 -4.93 120.40 113.58 1f6p s VAL 13 Ca 0.50 -0.96 -0.23 0.00 0.00 0.00 0.00 61.98 61.29 1f6p s VAL 13 Cb -0.10 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 1f6p s VAL 13 CO 0.46 0.45 0.71 -0.55 0.00 0.00 0.00 175.10 176.17 1f6p s SER 14 N -1.12 6.83 0.18 3.32 0.15 -1.25 -4.86 113.70 116.94 1f6p s SER 14 Ca 0.13 1.01 0.09 0.00 0.70 0.00 0.00 55.95 57.88 1f6p s SER 14 Cb -0.11 -2.39 -0.04 0.00 -1.71 0.00 0.00 66.02 61.77 1f6p s SER 14 CO 0.03 -0.29 -0.11 -0.36 1.20 0.00 0.00 173.24 173.72 1f6p s PHE 15 N 1.80 2.60 0.89 3.44 0.08 -1.15 -0.80 117.98 124.85 1f6p s PHE 15 Ca 0.33 -0.23 -0.14 0.00 0.12 0.00 0.00 56.93 57.01 1f6p s PHE 15 Cb -0.16 -1.27 0.13 0.00 -0.57 0.00 0.00 43.02 41.15 1f6p s PHE 15 CO 0.12 0.51 1.22 -0.80 -0.10 0.00 0.00 175.22 176.18 1f6p s ASN 16 N -2.83 3.78 0.52 1.36 0.01 0.78 -1.44 114.94 117.11 1f6p s ASN 16 Ca 0.25 0.63 0.24 0.00 -0.71 0.00 0.00 52.86 53.26 1f6p s ASN 16 Cb -0.09 -0.97 1.40 0.00 0.41 0.00 0.00 41.25 42.00 1f6p s ASN 16 CO 0.15 -2.35 2.09 -0.08 -1.51 0.00 0.00 177.10 175.40 1f6p h GLU 17 N -1.36 0.00 -0.43 -0.60 4.81 -1.96 -1.00 114.58 114.03 1f6p h GLU 17 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1f6p h GLU 17 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1f6p h GLU 17 CO 0.55 0.11 0.00 -0.40 -0.73 0.00 0.00 179.01 178.54 1f6p n ASP 18 N -3.90 2.26 0.00 1.04 5.68 -1.26 -4.92 116.55 115.45 1f6p n ASP 18 Ca -0.02 -2.04 0.00 0.00 -0.50 0.00 0.00 54.79 52.22 1f6p n ASP 18 Cb 0.20 -0.30 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1f6p n ASP 18 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1f6p n GLY 19 N 1.07 3.15 3.75 6.12 0.00 -0.38 -5.04 105.19 113.85 1f6p n GLY 19 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1f6p n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1f6p s THR 20 N -2.43 3.04 0.32 2.61 -4.23 -1.26 -4.70 115.64 108.99 1f6p s THR 20 Ca 0.00 0.36 -0.28 0.00 -1.18 0.00 0.00 61.69 60.59 1f6p s THR 20 Cb 0.00 -2.77 -0.09 0.00 1.34 0.00 0.00 72.50 70.98 1f6p s THR 20 CO 0.00 -0.42 1.09 -0.63 -0.54 0.00 0.00 174.62 174.12 1f6p s ILE 21 N -2.75 3.52 -0.75 2.99 1.01 -1.26 -0.16 121.20 123.80 1f6p s ILE 21 Ca 0.63 1.42 -0.14 0.00 0.00 0.00 0.00 60.65 62.57 1f6p s ILE 21 Cb -0.19 -3.86 0.20 0.00 0.01 0.00 0.00 42.46 38.61 1f6p s ILE 21 CO 0.54 0.26 0.69 0.21 0.00 0.00 0.00 174.94 176.63 1f6p s ASN 22 N -1.06 6.55 0.15 3.58 3.84 0.02 -4.68 114.94 123.33 1f6p s ASN 22 Ca 0.48 -2.49 -0.17 0.00 0.21 0.00 0.00 52.86 50.90 1f6p s ASN 22 Cb -0.29 -2.19 0.04 0.00 -0.55 0.00 0.00 41.25 38.26 1f6p s ASN 22 CO 0.38 -0.63 1.74 -0.08 -2.79 0.00 0.00 177.10 175.72 1f6p h GLU 23 N 8.00 0.20 0.01 0.43 4.81 -1.94 0.12 114.58 126.21 1f6p h GLU 23 Ca 0.01 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1f6p h GLU 23 Cb 1.05 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.37 1f6p h GLU 23 CO 0.82 0.14 -0.07 -0.22 -0.73 0.00 0.00 179.01 178.94 1f6p h LYS 24 N 0.21 -0.13 -0.89 1.92 1.63 -1.96 -1.68 116.57 115.66 1f6p h LYS 24 Ca 0.15 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1f6p h LYS 24 Cb 0.14 0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.76 1f6p h LYS 24 CO -0.17 -0.09 0.57 0.78 -3.45 0.00 0.00 179.45 177.08 1f6p h GLY 25 N -0.14 1.27 0.77 5.01 0.00 -1.67 -1.45 103.07 106.86 1f6p h GLY 25 Ca 0.03 -0.50 0.04 0.00 0.00 0.00 0.00 47.33 46.89 1f6p h GLY 25 CO -0.07 0.49 0.23 -2.00 0.00 0.00 0.00 176.54 175.19 1f6p h LEU 26 N 1.21 0.33 -0.99 3.11 5.85 -0.40 -1.34 115.31 123.09 1f6p h LEU 26 Ca 0.32 0.02 0.04 0.00 0.84 0.00 0.00 57.88 59.11 1f6p h LEU 26 Cb -0.10 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.83 1f6p h LEU 26 CO -0.07 0.24 0.65 0.03 -0.34 0.00 0.00 178.44 178.95 1f6p h ARG 27 N 0.46 1.20 -0.63 1.25 3.08 -0.95 -0.39 114.38 118.40 1f6p h ARG 27 Ca 0.20 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 1f6p h ARG 27 Cb 0.10 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 1f6p h ARG 27 CO -0.14 0.80 0.20 1.96 -1.07 0.00 0.00 179.97 181.72 1f6p h GLN 28 N 1.24 0.95 -0.27 0.04 4.20 -0.62 0.90 115.11 121.54 1f6p h GLN 28 Ca 0.40 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 1f6p h GLN 28 Cb 0.02 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1f6p h GLN 28 CO -0.13 0.81 -0.02 0.82 -0.67 0.00 0.00 178.83 179.64 1f6p h ILE 29 N 0.92 1.27 -0.11 2.54 2.04 0.01 0.32 117.51 124.50 1f6p h ILE 29 Ca 0.21 -0.98 0.03 0.00 1.00 0.00 0.00 64.86 65.13 1f6p h ILE 29 Cb 0.25 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 1f6p h ILE 29 CO -0.01 0.31 -0.12 0.40 0.00 0.00 0.00 178.15 178.73 1f6p h ILE 30 N 0.27 0.68 -0.73 -0.67 2.04 -1.07 -0.61 117.51 117.41 1f6p h ILE 30 Ca 0.07 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.00 1f6p h ILE 30 Cb 0.46 0.68 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1f6p h ILE 30 CO 0.02 0.00 0.48 0.03 0.00 0.00 0.00 178.15 178.68 1f6p h ARG 31 N -0.14 0.73 -0.51 2.37 2.47 -0.61 0.47 114.38 119.16 1f6p h ARG 31 Ca 0.08 -0.04 -0.12 0.00 -1.26 0.00 0.00 59.98 58.63 1f6p h ARG 31 Cb 0.26 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.40 1f6p h ARG 31 CO -0.20 0.48 -0.17 1.25 0.56 0.00 0.00 179.97 181.90 1f6p h HIS 32 N 0.75 1.15 -0.32 3.04 2.76 0.36 -1.54 115.15 121.34 1f6p h HIS 32 Ca 0.32 -0.26 -0.04 0.00 -2.20 0.00 0.00 60.37 58.19 1f6p h HIS 32 Cb 0.27 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 1f6p h HIS 32 CO -0.00 1.09 0.05 -0.91 -1.30 0.00 0.00 177.93 176.86 1f6p h ASN 33 N 0.88 0.51 0.23 3.26 2.35 0.56 -2.23 115.58 121.14 1f6p h ASN 33 Ca 0.12 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.60 1f6p h ASN 33 Cb 0.75 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1f6p h ASN 33 CO 0.06 0.63 -0.11 0.40 -1.65 0.00 0.00 177.43 176.76 1f6p h ILE 34 N 0.36 0.80 -0.05 2.81 2.04 -1.05 -1.93 117.51 120.49 1f6p h ILE 34 Ca 0.10 -0.79 -0.08 0.00 1.00 0.00 0.00 64.86 65.09 1f6p h ILE 34 Cb 0.34 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1f6p h ILE 34 CO 0.01 0.16 -0.27 0.44 0.00 0.00 0.00 178.15 178.49 1f6p h ASP 35 N -0.75 0.32 0.01 1.72 3.32 -1.39 -3.14 116.42 116.51 1f6p h ASP 35 Ca -0.03 -0.67 -0.41 0.00 0.02 0.00 0.00 57.03 55.94 1f6p h ASP 35 Cb 0.50 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.89 1f6p h ASP 35 CO 0.05 0.94 -2.38 0.29 -1.72 0.00 0.00 179.24 176.42 1f6p n LYS 36 N -4.48 0.63 0.22 3.56 4.76 -0.87 -4.43 118.16 117.55 1f6p n LYS 36 Ca -0.09 0.23 0.14 0.00 -2.87 0.00 0.00 58.31 55.72 1f6p n LYS 36 Cb 0.48 -1.54 0.45 0.00 -1.84 0.00 0.00 35.03 32.58 1f6p n LYS 36 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 1f6p h MET 37 N -0.42 0.00 -4.73 1.97 2.86 -1.44 -3.46 114.93 109.72 1f6p h MET 37 Ca -0.60 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 56.66 1f6p h MET 37 Cb 1.77 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.43 1f6p h MET 37 CO -0.20 0.00 -0.56 1.63 1.06 0.00 0.00 176.91 178.83 1f6p n LYS 38 N -2.88 -3.99 -1.04 1.72 4.76 -0.74 -4.35 118.16 111.64 1f6p n LYS 38 Ca 0.03 0.73 -0.33 0.00 -2.87 0.00 0.00 58.31 55.86 1f6p n LYS 38 Cb 0.39 -5.50 0.13 0.00 -1.84 0.00 0.00 35.03 28.21 1f6p n LYS 38 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1f6p n VAL 39 N -4.19 1.71 0.17 -0.18 0.24 -1.11 -4.89 118.33 110.08 1f6p n VAL 39 Ca -0.09 -0.18 0.07 0.00 -2.04 0.00 0.00 64.34 62.11 1f6p n VAL 39 Cb 0.59 -1.16 0.09 0.00 -1.47 0.00 0.00 33.84 31.90 1f6p n VAL 39 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1f6p h ASP 40 N -1.06 0.00 -5.56 -1.34 3.32 0.56 -3.47 116.42 108.88 1f6p h ASP 40 Ca -0.46 0.00 0.25 0.00 0.02 0.00 0.00 57.03 56.84 1f6p h ASP 40 Cb 1.30 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.76 1f6p h ASP 40 CO 0.45 0.27 0.67 -0.83 -1.72 0.00 0.00 179.24 178.08 1f6p s GLY 41 N -4.35 -0.22 0.09 2.75 0.00 -1.01 -2.04 107.32 102.54 1f6p s GLY 41 Ca 0.05 0.24 0.08 0.00 0.00 0.00 0.00 44.72 45.09 1f6p s GLY 41 CO 0.71 1.05 -0.16 1.08 0.00 0.00 0.00 173.10 175.79 1f6p s LEU 42 N -3.13 2.76 -0.39 0.66 1.43 -0.25 -1.64 118.68 118.12 1f6p s LEU 42 Ca 0.16 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.77 1f6p s LEU 42 Cb 0.01 -1.61 0.10 0.00 0.03 0.00 0.00 46.19 44.72 1f6p s LEU 42 CO 0.00 0.20 0.16 -0.47 0.23 0.00 0.00 176.35 176.48 1f6p s TYR 43 N -1.09 3.53 -0.08 0.29 5.04 -0.34 -1.60 117.35 123.10 1f6p s TYR 43 Ca 0.18 -2.31 -0.10 0.00 -2.44 0.00 0.00 57.07 52.39 1f6p s TYR 43 Cb -0.11 -3.00 -0.05 0.00 0.35 0.00 0.00 41.96 39.16 1f6p s TYR 43 CO 0.09 -0.94 0.25 0.08 -1.34 0.00 0.00 175.55 173.69 1f6p s VAL 44 N 1.16 5.32 0.00 3.14 1.01 -0.26 -1.75 120.40 129.03 1f6p s VAL 44 Ca 0.06 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1f6p s VAL 44 Cb -0.22 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.63 1f6p s VAL 44 CO -0.04 0.59 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1f6p n GLY 45 N 2.04 0.54 0.54 4.51 0.00 -1.26 -0.01 105.19 111.54 1f6p n GLY 45 Ca -0.17 -0.75 -0.04 0.00 0.00 0.00 0.00 46.02 45.06 1f6p n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f6p n GLY 46 N -2.76 -0.56 0.37 -0.02 0.00 -1.26 -4.62 105.19 96.34 1f6p n GLY 46 Ca 0.00 -1.77 0.04 0.00 0.00 0.00 0.00 46.02 44.29 1f6p n GLY 46 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1f6p h SER 47 N -0.19 0.93 0.14 1.61 0.02 -1.96 -2.05 113.55 112.05 1f6p h SER 47 Ca -0.06 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1f6p h SER 47 Cb 0.17 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.51 1f6p h SER 47 CO 0.04 0.59 -0.11 0.74 -1.14 0.00 0.00 176.83 176.95 1f6p h THR 48 N 1.05 0.98 0.00 -2.27 2.02 -1.91 0.32 112.91 113.11 1f6p h THR 48 Ca 0.41 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1f6p h THR 48 Cb 0.22 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1f6p h THR 48 CO -0.16 0.11 0.00 0.61 0.37 0.00 0.00 175.52 176.45 1f6p n GLY 49 N -1.14 -0.82 2.42 2.16 0.00 -0.77 -4.50 105.19 102.55 1f6p n GLY 49 Ca -0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 1f6p n GLY 49 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1f6p n GLU 50 N -1.15 -1.35 -0.13 1.61 1.02 0.10 -4.47 120.64 116.26 1f6p n GLU 50 Ca 0.12 0.99 -0.04 0.00 -0.02 0.00 0.00 57.16 58.21 1f6p n GLU 50 Cb 0.12 -5.39 0.04 0.00 -0.02 0.00 0.00 31.44 26.20 1f6p n GLU 50 CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 1f6p h ASN 51 N 0.00 0.12 0.00 1.62 -0.73 -1.72 -2.24 115.58 112.64 1f6p h ASN 51 Ca -0.40 0.06 0.00 0.00 1.87 0.00 0.00 56.30 57.82 1f6p h ASN 51 Cb 1.25 0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.89 1f6p h ASN 51 CO 0.52 0.10 0.00 0.49 -0.37 0.00 0.00 177.43 178.17 1f6p n PHE 52 N -5.03 0.00 0.66 0.67 3.72 -1.26 -1.86 117.46 114.36 1f6p n PHE 52 Ca 0.03 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.54 1f6p n PHE 52 Cb 0.17 0.00 0.13 0.00 -0.94 0.00 0.00 39.48 38.84 1f6p n PHE 52 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1f6p n MET 53 N -0.73 2.14 -4.10 -1.08 2.81 -0.84 -5.02 117.12 110.29 1f6p n MET 53 Ca 0.09 -1.94 -0.24 0.00 -1.81 0.00 0.00 57.70 53.81 1f6p n MET 53 Cb 0.04 -1.43 -0.07 0.00 -0.71 0.00 0.00 33.22 31.05 1f6p n MET 53 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1f6p s LEU 54 N -1.65 3.19 0.78 4.03 1.43 -0.78 -4.99 118.68 120.70 1f6p s LEU 54 Ca 0.29 -0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 52.38 1f6p s LEU 54 Cb 0.19 -1.62 0.06 0.00 0.03 0.00 0.00 46.19 44.85 1f6p s LEU 54 CO 0.28 -0.39 1.12 -0.94 0.23 0.00 0.00 176.35 176.65 1f6p s SER 55 N -3.86 4.71 0.20 2.29 1.04 -1.26 -4.86 113.70 111.95 1f6p s SER 55 Ca 0.39 1.07 -0.10 0.00 0.48 0.00 0.00 55.95 57.78 1f6p s SER 55 Cb -0.00 -1.74 0.13 0.00 0.10 0.00 0.00 66.02 64.51 1f6p s SER 55 CO 0.23 -1.81 1.81 0.74 0.98 0.00 0.00 173.24 175.19 1f6p h THR 56 N -0.98 1.22 -0.13 2.02 2.02 -1.99 -0.93 112.91 114.15 1f6p h THR 56 Ca -0.46 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.16 1f6p h THR 56 Cb 1.29 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1f6p h THR 56 CO 0.63 0.25 0.08 -0.08 0.37 0.00 0.00 175.52 176.76 1f6p h GLU 57 N 0.99 0.17 -0.89 6.66 4.57 -1.99 -0.89 114.58 123.20 1f6p h GLU 57 Ca 0.25 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.44 1f6p h GLU 57 Cb 0.05 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.55 1f6p h GLU 57 CO -0.04 0.14 0.59 0.93 -1.18 0.00 0.00 179.01 179.45 1f6p h GLU 58 N 0.15 1.13 -0.18 1.92 5.08 -1.88 -0.59 114.58 120.22 1f6p h GLU 58 Ca 0.05 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 1f6p h GLU 58 Cb 0.01 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1f6p h GLU 58 CO -0.01 0.75 -0.25 0.87 -1.00 0.00 0.00 179.01 179.37 1f6p h LYS 59 N 1.17 0.33 -0.58 2.33 1.57 -0.72 -1.87 116.57 118.79 1f6p h LYS 59 Ca 0.33 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.91 1f6p h LYS 59 Cb -0.08 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1f6p h LYS 59 CO -0.08 0.57 0.01 0.87 -0.57 0.00 0.00 179.45 180.24 1f6p h LYS 60 N 0.30 1.02 -0.00 3.15 1.57 0.15 -2.23 116.57 120.53 1f6p h LYS 60 Ca 0.05 -0.32 -0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1f6p h LYS 60 Cb 0.61 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1f6p h LYS 60 CO 0.04 1.01 0.00 0.93 -0.57 0.00 0.00 179.45 180.86 1f6p h GLU 61 N 0.92 0.00 -0.61 3.15 4.39 -0.80 0.58 114.58 122.20 1f6p h GLU 61 Ca 0.17 -0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.98 1f6p h GLU 61 Cb 0.54 -0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.10 1f6p h GLU 61 CO 0.03 0.15 0.14 0.82 -1.16 0.00 0.00 179.01 178.98 1f6p h ILE 62 N -0.14 0.64 -0.44 3.13 2.04 -1.29 0.34 117.51 121.79 1f6p h ILE 62 Ca 0.00 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1f6p h ILE 62 Cb 0.14 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 1f6p h ILE 62 CO -0.00 0.05 0.15 -0.26 0.00 0.00 0.00 178.15 178.09 1f6p h PHE 63 N 0.27 0.64 -0.05 1.37 0.04 -1.04 -1.45 116.94 116.73 1f6p h PHE 63 Ca 0.32 -0.03 -0.03 0.00 2.80 0.00 0.00 57.97 61.02 1f6p h PHE 63 Cb 0.47 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.43 1f6p h PHE 63 CO -0.24 0.52 -0.10 -0.09 -0.60 0.00 0.00 178.31 177.80 1f6p h ARG 64 N 0.63 0.16 -0.57 1.51 2.43 0.19 -2.74 114.38 115.99 1f6p h ARG 64 Ca 0.15 -0.10 0.05 0.00 -0.81 0.00 0.00 59.98 59.27 1f6p h ARG 64 Cb 0.18 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.69 1f6p h ARG 64 CO -0.01 0.69 0.30 0.82 -1.51 0.00 0.00 179.97 180.26 1f6p h ILE 65 N -0.35 0.96 -0.57 1.20 2.04 -0.69 -2.25 117.51 117.85 1f6p h ILE 65 Ca 0.00 -0.20 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1f6p h ILE 65 Cb 0.69 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1f6p h ILE 65 CO 0.02 0.10 0.10 0.00 0.00 0.00 0.00 178.15 178.38 1f6p h ALA 66 N 1.30 0.76 -0.62 1.87 0.00 -1.32 0.49 119.26 121.76 1f6p h ALA 66 Ca 0.25 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1f6p h ALA 66 Cb 0.15 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1f6p h ALA 66 CO -0.17 0.50 0.11 -0.22 0.00 0.00 0.00 179.25 179.48 1f6p h LYS 67 N 0.84 1.01 -0.20 0.00 1.63 -1.33 -0.82 116.57 117.70 1f6p h LYS 67 Ca 0.18 -0.26 -0.15 0.00 -0.85 0.00 0.00 60.65 59.56 1f6p h LYS 67 Cb 0.40 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.91 1f6p h LYS 67 CO 0.01 0.94 -0.45 0.22 -3.45 0.00 0.00 179.45 176.72 1f6p h ASP 68 N 0.92 0.74 -0.08 4.20 3.58 -1.29 -0.62 116.42 123.86 1f6p h ASP 68 Ca 0.19 -0.56 -0.16 0.00 0.42 0.00 0.00 57.03 56.91 1f6p h ASP 68 Cb 0.41 -0.21 0.01 0.00 1.72 0.00 0.00 39.33 41.25 1f6p h ASP 68 CO 0.01 1.17 -0.59 -0.08 -2.88 0.00 0.00 179.24 176.87 1f6p h GLU 69 N 0.34 0.54 0.01 0.28 4.57 -0.89 -3.31 114.58 116.12 1f6p h GLU 69 Ca -0.00 -0.47 -0.19 0.00 -1.18 0.00 0.00 59.36 57.51 1f6p h GLU 69 Cb 1.06 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 1f6p h GLU 69 CO 0.10 1.10 -0.91 0.00 -1.18 0.00 0.00 179.01 178.12 1f6p h ALA 70 N 0.45 0.51 -0.95 2.92 0.00 -1.23 -3.49 119.26 117.48 1f6p h ALA 70 Ca -0.05 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1f6p h ALA 70 Cb 1.24 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1f6p h ALA 70 CO 0.12 1.08 0.00 1.63 0.00 0.00 0.00 179.25 182.08 1f6p n LYS 71 N -3.50 0.00 -0.10 0.00 5.02 -0.24 -2.12 118.16 117.22 1f6p n LYS 71 Ca -0.01 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.34 1f6p n LYS 71 Cb 0.85 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.97 1f6p n LYS 71 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1f6p n ASP 72 N 7.44 2.47 -0.15 4.39 8.00 -1.26 -4.72 116.55 132.71 1f6p n ASP 72 Ca 0.00 -2.63 -0.06 0.00 0.71 0.00 0.00 54.79 52.82 1f6p n ASP 72 Cb 0.00 -0.28 0.03 0.00 -0.02 0.00 0.00 41.12 40.85 1f6p n ASP 72 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1f6p h GLN 73 N 0.38 0.50 -4.96 -1.24 4.20 -1.83 -3.46 115.11 108.71 1f6p h GLN 73 Ca 0.00 -0.03 -0.42 0.00 0.06 0.00 0.00 58.65 58.26 1f6p h GLN 73 Cb 0.87 -0.11 -0.14 0.00 0.30 0.00 0.00 27.48 28.39 1f6p h GLN 73 CO 0.03 0.33 -0.58 0.96 -0.67 0.00 0.00 178.83 178.90 1f6p s ILE 74 N -6.14 0.57 0.29 2.54 -4.36 -1.26 -5.08 121.20 107.76 1f6p s ILE 74 Ca -0.13 -2.00 -0.28 0.00 -0.26 0.00 0.00 60.65 57.98 1f6p s ILE 74 Cb 0.13 -2.57 -0.09 0.00 1.25 0.00 0.00 42.46 41.17 1f6p s ILE 74 CO 0.73 0.00 1.00 0.00 0.24 0.00 0.00 174.94 176.92 1f6p s ALA 75 N -3.55 3.30 -0.10 2.27 0.00 -0.87 -4.96 121.76 117.86 1f6p s ALA 75 Ca 0.35 0.70 0.01 0.00 0.00 0.00 0.00 51.96 53.02 1f6p s ALA 75 Cb 0.06 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.95 1f6p s ALA 75 CO 0.16 0.03 -0.12 -0.51 0.00 0.00 0.00 175.76 175.32 1f6p s LEU 76 N -1.62 1.54 -0.15 0.00 1.43 -1.26 -1.09 118.68 117.53 1f6p s LEU 76 Ca 0.46 -0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.19 1f6p s LEU 76 Cb -0.26 -0.94 -0.02 0.00 0.03 0.00 0.00 46.19 45.00 1f6p s LEU 76 CO 0.33 -0.02 -0.09 -0.63 0.23 0.00 0.00 176.35 176.16 1f6p s ILE 77 N 1.13 3.35 -0.35 -0.59 1.01 -0.63 -1.26 121.20 123.87 1f6p s ILE 77 Ca -0.05 -0.55 -0.08 0.00 0.00 0.00 0.00 60.65 59.97 1f6p s ILE 77 Cb -0.14 -2.44 0.03 0.00 0.01 0.00 0.00 42.46 39.91 1f6p s ILE 77 CO -0.03 0.50 0.14 0.00 0.00 0.00 0.00 174.94 175.56 1f6p s ALA 78 N 0.53 3.15 -0.31 9.38 0.00 -0.39 -1.10 121.76 133.03 1f6p s ALA 78 Ca -0.06 -1.69 -0.29 0.00 0.00 0.00 0.00 51.96 49.92 1f6p s ALA 78 Cb -0.15 -2.39 0.02 0.00 0.00 0.00 0.00 23.12 20.60 1f6p s ALA 78 CO 0.03 -1.29 1.06 -1.14 0.00 0.00 0.00 175.76 174.42 1f6p s GLN 79 N 1.48 4.09 0.00 0.00 -0.44 0.98 -0.63 119.66 125.14 1f6p s GLN 79 Ca 0.01 1.09 0.00 0.00 -2.50 0.00 0.00 55.36 53.95 1f6p s GLN 79 Cb -0.19 -3.72 0.00 0.00 -1.64 0.00 0.00 33.01 27.46 1f6p s GLN 79 CO 0.04 -0.85 0.87 1.33 0.50 0.00 0.00 175.29 177.18 1f6p n VAL 80 N 5.78 0.75 -1.21 1.34 0.24 0.68 -4.59 118.33 121.31 1f6p n VAL 80 Ca 0.12 -0.77 -0.33 0.00 -2.04 0.00 0.00 64.34 61.32 1f6p n VAL 80 Cb 0.47 0.64 0.11 0.00 -1.47 0.00 0.00 33.84 33.59 1f6p n VAL 80 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1f6p s GLY 81 N -0.75 2.04 0.03 7.63 0.00 -1.24 -4.11 107.32 110.92 1f6p s GLY 81 Ca 0.00 0.68 -0.29 0.00 0.00 0.00 0.00 44.72 45.12 1f6p s GLY 81 CO 0.00 1.08 1.21 -0.45 0.00 0.00 0.00 173.10 174.95 1f6p s SER 82 N -2.45 -0.08 0.22 1.64 0.15 -1.26 -4.75 113.70 107.16 1f6p s SER 82 Ca 0.70 -0.21 0.07 0.00 0.70 0.00 0.00 55.95 57.21 1f6p s SER 82 Cb -0.25 0.24 0.16 0.00 -1.71 0.00 0.00 66.02 64.46 1f6p s SER 82 CO 0.50 -0.44 1.49 0.58 1.20 0.00 0.00 173.24 176.57 1f6p h VAL 83 N 2.00 1.50 -2.88 4.45 2.07 -1.94 -3.39 116.25 118.07 1f6p h VAL 83 Ca -0.29 -2.46 -0.59 0.00 0.82 0.00 0.00 66.70 64.18 1f6p h VAL 83 Cb 1.21 2.33 -0.11 0.00 -1.52 0.00 0.00 31.29 33.20 1f6p h VAL 83 CO 0.28 0.71 0.75 0.21 0.02 0.00 0.00 177.57 179.54 1f6p s ASN 84 N -6.84 6.28 0.32 0.57 3.84 -1.26 -4.93 114.94 112.92 1f6p s ASN 84 Ca -0.01 -0.44 0.03 0.00 0.21 0.00 0.00 52.86 52.65 1f6p s ASN 84 Cb 0.12 -2.48 0.55 0.00 -0.55 0.00 0.00 41.25 38.88 1f6p s ASN 84 CO 0.79 -1.47 1.85 0.25 -2.79 0.00 0.00 177.10 175.73 1f6p h LEU 85 N 11.71 0.53 -0.98 3.21 5.85 -2.00 -0.21 115.31 133.43 1f6p h LEU 85 Ca -0.27 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.29 1f6p h LEU 85 Cb 1.06 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1f6p h LEU 85 CO 1.17 0.61 0.19 0.11 -0.34 0.00 0.00 178.44 180.18 1f6p h LYS 86 N 0.54 0.93 -0.53 1.25 1.57 -1.96 -0.15 116.57 118.22 1f6p h LYS 86 Ca 0.11 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1f6p h LYS 86 Cb 0.37 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1f6p h LYS 86 CO 0.01 0.80 -0.12 1.49 -0.57 0.00 0.00 179.45 181.07 1f6p h GLU 87 N 0.90 1.02 -0.53 3.15 4.81 -1.74 -1.26 114.58 120.93 1f6p h GLU 87 Ca 0.20 -0.38 -0.02 0.00 -0.13 0.00 0.00 59.36 59.04 1f6p h GLU 87 Cb 0.26 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1f6p h GLU 87 CO -0.01 1.06 0.27 0.00 -0.73 0.00 0.00 179.01 179.60 1f6p h ALA 88 N 0.95 0.69 0.06 2.92 0.00 -0.54 -0.51 119.26 122.83 1f6p h ALA 88 Ca 0.14 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1f6p h ALA 88 Cb 0.68 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1f6p h ALA 88 CO 0.05 0.24 -0.03 0.28 0.00 0.00 0.00 179.25 179.78 1f6p h VAL 89 N 0.71 1.03 -0.43 0.00 2.07 -0.94 0.24 116.25 118.93 1f6p h VAL 89 Ca 0.18 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.46 1f6p h VAL 89 Cb 0.10 1.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1f6p h VAL 89 CO -0.03 0.08 0.15 -0.08 0.02 0.00 0.00 177.57 177.71 1f6p h GLU 90 N -0.22 0.30 -0.47 1.57 4.81 -0.83 0.34 114.58 120.08 1f6p h GLU 90 Ca -0.01 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1f6p h GLU 90 Cb 0.19 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1f6p h GLU 90 CO 0.01 0.20 0.11 -0.07 -0.73 0.00 0.00 179.01 178.53 1f6p h LEU 91 N 0.31 0.72 -0.24 1.64 3.38 -1.10 -0.75 115.31 119.27 1f6p h LEU 91 Ca 0.20 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1f6p h LEU 91 Cb 0.19 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1f6p h LEU 91 CO -0.21 0.78 0.00 1.23 0.09 0.00 0.00 178.44 180.33 1f6p h GLY 92 N 0.64 0.24 1.23 0.83 0.00 0.31 0.20 103.07 106.52 1f6p h GLY 92 Ca 0.15 0.02 -0.07 0.00 0.00 0.00 0.00 47.33 47.43 1f6p h GLY 92 CO 0.00 -0.04 0.10 0.50 0.00 0.00 0.00 176.54 177.10 1f6p h LYS 93 N 0.08 0.95 -0.11 4.80 1.57 -0.07 -0.80 116.57 123.00 1f6p h LYS 93 Ca 0.11 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1f6p h LYS 93 Cb 0.14 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1f6p h LYS 93 CO -0.19 0.87 0.03 -0.92 -0.57 0.00 0.00 179.45 178.68 1f6p h TYR 94 N 0.90 0.17 -0.66 -1.35 3.20 -0.63 0.52 116.97 119.11 1f6p h TYR 94 Ca 0.19 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.99 1f6p h TYR 94 Cb 0.38 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1f6p h TYR 94 CO 0.02 0.32 0.22 0.00 -1.64 0.00 0.00 178.16 177.08 1f6p h ALA 95 N 0.84 0.87 -0.26 1.82 0.00 -0.42 0.20 119.26 122.30 1f6p h ALA 95 Ca 0.03 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1f6p h ALA 95 Cb 0.23 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1f6p h ALA 95 CO -0.00 0.53 0.15 1.15 0.00 0.00 0.00 179.25 181.08 1f6p h THR 96 N 0.96 1.10 -0.26 0.00 2.02 -0.87 -2.31 112.91 113.56 1f6p h THR 96 Ca 0.22 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1f6p h THR 96 Cb 0.28 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1f6p h THR 96 CO -0.01 0.10 0.07 -0.33 0.37 0.00 0.00 175.52 175.73 1f6p h GLU 97 N 0.32 0.36 0.00 6.66 5.08 -0.06 -1.42 114.58 125.52 1f6p h GLU 97 Ca 0.09 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1f6p h GLU 97 Cb 0.03 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1f6p h GLU 97 CO -0.02 0.33 0.00 -0.07 -1.00 0.00 0.00 179.01 178.26 1f6p h LEU 98 N 0.36 0.00 0.00 1.33 3.38 -0.35 -3.47 115.31 116.56 1f6p h LEU 98 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1f6p h LEU 98 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1f6p h LEU 98 CO -0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.13 1f6p n GLY 99 N 0.11 0.93 3.50 0.83 0.00 -0.54 -5.04 105.19 104.99 1f6p n GLY 99 Ca 0.01 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1f6p n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1f6p n TYR 100 N -2.13 -0.18 0.03 1.61 4.02 -0.91 -4.89 117.16 114.71 1f6p n TYR 100 Ca 0.00 0.49 -0.08 0.00 -0.01 0.00 0.00 57.90 58.31 1f6p n TYR 100 Cb 0.00 -2.03 0.09 0.00 -0.02 0.00 0.00 39.34 37.38 1f6p n TYR 100 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1f6p h ASP 101 N 0.59 0.50 -5.08 7.72 3.32 -1.53 -3.46 116.42 118.48 1f6p h ASP 101 Ca -0.45 -0.26 -0.05 0.00 0.02 0.00 0.00 57.03 56.29 1f6p h ASP 101 Cb 1.39 -0.14 -0.13 0.00 0.22 0.00 0.00 39.33 40.66 1f6p h ASP 101 CO 0.50 0.94 -0.10 0.00 -1.72 0.00 0.00 179.24 178.87 1f6p s LEU 103 N -2.81 3.86 0.07 0.00 1.43 -0.62 -1.26 118.68 119.35 1f6p s LEU 103 Ca 0.03 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1f6p s LEU 103 Cb 0.02 -2.50 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 1f6p s LEU 103 CO -0.12 -0.28 -0.08 -0.55 0.23 0.00 0.00 176.35 175.56 1f6p s SER 104 N -4.02 1.03 -0.16 2.29 0.15 0.19 -0.70 113.70 112.48 1f6p s SER 104 Ca 0.40 -0.74 -0.09 0.00 0.70 0.00 0.00 55.95 56.22 1f6p s SER 104 Cb -0.08 0.05 0.06 0.00 -1.71 0.00 0.00 66.02 64.34 1f6p s SER 104 CO 0.28 -0.30 0.39 0.00 1.20 0.00 0.00 173.24 174.81 1f6p s ALA 105 N -2.26 -0.98 0.45 5.45 0.00 -0.75 -0.23 121.76 123.45 1f6p s ALA 105 Ca -0.01 1.44 -0.24 0.00 0.00 0.00 0.00 51.96 53.15 1f6p s ALA 105 Cb -0.04 -0.87 -0.07 0.00 0.00 0.00 0.00 23.12 22.13 1f6p s ALA 105 CO -0.01 -0.25 1.27 0.54 0.00 0.00 0.00 175.76 177.30 1f6p s VAL 106 N 1.33 2.66 0.30 0.00 0.11 -1.26 -1.53 120.40 122.00 1f6p s VAL 106 Ca -0.09 0.54 -0.30 0.00 -2.93 0.00 0.00 61.98 59.20 1f6p s VAL 106 Cb -0.08 -3.30 -0.12 0.00 -1.53 0.00 0.00 36.38 31.35 1f6p s VAL 106 CO -0.12 0.04 1.47 0.35 -3.33 0.00 0.00 175.10 173.51 1f6p n THR 107 N -0.30 1.30 -1.75 5.04 -2.24 -1.13 -4.49 114.28 110.71 1f6p n THR 107 Ca 0.06 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 61.10 1f6p n THR 107 Cb 0.45 -1.75 -0.01 0.00 -2.10 0.00 0.00 70.33 66.92 1f6p n THR 107 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1f6p n PRO 108 N 1.62 2.67 -1.07 -0.78 -0.04 -1.26 -4.91 135.00 131.22 1f6p n PRO 108 Ca 0.08 0.94 0.00 0.00 -0.04 0.00 0.00 63.50 64.48 1f6p n PRO 108 Cb 0.35 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.11 1f6p n PRO 108 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1f6p n PHE 109 N 1.57 0.00 0.00 0.54 -1.74 -1.26 -4.79 117.46 111.78 1f6p n PHE 109 Ca 0.06 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.95 1f6p n PHE 109 Cb 0.37 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.37 1f6p n PHE 109 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 1f6p n TYR 110 N 0.00 0.00 -1.74 2.97 9.36 -1.26 -4.82 117.16 121.67 1f6p n TYR 110 Ca 0.00 0.00 -0.39 0.00 3.32 0.00 0.00 57.90 60.83 1f6p n TYR 110 Cb 0.00 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 38.75 1f6p n TYR 110 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1f6p n TYR 111 N 0.00 2.30 -2.28 2.98 4.01 -1.26 -4.96 117.16 117.95 1f6p n TYR 111 Ca 0.00 0.43 -0.43 0.00 -0.16 0.00 0.00 57.90 57.74 1f6p n TYR 111 Cb 0.00 -2.36 0.00 0.00 -0.31 0.00 0.00 39.34 36.67 1f6p n TYR 111 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1f6p n LYS 112 N -1.04 3.19 -1.99 -0.72 4.76 -1.26 -5.01 118.16 116.10 1f6p n LYS 112 Ca 0.11 -3.18 -0.38 0.00 -2.87 0.00 0.00 58.31 51.99 1f6p n LYS 112 Cb 0.45 -3.23 0.02 0.00 -1.84 0.00 0.00 35.03 30.43 1f6p n LYS 112 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1f6p s PHE 113 N 2.60 2.52 0.68 2.13 0.08 -1.26 -5.01 117.98 119.72 1f6p s PHE 113 Ca 0.47 1.45 -0.09 0.00 0.12 0.00 0.00 56.93 58.87 1f6p s PHE 113 Cb 0.08 -3.61 0.03 0.00 -0.57 0.00 0.00 43.02 38.94 1f6p s PHE 113 CO -0.01 -2.30 1.03 -1.54 -0.10 0.00 0.00 175.22 172.29 1f6p s SER 114 N -1.16 5.31 0.19 1.36 1.04 -1.26 -4.85 113.70 114.32 1f6p s SER 114 Ca 0.69 0.86 -0.15 0.00 0.48 0.00 0.00 55.95 57.83 1f6p s SER 114 Cb -0.35 -1.67 0.17 0.00 0.10 0.00 0.00 66.02 64.26 1f6p s SER 114 CO 0.41 -1.34 1.66 0.15 0.98 0.00 0.00 173.24 175.10 1f6p h PHE 115 N -0.53 -0.22 0.00 5.02 3.57 -1.99 -0.47 116.94 122.32 1f6p h PHE 115 Ca -0.45 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.04 1f6p h PHE 115 Cb 1.27 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 40.18 1f6p h PHE 115 CO 0.45 -0.20 -0.24 -1.35 -2.23 0.00 0.00 178.31 174.74 1f6p h PRO 116 N 0.02 0.00 -0.26 6.41 0.11 -1.98 0.45 132.00 136.76 1f6p h PRO 116 Ca 0.25 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.24 1f6p h PRO 116 Cb 0.38 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1f6p h PRO 116 CO -0.50 0.24 -0.28 0.93 -0.21 0.00 0.00 178.00 178.18 1f6p h GLU 117 N 0.00 0.64 -0.16 1.05 5.08 -1.56 -0.24 114.58 119.38 1f6p h GLU 117 Ca -0.00 -0.35 0.02 0.00 -1.00 0.00 0.00 59.36 58.03 1f6p h GLU 117 Cb 0.58 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1f6p h GLU 117 CO 0.03 0.95 0.02 0.82 -1.00 0.00 0.00 179.01 179.83 1f6p h ILE 118 N 0.36 0.92 -0.52 3.13 2.04 0.62 -0.59 117.51 123.47 1f6p h ILE 118 Ca 0.04 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1f6p h ILE 118 Cb 0.84 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 1f6p h ILE 118 CO 0.07 0.02 0.34 0.50 0.00 0.00 0.00 178.15 179.07 1f6p h LYS 119 N 0.08 0.68 -0.49 2.37 3.64 -0.20 -2.33 116.57 120.32 1f6p h LYS 119 Ca 0.07 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1f6p h LYS 119 Cb 0.07 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 1f6p h LYS 119 CO -0.11 0.45 0.25 1.25 -2.27 0.00 0.00 179.45 179.03 1f6p h HIS 120 N 0.70 0.67 -0.14 1.91 2.76 -0.81 0.11 115.15 120.34 1f6p h HIS 120 Ca 0.19 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1f6p h HIS 120 Cb -0.08 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 28.66 1f6p h HIS 120 CO -0.04 0.48 0.09 -0.92 -1.30 0.00 0.00 177.93 176.24 1f6p h TYR 121 N 0.69 0.19 -0.15 5.26 5.03 -0.77 -1.12 116.97 126.09 1f6p h TYR 121 Ca 0.17 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.48 1f6p h TYR 121 Cb 0.05 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.26 1f6p h TYR 121 CO 0.00 0.15 0.06 1.88 -1.32 0.00 0.00 178.16 178.93 1f6p h TYR 122 N 0.17 0.23 -0.94 -3.82 0.05 -0.86 -2.68 116.97 109.13 1f6p h TYR 122 Ca 0.05 -0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 1f6p h TYR 122 Cb 0.01 -0.07 -0.05 0.00 1.01 0.00 0.00 36.73 37.64 1f6p h TYR 122 CO -0.06 0.31 0.58 -0.44 -1.05 0.00 0.00 178.16 177.51 1f6p h ASP 123 N 0.08 1.11 -0.09 3.88 3.32 -0.98 -2.17 116.42 121.57 1f6p h ASP 123 Ca 0.05 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1f6p h ASP 123 Cb 0.18 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1f6p h ASP 123 CO -0.00 0.83 0.06 0.74 -1.72 0.00 0.00 179.24 179.15 1f6p h THR 124 N 1.28 1.05 -0.83 0.35 2.02 -1.19 -0.70 112.91 114.90 1f6p h THR 124 Ca 0.34 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.38 1f6p h THR 124 Cb -0.09 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 1f6p h THR 124 CO -0.07 0.05 0.52 0.40 0.37 0.00 0.00 175.52 176.79 1f6p h ILE 125 N 0.09 1.22 -0.57 3.11 2.04 -1.13 -1.53 117.51 120.74 1f6p h ILE 125 Ca 0.03 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 1f6p h ILE 125 Cb 0.03 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 1f6p h ILE 125 CO -0.01 0.23 0.12 0.40 0.00 0.00 0.00 178.15 178.89 1f6p h ILE 126 N 1.13 1.25 0.00 -0.67 2.04 -1.34 -2.74 117.51 117.19 1f6p h ILE 126 Ca 0.30 -0.93 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 1f6p h ILE 126 Cb -0.08 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1f6p h ILE 126 CO -0.06 0.34 -0.25 0.00 0.00 0.00 0.00 178.15 178.18 1f6p h ALA 127 N 1.02 1.43 -0.01 1.87 0.00 -0.83 0.83 119.26 123.57 1f6p h ALA 127 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1f6p h ALA 127 Cb 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1f6p h ALA 127 CO 0.01 0.31 -0.39 0.39 0.00 0.00 0.00 179.25 179.57 1f6p n GLU 128 N -4.01 0.55 0.00 0.00 -0.58 -0.60 -4.43 120.64 111.57 1f6p n GLU 128 Ca -0.02 -0.34 0.00 0.00 -0.42 0.00 0.00 57.16 56.38 1f6p n GLU 128 Cb 0.32 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 1f6p n GLU 128 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1f6p n THR 129 N -0.93 0.00 -0.92 2.62 -2.24 -0.61 -4.80 114.28 107.41 1f6p n THR 129 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1f6p n THR 129 Cb 0.35 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 1f6p n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f6p n GLY 130 N 2.78 0.51 3.96 3.38 0.00 0.28 -5.01 105.19 111.10 1f6p n GLY 130 Ca 0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 46.02 45.55 1f6p n GLY 130 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f6p s SER 131 N -2.24 6.17 0.70 1.61 0.01 -1.26 -5.09 113.70 113.59 1f6p s SER 131 Ca 0.00 -0.02 -0.16 0.00 1.31 0.00 0.00 55.95 57.08 1f6p s SER 131 Cb 0.00 -1.66 0.02 0.00 0.21 0.00 0.00 66.02 64.59 1f6p s SER 131 CO 0.00 -0.16 1.20 0.20 0.41 0.00 0.00 173.24 174.88 1f6p s ASN 132 N -4.02 4.47 -0.03 2.44 0.01 -1.26 -4.79 114.94 111.76 1f6p s ASN 132 Ca 0.37 2.32 0.03 0.00 -0.71 0.00 0.00 52.86 54.87 1f6p s ASN 132 Cb -0.09 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 38.99 1f6p s ASN 132 CO 0.29 -2.07 -0.11 -0.32 -1.51 0.00 0.00 177.10 173.38 1f6p s MET 133 N -3.84 1.17 -0.22 -0.60 -2.45 0.18 -1.59 119.30 111.95 1f6p s MET 133 Ca 0.74 -0.38 -0.03 0.00 -1.25 0.00 0.00 55.69 54.78 1f6p s MET 133 Cb -0.28 -1.06 0.01 0.00 1.25 0.00 0.00 34.83 34.74 1f6p s MET 133 CO 0.43 0.14 -0.07 0.42 1.05 0.00 0.00 175.02 176.99 1f6p s ILE 134 N 0.18 3.03 0.11 10.11 1.01 0.13 -0.83 121.20 134.93 1f6p s ILE 134 Ca -0.04 -0.71 -0.31 0.00 0.00 0.00 0.00 60.65 59.59 1f6p s ILE 134 Cb -0.09 -2.41 -0.08 0.00 0.01 0.00 0.00 42.46 39.88 1f6p s ILE 134 CO 0.01 0.38 1.49 -0.69 0.00 0.00 0.00 174.94 176.13 1f6p s VAL 135 N 1.41 3.10 -0.44 2.92 1.01 -0.28 -1.80 120.40 126.31 1f6p s VAL 135 Ca 0.04 0.72 -0.08 0.00 0.00 0.00 0.00 61.98 62.66 1f6p s VAL 135 Cb -0.15 -3.46 0.10 0.00 0.00 0.00 0.00 36.38 32.87 1f6p s VAL 135 CO -0.05 0.04 0.29 -0.47 0.00 0.00 0.00 175.10 174.90 1f6p s TYR 136 N 1.57 3.40 -0.26 5.22 5.04 -0.59 -0.21 117.35 131.52 1f6p s TYR 136 Ca 0.68 -1.77 -0.14 0.00 -2.44 0.00 0.00 57.07 53.40 1f6p s TYR 136 Cb -0.39 -3.21 -0.04 0.00 0.35 0.00 0.00 41.96 38.68 1f6p s TYR 136 CO 0.30 -0.92 0.35 -1.12 -1.34 0.00 0.00 175.55 172.82 1f6p s SER 137 N 2.32 6.25 -0.42 4.32 0.01 -1.01 -2.82 113.70 122.35 1f6p s SER 137 Ca 0.05 0.29 0.08 0.00 1.31 0.00 0.00 55.95 57.67 1f6p s SER 137 Cb -0.24 -2.20 0.25 0.00 0.21 0.00 0.00 66.02 64.04 1f6p s SER 137 CO 0.00 -0.15 0.67 0.00 0.41 0.00 0.00 173.24 174.18 1f6p n ILE 138 N 4.97 -0.42 -0.33 1.44 3.06 -1.26 -1.45 119.36 125.36 1f6p n ILE 138 Ca -0.09 -3.14 0.24 0.00 -2.50 0.00 0.00 62.75 57.26 1f6p n ILE 138 Cb 0.51 -0.61 0.52 0.00 0.54 0.00 0.00 39.64 40.59 1f6p n ILE 138 CO 0.00 0.00 0.00 -0.65 -2.50 0.00 0.00 176.55 173.40 1f6p h PRO 139 N 3.91 0.36 -0.28 9.51 0.11 -1.73 0.15 132.00 144.03 1f6p h PRO 139 Ca -0.01 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 1f6p h PRO 139 Cb 0.94 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1f6p h PRO 139 CO 0.41 0.24 -0.17 0.35 -0.21 0.00 0.00 178.00 178.61 1f6p h PHE 140 N 0.37 0.53 0.06 0.65 3.57 -1.91 0.15 116.94 120.36 1f6p h PHE 140 Ca 0.62 -0.09 -0.34 0.00 3.53 0.00 0.00 57.97 61.69 1f6p h PHE 140 Cb 1.60 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 40.17 1f6p h PHE 140 CO -0.00 0.64 -1.97 1.28 -2.23 0.00 0.00 178.31 176.03 1f6p n LEU 141 N -4.17 1.78 0.06 0.59 4.77 0.32 -4.61 117.00 115.74 1f6p n LEU 141 Ca 0.00 0.24 -0.16 0.00 -0.03 0.00 0.00 56.01 56.06 1f6p n LEU 141 Cb 0.35 -0.48 -0.14 0.00 -2.33 0.00 0.00 43.42 40.83 1f6p n LEU 141 CO 0.41 0.66 -0.32 0.71 -1.33 0.00 0.00 177.39 177.51 1f6p h THR 142 N 0.03 1.16 0.00 -5.08 1.35 -0.84 -3.48 112.91 106.06 1f6p h THR 142 Ca -0.40 -2.81 0.00 0.00 -0.55 0.00 0.00 66.41 62.66 1f6p h THR 142 Cb 2.03 2.76 0.00 0.00 -1.73 0.00 0.00 68.15 71.21 1f6p h THR 142 CO 0.06 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.76 1f6p n GLY 143 N 1.66 0.80 3.63 5.82 0.00 0.52 -4.66 105.19 112.96 1f6p n GLY 143 Ca -0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1f6p n GLY 143 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f6p s VAL 144 N -3.04 5.28 -0.22 1.61 1.01 -1.26 -5.05 120.40 118.72 1f6p s VAL 144 Ca 0.00 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.36 1f6p s VAL 144 Cb 0.00 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.83 1f6p s VAL 144 CO 0.00 0.26 -0.15 0.20 0.00 0.00 0.00 175.10 175.42 1f6p s ASN 145 N 1.34 3.86 0.11 3.32 0.01 -1.26 -4.20 114.94 118.12 1f6p s ASN 145 Ca 0.11 -1.07 -0.00 0.00 -0.71 0.00 0.00 52.86 51.19 1f6p s ASN 145 Cb -0.15 -1.50 -0.04 0.00 0.41 0.00 0.00 41.25 39.97 1f6p s ASN 145 CO 0.08 -0.11 0.27 -0.04 -1.51 0.00 0.00 177.10 175.78 1f6p s MET 146 N 1.19 3.47 0.54 -0.60 -1.94 -1.26 -5.13 119.30 115.57 1f6p s MET 146 Ca -0.03 -0.43 0.04 0.00 -1.71 0.00 0.00 55.69 53.56 1f6p s MET 146 Cb -0.17 -2.98 0.02 0.00 2.01 0.00 0.00 34.83 33.71 1f6p s MET 146 CO -0.08 0.55 0.25 0.20 -0.01 0.00 0.00 175.02 175.93 1f6p s GLY 147 N -2.74 2.64 0.20 -0.03 0.00 -1.26 -4.97 107.32 101.17 1f6p s GLY 147 Ca 0.36 -0.84 -0.10 0.00 0.00 0.00 0.00 44.72 44.13 1f6p s GLY 147 CO 0.28 -2.05 1.78 -2.22 0.00 0.00 0.00 173.10 170.89 1f6p h ILE 148 N 0.95 0.89 -0.60 0.90 1.08 -1.98 -1.54 117.51 117.23 1f6p h ILE 148 Ca -0.39 -0.18 -0.01 0.00 -0.39 0.00 0.00 64.86 63.88 1f6p h ILE 148 Cb 1.31 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 35.35 1f6p h ILE 148 CO 0.63 0.10 0.33 -0.08 -0.69 0.00 0.00 178.15 178.44 1f6p h GLU 149 N 0.52 0.83 -0.59 2.37 4.81 -1.99 -0.52 114.58 120.01 1f6p h GLU 149 Ca 0.28 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.35 1f6p h GLU 149 Cb 0.24 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 1f6p h GLU 149 CO -0.22 0.64 0.11 1.96 -0.73 0.00 0.00 179.01 180.76 1f6p h GLN 150 N 0.81 0.93 -0.53 1.92 4.20 -1.71 -2.28 115.11 118.45 1f6p h GLN 150 Ca 0.21 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1f6p h GLN 150 Cb 0.04 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1f6p h GLN 150 CO -0.03 0.86 0.05 0.74 -0.67 0.00 0.00 178.83 179.77 1f6p h PHE 151 N 0.89 0.92 -0.96 2.96 0.04 -0.79 -1.02 116.94 118.97 1f6p h PHE 151 Ca 0.18 -0.12 0.02 0.00 2.80 0.00 0.00 57.97 60.85 1f6p h PHE 151 Cb 0.37 -0.25 -0.05 0.00 2.20 0.00 0.00 35.95 38.22 1f6p h PHE 151 CO 0.02 0.81 0.63 0.78 -0.60 0.00 0.00 178.31 179.96 1f6p h GLY 152 N 0.99 1.36 0.80 -1.45 0.00 -0.70 0.15 103.07 104.21 1f6p h GLY 152 Ca 0.16 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1f6p h GLY 152 CO 0.01 0.47 0.01 0.83 0.00 0.00 0.00 176.54 177.86 1f6p h GLU 153 N 1.27 0.29 -0.96 4.80 4.39 -0.69 -2.26 114.58 121.41 1f6p h GLU 153 Ca 0.36 -0.09 0.10 0.00 0.34 0.00 0.00 59.36 60.07 1f6p h GLU 153 Cb -0.10 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.45 1f6p h GLU 153 CO -0.09 0.49 0.62 -0.07 -1.16 0.00 0.00 179.01 178.80 1f6p h LEU 154 N 0.04 0.90 0.00 1.33 3.38 -0.90 -2.14 115.31 117.92 1f6p h LEU 154 Ca 0.05 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1f6p h LEU 154 Cb 0.36 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1f6p h LEU 154 CO 0.01 0.52 0.00 -1.22 0.09 0.00 0.00 178.44 177.84 1f6p n TYR 155 N -4.55 0.00 0.18 1.13 4.01 0.49 -2.02 117.16 116.39 1f6p n TYR 155 Ca 0.17 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.94 1f6p n TYR 155 Cb 0.30 0.00 0.32 0.00 -0.31 0.00 0.00 39.34 39.65 1f6p n TYR 155 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1f6p h LYS 156 N 0.00 0.00 -6.13 -0.72 1.57 -1.00 -3.38 116.57 106.90 1f6p h LYS 156 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1f6p h LYS 156 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 1f6p h LYS 156 CO 0.00 0.43 0.76 1.21 -0.57 0.00 0.00 179.45 181.28 1f6p s ASN 157 N -6.70 7.11 0.47 0.86 3.84 -0.86 -4.92 114.94 114.75 1f6p s ASN 157 Ca -0.01 1.46 0.32 0.00 0.21 0.00 0.00 52.86 54.83 1f6p s ASN 157 Cb 0.13 -2.54 1.36 0.00 -0.55 0.00 0.00 41.25 39.64 1f6p s ASN 157 CO 0.71 -0.63 1.93 1.55 -2.79 0.00 0.00 177.10 177.87 1f6p h PRO 158 N 7.47 0.00 0.00 0.43 0.13 -1.88 -2.25 132.00 135.91 1f6p h PRO 158 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1f6p h PRO 158 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1f6p h PRO 158 CO 0.95 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.35 1f6p n LYS 159 N -2.82 0.04 -3.00 0.86 4.76 -1.26 -4.60 118.16 112.14 1f6p n LYS 159 Ca 0.01 0.15 -0.43 0.00 -2.87 0.00 0.00 58.31 55.17 1f6p n LYS 159 Cb 0.25 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 1f6p n LYS 159 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1f6p s VAL 160 N -2.94 4.68 -0.01 -0.18 1.01 -0.85 0.51 120.40 122.62 1f6p s VAL 160 Ca 0.11 0.28 0.11 0.00 0.00 0.00 0.00 61.98 62.49 1f6p s VAL 160 Cb 0.13 -4.32 -0.14 0.00 0.00 0.00 0.00 36.38 32.06 1f6p s VAL 160 CO 0.36 -0.74 1.14 -0.07 0.00 0.00 0.00 175.10 175.79 1f6p h LEU 161 N 10.09 0.00 0.00 3.92 3.38 -1.24 -3.47 115.31 127.99 1f6p h LEU 161 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1f6p h LEU 161 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1f6p h LEU 161 CO 0.96 0.83 0.00 0.61 0.09 0.00 0.00 178.44 180.92 1f6p n GLY 162 N 1.37 -0.57 3.03 0.83 0.00 -1.25 -0.85 105.19 107.75 1f6p n GLY 162 Ca -0.04 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 1f6p n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f6p s VAL 163 N -4.00 0.05 -0.71 1.61 0.11 -0.97 -1.13 120.40 115.36 1f6p s VAL 163 Ca 0.00 -0.38 -0.21 0.00 -2.93 0.00 0.00 61.98 58.46 1f6p s VAL 163 Cb 0.00 -0.27 0.09 0.00 -1.53 0.00 0.00 36.38 34.67 1f6p s VAL 163 CO 0.00 -0.21 0.97 -0.75 -3.33 0.00 0.00 175.10 171.78 1f6p s LYS 164 N -0.67 3.21 -1.04 1.54 2.20 0.71 -1.65 119.74 124.05 1f6p s LYS 164 Ca -0.07 -1.10 -0.20 0.00 -0.36 0.00 0.00 55.97 54.23 1f6p s LYS 164 Cb -0.05 -4.39 0.09 0.00 -1.51 0.00 0.00 37.83 31.97 1f6p s LYS 164 CO 0.00 -1.77 1.38 0.12 -0.36 0.00 0.00 175.35 174.72 1f6p s PHE 165 N 3.59 2.81 -1.16 4.03 5.36 0.12 -2.42 117.98 130.32 1f6p s PHE 165 Ca 0.23 -1.19 -0.06 0.00 -0.96 0.00 0.00 56.93 54.95 1f6p s PHE 165 Cb -0.15 -4.55 0.25 0.00 -0.34 0.00 0.00 43.02 38.23 1f6p s PHE 165 CO 0.05 -1.75 1.69 2.41 -1.46 0.00 0.00 175.22 176.17 1f6p n THR 166 N 6.24 5.04 -3.67 0.12 -1.04 -0.53 -1.06 114.28 119.38 1f6p n THR 166 Ca 0.32 -5.32 -0.10 0.00 -2.04 0.00 0.00 64.05 56.91 1f6p n THR 166 Cb 0.49 -2.14 -0.05 0.00 -1.82 0.00 0.00 70.33 66.81 1f6p n THR 166 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1f6p s ALA 167 N -1.69 -0.87 -0.11 2.41 0.00 -1.26 -4.08 121.76 116.15 1f6p s ALA 167 Ca 0.36 -0.13 0.17 0.00 0.00 0.00 0.00 51.96 52.35 1f6p s ALA 167 Cb 0.08 0.72 0.25 0.00 0.00 0.00 0.00 23.12 24.18 1f6p s ALA 167 CO 0.05 -0.67 1.13 0.41 0.00 0.00 0.00 175.76 176.68 1f6p n GLY 168 N -0.24 4.47 3.44 0.00 0.00 -1.26 -4.72 105.19 106.87 1f6p n GLY 168 Ca -0.15 -1.00 -0.44 0.00 0.00 0.00 0.00 46.02 44.44 1f6p n GLY 168 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f6p s ASP 169 N -2.64 6.33 0.31 1.61 -1.08 -1.26 -4.87 116.67 115.06 1f6p s ASP 169 Ca 0.28 -1.43 0.26 0.00 -0.52 0.00 0.00 52.55 51.13 1f6p s ASP 169 Cb 0.25 -2.39 0.75 0.00 -1.46 0.00 0.00 42.92 40.07 1f6p s ASP 169 CO 0.03 -1.25 1.74 -0.26 0.52 0.00 0.00 175.17 175.94 1f6p h PHE 170 N 9.24 0.00 -0.04 -5.34 -1.00 -1.99 -1.77 116.94 116.04 1f6p h PHE 170 Ca -0.14 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.63 1f6p h PHE 170 Cb 1.06 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.62 1f6p h PHE 170 CO 1.01 0.00 -0.03 -0.92 -1.61 0.00 0.00 178.31 176.76 1f6p h TYR 171 N 0.00 0.10 -0.79 -0.55 3.20 -2.00 -2.70 116.97 114.23 1f6p h TYR 171 Ca 0.00 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.85 1f6p h TYR 171 Cb 0.74 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.95 1f6p h TYR 171 CO 0.00 0.52 0.52 1.25 -1.64 0.00 0.00 178.16 178.81 1f6p h LEU 172 N -0.35 0.91 -0.45 2.82 5.85 -1.94 -1.17 115.31 120.98 1f6p h LEU 172 Ca 0.01 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1f6p h LEU 172 Cb 0.50 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1f6p h LEU 172 CO 0.01 0.66 0.24 0.25 -0.34 0.00 0.00 178.44 179.26 1f6p h LEU 173 N 1.07 0.57 -0.19 2.25 5.85 -1.33 0.21 115.31 123.74 1f6p h LEU 173 Ca 0.29 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1f6p h LEU 173 Cb -0.12 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1f6p h LEU 173 CO -0.06 0.50 0.09 -0.08 -0.34 0.00 0.00 178.44 178.55 1f6p h GLU 174 N 0.59 0.27 -0.53 1.25 4.22 -1.11 -2.98 114.58 116.29 1f6p h GLU 174 Ca 0.16 -0.04 -0.01 0.00 0.08 0.00 0.00 59.36 59.54 1f6p h GLU 174 Cb 0.07 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1f6p h GLU 174 CO -0.02 0.31 0.27 0.00 -2.18 0.00 0.00 179.01 177.39 1f6p h ARG 175 N 0.17 0.75 -0.89 1.92 2.47 -0.86 -0.81 114.38 117.14 1f6p h ARG 175 Ca 0.06 -0.10 0.09 0.00 -1.26 0.00 0.00 59.98 58.77 1f6p h ARG 175 Cb 0.12 -0.14 -0.06 0.00 -1.65 0.00 0.00 29.97 28.24 1f6p h ARG 175 CO -0.01 0.60 0.58 -0.07 0.56 0.00 0.00 179.97 181.63 1f6p h LEU 176 N 0.71 0.83 -0.15 3.04 3.38 -0.50 0.71 115.31 123.33 1f6p h LEU 176 Ca 0.18 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 58.02 1f6p h LEU 176 Cb 0.08 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1f6p h LEU 176 CO -0.03 0.50 -0.50 0.50 0.09 0.00 0.00 178.44 179.00 1f6p h LYS 177 N 0.93 0.61 -0.43 1.13 1.63 -1.34 0.66 116.57 119.76 1f6p h LYS 177 Ca 0.41 -0.45 -0.10 0.00 -0.85 0.00 0.00 60.65 59.65 1f6p h LYS 177 Cb 0.34 0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.04 1f6p h LYS 177 CO -0.17 1.07 -0.11 -0.22 -3.45 0.00 0.00 179.45 176.58 1f6p h LYS 178 N 0.27 0.83 -0.01 1.90 1.63 -1.04 -2.92 116.57 117.23 1f6p h LYS 178 Ca -0.02 -0.32 -0.23 0.00 -0.85 0.00 0.00 60.65 59.22 1f6p h LYS 178 Cb 1.13 -0.05 0.02 0.00 -0.60 0.00 0.00 32.23 32.73 1f6p h LYS 178 CO 0.11 0.95 -0.91 0.00 -3.45 0.00 0.00 179.45 176.15 1f6p h ALA 179 N 0.86 0.13 -2.20 5.00 0.00 -0.82 -3.38 119.26 118.83 1f6p h ALA 179 Ca 0.11 -0.66 -0.59 0.00 0.00 0.00 0.00 54.91 53.77 1f6p h ALA 179 Cb 0.65 0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.07 1f6p h ALA 179 CO 0.04 0.59 -0.69 0.66 0.00 0.00 0.00 179.25 179.86 1f6p n TYR 180 N -3.96 2.83 0.27 0.00 4.01 0.22 -4.94 117.16 115.59 1f6p n TYR 180 Ca -0.11 -4.04 0.14 0.00 -0.16 0.00 0.00 57.90 53.73 1f6p n TYR 180 Cb 0.82 -0.51 0.78 0.00 -0.31 0.00 0.00 39.34 40.11 1f6p n TYR 180 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1f6p h PRO 181 N 4.22 0.00 -0.01 -0.72 0.13 -1.71 -0.81 132.00 133.10 1f6p h PRO 181 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1f6p h PRO 181 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1f6p h PRO 181 CO 0.76 0.09 -0.10 0.09 -0.23 0.00 0.00 178.00 178.61 1f6p n ASN 182 N -3.63 1.32 -4.88 1.44 3.02 -1.26 -4.88 115.26 106.38 1f6p n ASN 182 Ca -0.02 -1.26 -0.32 0.00 -0.03 0.00 0.00 54.58 52.95 1f6p n ASN 182 Cb 0.21 0.05 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 1f6p n ASN 182 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1f6p s HIS 183 N -2.20 3.47 0.33 3.10 3.76 -0.31 -5.05 115.29 118.39 1f6p s HIS 183 Ca 0.33 0.74 -0.12 0.00 -0.15 0.00 0.00 55.06 55.86 1f6p s HIS 183 Cb 0.20 -2.15 -0.08 0.00 1.11 0.00 0.00 32.58 31.67 1f6p s HIS 183 CO 0.41 0.37 0.70 -0.51 -0.85 0.00 0.00 174.74 174.85 1f6p s LEU 184 N -2.63 4.01 -0.08 0.89 1.43 -0.02 -4.96 118.68 117.30 1f6p s LEU 184 Ca 0.43 1.12 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 1f6p s LEU 184 Cb -0.12 -3.94 0.02 0.00 0.03 0.00 0.00 46.19 42.18 1f6p s LEU 184 CO 0.22 -0.24 -0.07 -0.63 0.23 0.00 0.00 176.35 175.86 1f6p s ILE 185 N -2.08 0.87 -0.20 -0.59 1.01 -1.26 -2.28 121.20 116.66 1f6p s ILE 185 Ca 0.51 -0.24 -0.09 0.00 0.00 0.00 0.00 60.65 60.83 1f6p s ILE 185 Cb -0.10 -0.89 -0.05 0.00 0.01 0.00 0.00 42.46 41.43 1f6p s ILE 185 CO 0.23 0.33 0.11 0.26 0.00 0.00 0.00 174.94 175.87 1f6p s TRP 186 N 1.39 3.34 0.34 3.97 0.51 -0.66 -1.12 118.94 126.72 1f6p s TRP 186 Ca -0.02 0.22 -0.27 0.00 -2.12 0.00 0.00 56.10 53.91 1f6p s TRP 186 Cb -0.13 -2.16 -0.09 0.00 -0.81 0.00 0.00 33.47 30.28 1f6p s TRP 186 CO -0.04 0.20 1.11 0.00 -0.51 0.00 0.00 176.95 177.71 1f6p s ALA 187 N 0.51 3.26 -0.25 0.98 0.00 -0.55 0.16 121.76 125.87 1f6p s ALA 187 Ca 0.06 0.87 0.13 0.00 0.00 0.00 0.00 51.96 53.03 1f6p s ALA 187 Cb -0.12 -3.33 -0.18 0.00 0.00 0.00 0.00 23.12 19.49 1f6p s ALA 187 CO -0.00 -0.28 0.39 0.41 0.00 0.00 0.00 175.76 176.28 1f6p n GLY 188 N 0.80 -0.45 3.35 0.00 0.00 -0.22 -1.50 105.19 107.17 1f6p n GLY 188 Ca 0.02 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 1f6p n GLY 188 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f6p s PHE 189 N -2.64 3.28 0.39 1.61 0.08 -1.26 -4.85 117.98 114.58 1f6p s PHE 189 Ca -0.01 -1.12 0.08 0.00 0.12 0.00 0.00 56.93 55.99 1f6p s PHE 189 Cb 0.09 -3.00 0.82 0.00 -0.57 0.00 0.00 43.02 40.35 1f6p s PHE 189 CO 0.54 -0.79 1.99 -0.44 -0.10 0.00 0.00 175.22 176.42 1f6p h ASP 190 N 8.60 0.57 0.71 1.36 5.19 -1.90 -0.80 116.42 130.14 1f6p h ASP 190 Ca -0.26 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.15 1f6p h ASP 190 Cb 1.10 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.49 1f6p h ASP 190 CO 0.81 0.38 0.00 -1.84 -3.12 0.00 0.00 179.24 175.47 1f6p n GLU 191 N -4.47 0.12 -0.43 3.56 0.00 -1.26 -2.68 120.64 115.47 1f6p n GLU 191 Ca 0.09 0.07 0.06 0.00 0.00 0.00 0.00 57.16 57.38 1f6p n GLU 191 Cb 0.21 -1.50 0.19 0.00 0.00 0.00 0.00 31.44 30.34 1f6p n GLU 191 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.13 175.80 1f6p n MET 192 N -1.43 1.58 0.00 3.44 2.81 -0.32 -4.86 117.12 118.35 1f6p n MET 192 Ca 0.08 -3.02 -0.11 0.00 -1.81 0.00 0.00 57.70 52.83 1f6p n MET 192 Cb 0.25 -1.61 -0.06 0.00 -0.71 0.00 0.00 33.22 31.10 1f6p n MET 192 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 1f6p h MET 193 N 0.70 0.11 0.22 0.03 4.05 -1.37 -2.54 114.93 116.13 1f6p h MET 193 Ca 0.02 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1f6p h MET 193 Cb 1.09 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.87 1f6p h MET 193 CO 0.05 0.09 -0.11 1.25 0.23 0.00 0.00 176.91 178.42 1f6p h LEU 194 N 0.10 -0.28 -0.83 3.39 5.85 -1.89 0.11 115.31 121.77 1f6p h LEU 194 Ca 0.03 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.85 1f6p h LEU 194 Cb 0.00 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.04 1f6p h LEU 194 CO -0.01 -0.19 0.49 1.55 -0.34 0.00 0.00 178.44 179.94 1f6p h PRO 195 N -0.31 0.82 -0.58 5.25 0.13 -1.95 -0.38 132.00 134.98 1f6p h PRO 195 Ca -0.03 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.01 1f6p h PRO 195 Cb 0.25 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 31.17 1f6p h PRO 195 CO 0.04 0.54 0.17 0.00 -0.23 0.00 0.00 178.00 178.52 1f6p h ALA 196 N 1.43 0.76 -0.35 -0.56 0.00 -1.21 -2.84 119.26 116.49 1f6p h ALA 196 Ca 0.38 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1f6p h ALA 196 Cb 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1f6p h ALA 196 CO -0.22 0.43 -0.05 0.00 0.00 0.00 0.00 179.25 179.41 1f6p h ALA 197 N 1.04 1.27 0.00 0.00 0.00 -0.08 -2.67 119.26 118.82 1f6p h ALA 197 Ca 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1f6p h ALA 197 Cb 0.30 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1f6p h ALA 197 CO -0.00 0.49 -0.06 0.66 0.00 0.00 0.00 179.25 180.33 1f6p h SER 198 N 0.53 0.00 -0.44 0.00 4.64 -0.85 -0.21 113.55 117.22 1f6p h SER 198 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1f6p h SER 198 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1f6p h SER 198 CO 0.02 0.06 0.00 0.18 -0.87 0.00 0.00 176.83 176.22 1f6p n LEU 199 N -3.52 2.61 0.00 5.97 4.77 -1.01 -4.97 117.00 120.84 1f6p n LEU 199 Ca -0.02 -1.26 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 1f6p n LEU 199 Cb 0.18 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1f6p n LEU 199 CO 0.27 0.63 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 1f6p n GLY 200 N 1.29 0.65 3.66 -0.72 0.00 -0.09 -4.93 105.19 105.06 1f6p n GLY 200 Ca 0.17 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.18 1f6p n GLY 200 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1f6p n VAL 201 N -2.61 3.38 1.35 1.61 0.24 -1.18 -4.94 118.33 116.18 1f6p n VAL 201 Ca 0.00 -0.39 0.13 0.00 -2.04 0.00 0.00 64.34 62.04 1f6p n VAL 201 Cb 0.02 -1.23 0.42 0.00 -1.47 0.00 0.00 33.84 31.57 1f6p n VAL 201 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1f6p n ASP 202 N -1.94 1.45 0.00 -1.34 8.00 -0.27 -4.89 116.55 117.56 1f6p n ASP 202 Ca 0.14 -1.31 0.00 0.00 0.71 0.00 0.00 54.79 54.33 1f6p n ASP 202 Cb 0.49 0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 1f6p n ASP 202 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f6p n GLY 203 N 1.26 -1.16 3.34 0.44 0.00 -1.21 -2.17 105.19 105.70 1f6p n GLY 203 Ca 0.16 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.04 1f6p n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f6p s ALA 204 N -1.00 -1.10 -0.19 4.61 0.00 0.57 -1.48 121.76 123.17 1f6p s ALA 204 Ca 0.00 1.15 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 1f6p s ALA 204 Cb 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 23.12 22.52 1f6p s ALA 204 CO 0.00 -0.22 -0.13 0.42 0.00 0.00 0.00 175.76 175.83 1f6p s ILE 205 N -0.01 2.68 0.03 0.00 1.01 -0.57 -1.45 121.20 122.89 1f6p s ILE 205 Ca -0.02 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 59.82 1f6p s ILE 205 Cb -0.03 -2.17 -0.00 0.00 0.01 0.00 0.00 42.46 40.26 1f6p s ILE 205 CO 0.01 0.49 0.14 -0.83 0.00 0.00 0.00 174.94 174.75 1f6p s GLY 206 N 1.32 0.10 0.07 6.18 0.00 -0.49 -4.44 107.32 110.06 1f6p s GLY 206 Ca 0.04 -0.38 0.07 0.00 0.00 0.00 0.00 44.72 44.45 1f6p s GLY 206 CO -0.08 -0.53 1.10 1.48 0.00 0.00 0.00 173.10 175.07 1f6p h SER 207 N 3.66 0.05 0.62 1.64 4.64 -1.90 0.77 113.55 123.04 1f6p h SER 207 Ca -0.32 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1f6p h SER 207 Cb 1.19 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1f6p h SER 207 CO 0.48 1.05 0.00 0.35 -0.87 0.00 0.00 176.83 177.84 1f6p n THR 208 N -3.29 0.49 0.30 2.95 -2.24 -1.26 -2.49 114.28 108.73 1f6p n THR 208 Ca -0.06 0.12 0.17 0.00 -2.27 0.00 0.00 64.05 62.02 1f6p n THR 208 Cb 0.98 -0.76 0.71 0.00 -2.10 0.00 0.00 70.33 69.15 1f6p n THR 208 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1f6p h PHE 209 N 0.00 0.00 -0.22 4.78 0.04 -1.88 -0.45 116.94 119.21 1f6p h PHE 209 Ca 0.00 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.83 1f6p h PHE 209 Cb 0.31 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.45 1f6p h PHE 209 CO 0.00 0.00 0.22 -0.91 -0.60 0.00 0.00 178.31 177.02 1f6p h ASN 210 N 0.00 0.00 0.00 2.17 2.35 -1.71 -2.82 115.58 115.57 1f6p h ASN 210 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1f6p h ASN 210 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1f6p h ASN 210 CO 0.00 0.00 -0.46 1.33 -1.65 0.00 0.00 177.43 176.65 1f6p n VAL 211 N -3.91 0.00 -1.45 2.81 0.24 -0.87 -4.83 118.33 110.32 1f6p n VAL 211 Ca 0.03 -0.08 0.07 0.00 -2.04 0.00 0.00 64.34 62.32 1f6p n VAL 211 Cb 0.36 0.48 0.19 0.00 -1.47 0.00 0.00 33.84 33.40 1f6p n VAL 211 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1f6p n ASN 212 N -0.85 1.93 -0.09 -1.34 5.15 -0.23 -4.83 115.26 115.00 1f6p n ASN 212 Ca 0.00 -3.67 0.07 0.00 -0.60 0.00 0.00 54.58 50.38 1f6p n ASN 212 Cb 0.00 -0.51 0.42 0.00 -0.53 0.00 0.00 39.78 39.16 1f6p n ASN 212 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1f6p h GLY 213 N 0.73 0.71 0.62 8.20 0.00 -1.69 -0.20 103.07 111.44 1f6p h GLY 213 Ca 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1f6p h GLY 213 CO 0.01 0.19 -0.08 -2.08 0.00 0.00 0.00 176.54 174.58 1f6p h VAL 214 N 0.59 0.98 -0.91 4.60 2.07 -1.88 -2.24 116.25 119.44 1f6p h VAL 214 Ca 0.24 -0.77 0.03 0.00 0.82 0.00 0.00 66.70 67.02 1f6p h VAL 214 Cb 0.22 1.44 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 1f6p h VAL 214 CO -0.07 0.18 0.60 0.03 0.02 0.00 0.00 177.57 178.32 1f6p h ARG 215 N -0.60 1.14 -0.18 1.57 3.08 -1.83 -2.44 114.38 115.12 1f6p h ARG 215 Ca -0.02 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1f6p h ARG 215 Cb 0.45 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1f6p h ARG 215 CO 0.04 0.75 0.11 0.00 -1.07 0.00 0.00 179.97 179.80 1f6p h ALA 216 N 1.37 0.23 -0.98 0.04 0.00 -0.82 -2.40 119.26 116.70 1f6p h ALA 216 Ca 0.36 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.33 1f6p h ALA 216 Cb -0.03 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.60 1f6p h ALA 216 CO -0.11 -0.26 0.62 -0.09 0.00 0.00 0.00 179.25 179.41 1f6p h ARG 217 N 0.21 0.99 -0.25 0.00 2.43 -1.21 -2.24 114.38 114.31 1f6p h ARG 217 Ca 0.07 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1f6p h ARG 217 Cb 0.03 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 1f6p h ARG 217 CO -0.01 0.65 0.10 1.96 -1.51 0.00 0.00 179.97 181.17 1f6p h GLN 218 N 1.02 0.37 0.09 0.20 4.20 -1.15 0.15 115.11 119.99 1f6p h GLN 218 Ca 0.47 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 59.14 1f6p h GLN 218 Cb 0.39 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.07 1f6p h GLN 218 CO -0.24 0.40 -0.31 0.82 -0.67 0.00 0.00 178.83 178.83 1f6p h ILE 219 N 0.26 0.34 -0.10 2.54 2.04 -1.12 0.07 117.51 121.53 1f6p h ILE 219 Ca 0.08 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.97 1f6p h ILE 219 Cb 0.16 0.34 -0.06 0.00 -0.74 0.00 0.00 36.82 36.52 1f6p h ILE 219 CO -0.01 0.00 -0.52 0.15 0.00 0.00 0.00 178.15 177.77 1f6p h PHE 220 N -0.51 -1.53 -0.33 1.37 3.57 -1.31 0.17 116.94 118.37 1f6p h PHE 220 Ca 0.04 0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.53 1f6p h PHE 220 Cb 0.56 0.68 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 1f6p h PHE 220 CO -0.29 -0.54 -0.08 0.93 -2.23 0.00 0.00 178.31 176.10 1f6p h GLU 221 N -0.59 0.54 -0.20 1.11 5.08 -0.59 -1.21 114.58 118.72 1f6p h GLU 221 Ca 0.04 -0.15 -0.18 0.00 -1.00 0.00 0.00 59.36 58.07 1f6p h GLU 221 Cb 0.69 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1f6p h GLU 221 CO -0.41 0.63 -0.61 -0.07 -1.00 0.00 0.00 179.01 177.55 1f6p h LEU 222 N 0.51 0.76 0.22 1.33 3.38 -0.57 -2.14 115.31 118.79 1f6p h LEU 222 Ca 0.10 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1f6p h LEU 222 Cb 0.45 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1f6p h LEU 222 CO 0.02 1.19 -0.10 0.74 0.09 0.00 0.00 178.44 180.38 1f6p h THR 223 N 0.50 0.86 -1.00 0.22 2.02 -0.50 0.13 112.91 115.14 1f6p h THR 223 Ca -0.00 -0.56 0.18 0.00 0.77 0.00 0.00 66.41 66.80 1f6p h THR 223 Cb 1.19 1.19 -0.10 0.00 -1.74 0.00 0.00 68.15 68.68 1f6p h THR 223 CO 0.12 0.12 0.62 0.11 0.37 0.00 0.00 175.52 176.86 1f6p h LYS 224 N -0.58 0.76 -0.26 6.66 1.79 -1.23 0.38 116.57 124.10 1f6p h LYS 224 Ca -0.03 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1f6p h LYS 224 Cb 0.42 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1f6p h LYS 224 CO 0.05 0.50 0.00 0.00 -1.08 0.00 0.00 179.45 178.92 1f6p n ALA 225 N -2.34 2.51 -1.49 3.86 0.00 -0.81 -4.86 120.51 117.38 1f6p n ALA 225 Ca 0.23 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.48 1f6p n ALA 225 Cb 0.55 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.94 1f6p n ALA 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f6p n GLY 226 N 0.42 1.24 2.84 0.00 0.00 0.13 -4.92 105.19 104.90 1f6p n GLY 226 Ca 0.01 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1f6p n GLY 226 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1f6p n LYS 227 N -2.57 4.67 -0.33 1.61 5.02 0.40 -4.80 118.16 122.15 1f6p n LYS 227 Ca -0.14 -4.38 0.02 0.00 -2.02 0.00 0.00 58.31 51.79 1f6p n LYS 227 Cb 0.47 -2.56 0.19 0.00 -0.02 0.00 0.00 35.03 33.11 1f6p n LYS 227 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1f6p h LEU 228 N 5.39 1.00 -0.04 -0.35 3.38 -1.88 -1.23 115.31 121.58 1f6p h LEU 228 Ca 0.36 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.32 1f6p h LEU 228 Cb 0.51 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1f6p h LEU 228 CO 1.34 0.66 0.02 0.11 0.09 0.00 0.00 178.44 180.66 1f6p h LYS 229 N 1.14 0.06 -0.54 1.13 1.57 -1.96 -0.30 116.57 117.68 1f6p h LYS 229 Ca 0.39 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 59.05 1f6p h LYS 229 Cb 0.10 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1f6p h LYS 229 CO -0.14 0.18 -0.12 1.49 -0.57 0.00 0.00 179.45 180.30 1f6p h GLU 230 N -0.08 1.03 -0.34 3.15 4.81 -1.94 -2.35 114.58 118.86 1f6p h GLU 230 Ca 0.01 -0.39 0.05 0.00 -0.13 0.00 0.00 59.36 58.91 1f6p h GLU 230 Cb 0.15 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.42 1f6p h GLU 230 CO -0.00 1.08 0.05 0.00 -0.73 0.00 0.00 179.01 179.41 1f6p h ALA 231 N 0.94 0.35 -0.72 2.92 0.00 -1.09 -2.38 119.26 119.28 1f6p h ALA 231 Ca 0.14 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1f6p h ALA 231 Cb 0.69 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1f6p h ALA 231 CO 0.05 -0.35 0.25 1.25 0.00 0.00 0.00 179.25 180.45 1f6p h LEU 232 N 0.16 1.02 -0.73 0.00 5.85 -0.64 -1.37 115.31 119.60 1f6p h LEU 232 Ca 0.16 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1f6p h LEU 232 Cb 0.20 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1f6p h LEU 232 CO -0.23 0.94 0.37 -0.33 -0.34 0.00 0.00 178.44 178.85 1f6p h GLU 233 N 1.05 1.04 -0.25 1.25 4.39 -1.02 0.14 114.58 121.18 1f6p h GLU 233 Ca 0.23 -0.14 -0.12 0.00 0.34 0.00 0.00 59.36 59.67 1f6p h GLU 233 Cb 0.27 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1f6p h GLU 233 CO -0.01 0.80 -0.34 0.82 -1.16 0.00 0.00 179.01 179.13 1f6p h ILE 234 N 1.02 1.29 -0.09 3.13 2.04 -1.00 -0.47 117.51 123.43 1f6p h ILE 234 Ca 0.25 -1.45 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 1f6p h ILE 234 Cb 0.09 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1f6p h ILE 234 CO -0.03 0.46 -0.36 -0.61 0.00 0.00 0.00 178.15 177.60 1f6p h GLN 235 N 0.45 0.18 0.23 2.37 5.75 -1.02 0.58 115.11 123.65 1f6p h GLN 235 Ca 0.05 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 1f6p h GLN 235 Cb 0.80 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.35 1f6p h GLN 235 CO 0.07 0.52 -0.11 0.45 -2.65 0.00 0.00 178.83 177.10 1f6p h HIS 236 N 0.15 -0.29 -0.10 3.99 3.86 0.11 0.35 115.15 123.22 1f6p h HIS 236 Ca 0.02 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1f6p h HIS 236 Cb 0.71 0.10 -0.00 0.00 1.06 0.00 0.00 27.41 29.27 1f6p h HIS 236 CO 0.01 -0.05 0.03 0.28 0.86 0.00 0.00 177.93 179.06 1f6p h VAL 237 N -0.49 1.19 -0.79 2.45 2.07 -0.98 -1.65 116.25 118.05 1f6p h VAL 237 Ca -0.03 -0.58 0.14 0.00 0.82 0.00 0.00 66.70 67.04 1f6p h VAL 237 Cb 0.37 1.39 -0.09 0.00 -1.52 0.00 0.00 31.29 31.44 1f6p h VAL 237 CO 0.05 0.17 0.37 0.74 0.02 0.00 0.00 177.57 178.92 1f6p h THR 238 N -0.04 0.72 0.00 2.57 2.02 -0.80 -2.00 112.91 115.37 1f6p h THR 238 Ca 0.03 -0.19 -0.05 0.00 0.77 0.00 0.00 66.41 66.97 1f6p h THR 238 Cb 0.24 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 1f6p h THR 238 CO 0.00 0.10 -0.24 0.78 0.37 0.00 0.00 175.52 176.53 1f6p h ASN 239 N 0.55 0.00 -0.23 4.18 4.21 0.32 -0.39 115.58 124.22 1f6p h ASN 239 Ca 0.43 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.91 1f6p h ASN 239 Cb 0.60 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.79 1f6p h ASN 239 CO -0.37 0.24 0.03 0.44 -1.29 0.00 0.00 177.43 176.48 1f6p h ASP 240 N 0.00 0.38 -0.62 5.81 3.32 -0.57 0.13 116.42 124.88 1f6p h ASP 240 Ca -0.00 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 56.68 1f6p h ASP 240 Cb 0.72 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1f6p h ASP 240 CO 0.03 0.56 0.02 0.25 -1.72 0.00 0.00 179.24 178.38 1f6p h LEU 241 N 0.18 1.05 -0.53 1.55 5.85 -1.25 -1.72 115.31 120.44 1f6p h LEU 241 Ca 0.07 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 1f6p h LEU 241 Cb 0.35 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1f6p h LEU 241 CO 0.01 1.09 0.11 0.40 -0.34 0.00 0.00 178.44 179.70 1f6p h ILE 242 N 0.98 1.25 -0.95 4.05 2.04 -0.90 0.38 117.51 124.35 1f6p h ILE 242 Ca 0.18 -0.90 0.01 0.00 1.00 0.00 0.00 64.86 65.15 1f6p h ILE 242 Cb 0.54 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.39 1f6p h ILE 242 CO 0.03 0.33 0.63 -0.08 0.00 0.00 0.00 178.15 179.05 1f6p h GLU 243 N 0.74 1.24 0.26 2.37 4.81 -0.59 0.19 114.58 123.61 1f6p h GLU 243 Ca 0.16 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1f6p h GLU 243 Cb 0.37 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1f6p h GLU 243 CO 0.01 0.82 -0.19 0.78 -0.73 0.00 0.00 179.01 179.70 1f6p h GLY 244 N 1.28 -0.46 0.69 1.92 0.00 -0.57 -0.41 103.07 105.52 1f6p h GLY 244 Ca 0.35 0.21 0.04 0.00 0.00 0.00 0.00 47.33 47.94 1f6p h GLY 244 CO -0.08 -0.19 0.18 -2.22 0.00 0.00 0.00 176.54 174.23 1f6p h ILE 245 N -0.45 0.92 -0.00 2.60 2.04 0.39 -0.94 117.51 122.05 1f6p h ILE 245 Ca -0.02 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1f6p h ILE 245 Cb 0.39 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1f6p h ILE 245 CO 0.00 0.07 0.00 -0.07 0.00 0.00 0.00 178.15 178.15 1f6p h LEU 246 N 0.37 0.00 -0.89 1.44 3.38 -0.58 -0.27 115.31 118.77 1f6p h LEU 246 Ca 0.19 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1f6p h LEU 246 Cb 0.14 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1f6p h LEU 246 CO -0.17 0.14 0.58 0.00 0.09 0.00 0.00 178.44 179.08 1f6p h ALA 247 N 0.87 1.13 0.00 1.53 0.00 -0.90 -2.05 119.26 119.84 1f6p h ALA 247 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1f6p h ALA 247 Cb 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1f6p h ALA 247 CO -0.00 0.54 0.00 -0.97 0.00 0.00 0.00 179.25 178.82 1f6p h ASN 248 N 1.21 0.00 0.00 0.00 -0.00 -1.00 -3.48 115.58 112.31 1f6p h ASN 248 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.62 1f6p h ASN 248 Cb -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.19 1f6p h ASN 248 CO -0.07 0.00 0.00 0.61 -0.00 0.00 0.00 177.43 177.97 1f6p n GLY 249 N 0.63 1.53 0.39 1.57 0.00 -0.13 -4.75 105.19 104.44 1f6p n GLY 249 Ca 0.04 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 1f6p n GLY 249 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1f6p h LEU 250 N 0.00 -1.37 0.50 0.99 5.85 -1.70 -1.28 115.31 118.30 1f6p h LEU 250 Ca 0.00 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1f6p h LEU 250 Cb 0.00 0.52 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1f6p h LEU 250 CO 0.00 -0.42 -0.25 1.88 -0.34 0.00 0.00 178.44 179.30 1f6p h TYR 251 N -0.54 -0.66 -0.77 1.25 -1.99 -1.96 -2.50 116.97 109.81 1f6p h TYR 251 Ca 0.01 -0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.74 1f6p h TYR 251 Cb 0.59 0.22 -0.04 0.00 2.00 0.00 0.00 36.73 39.50 1f6p h TYR 251 CO -0.50 -0.41 0.51 -0.07 -0.00 0.00 0.00 178.16 177.69 1f6p h LEU 252 N -0.69 0.88 -0.65 3.88 3.38 -1.93 -1.58 115.31 118.59 1f6p h LEU 252 Ca -0.07 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1f6p h LEU 252 Cb 0.54 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1f6p h LEU 252 CO 0.10 0.64 0.04 0.74 0.09 0.00 0.00 178.44 180.04 1f6p h THR 253 N 1.04 1.26 -0.37 0.22 2.02 -1.20 0.38 112.91 116.26 1f6p h THR 253 Ca 0.28 -1.12 -0.10 0.00 0.77 0.00 0.00 66.41 66.24 1f6p h THR 253 Cb -0.12 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 1f6p h THR 253 CO -0.06 0.41 -0.19 0.40 0.37 0.00 0.00 175.52 176.45 1f6p h ILE 254 N 1.00 1.26 -0.19 3.11 2.04 -1.39 0.26 117.51 123.60 1f6p h ILE 254 Ca 0.18 -1.26 -0.05 0.00 1.00 0.00 0.00 64.86 64.74 1f6p h ILE 254 Cb 0.52 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1f6p h ILE 254 CO 0.02 0.42 -0.06 0.11 0.00 0.00 0.00 178.15 178.65 1f6p h LYS 255 N 0.63 0.37 -0.78 2.37 1.57 -0.21 -0.43 116.57 120.09 1f6p h LYS 255 Ca 0.09 -0.15 0.06 0.00 -1.87 0.00 0.00 60.65 58.78 1f6p h LYS 255 Cb 0.67 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.90 1f6p h LYS 255 CO 0.05 0.64 0.47 0.93 -0.57 0.00 0.00 179.45 180.97 1f6p h GLU 256 N 0.08 0.85 -0.26 3.15 4.39 -0.05 -0.31 114.58 122.43 1f6p h GLU 256 Ca 0.05 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1f6p h GLU 256 Cb 0.51 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.96 1f6p h GLU 256 CO 0.02 0.56 0.06 -0.07 -1.16 0.00 0.00 179.01 178.42 1f6p h LEU 257 N 0.87 0.33 -0.60 1.33 3.38 -0.26 -0.95 115.31 119.42 1f6p h LEU 257 Ca 0.34 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 58.17 1f6p h LEU 257 Cb 0.15 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1f6p h LEU 257 CO -0.17 0.35 -0.04 -0.07 0.09 0.00 0.00 178.44 178.61 1f6p h LEU 258 N 0.37 1.06 -0.93 1.67 3.38 0.51 -2.76 115.31 118.60 1f6p h LEU 258 Ca 0.09 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.77 1f6p h LEU 258 Cb 0.16 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1f6p h LEU 258 CO -0.00 1.13 0.61 0.11 0.09 0.00 0.00 178.44 180.37 1f6p h LYS 259 N 0.97 1.15 0.00 1.13 1.57 0.16 -1.05 116.57 120.50 1f6p h LYS 259 Ca 0.16 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1f6p h LYS 259 Cb 0.61 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1f6p h LYS 259 CO 0.04 0.76 0.00 -0.07 -0.57 0.00 0.00 179.45 179.61 1f6p h LEU 260 N 1.19 0.00 0.00 2.94 3.38 -1.03 0.13 115.31 121.92 1f6p h LEU 260 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1f6p h LEU 260 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1f6p h LEU 260 CO -0.11 0.00 -0.59 -0.33 0.09 0.00 0.00 178.44 177.49 1f6p h GLU 261 N 0.00 0.00 0.00 1.13 4.39 -1.09 -3.47 114.58 115.54 1f6p h GLU 261 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1f6p h GLU 261 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1f6p h GLU 261 CO 0.00 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 1f6p n GLY 262 N 1.18 1.35 3.49 -3.84 0.00 0.45 -5.09 105.19 102.73 1f6p n GLY 262 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1f6p n GLY 262 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f6p s VAL 263 N -2.00 4.50 -1.30 1.61 1.01 -0.90 -5.02 120.40 118.31 1f6p s VAL 263 Ca 0.00 -0.11 -0.17 0.00 0.00 0.00 0.00 61.98 61.70 1f6p s VAL 263 Cb 0.00 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 33.30 1f6p s VAL 263 CO 0.00 0.35 1.98 -0.67 0.00 0.00 0.00 175.10 176.76 1f6p n ASP 264 N 4.69 4.08 0.00 3.32 2.03 -1.26 -2.94 116.55 126.47 1f6p n ASP 264 Ca -0.16 -2.84 0.13 0.00 0.52 0.00 0.00 54.79 52.44 1f6p n ASP 264 Cb 0.52 -1.65 0.58 0.00 -0.72 0.00 0.00 41.12 39.85 1f6p n ASP 264 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f6p n ALA 265 N 7.90 2.23 -0.84 -1.67 0.00 -1.26 -4.24 120.51 122.63 1f6p n ALA 265 Ca 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.84 1f6p n ALA 265 Cb 0.43 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1f6p n ALA 265 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f6p n GLY 266 N 1.21 1.22 3.97 0.00 0.00 -1.26 -3.89 105.19 106.43 1f6p n GLY 266 Ca 0.07 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 1f6p n GLY 266 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f6p s TYR 267 N 0.00 2.39 0.26 1.61 1.51 -0.52 -4.80 117.35 117.79 1f6p s TYR 267 Ca 0.00 0.03 0.02 0.00 -1.01 0.00 0.00 57.07 56.11 1f6p s TYR 267 Cb 0.00 -3.02 -0.03 0.00 -0.11 0.00 0.00 41.96 38.80 1f6p s TYR 267 CO 0.00 -1.38 0.42 0.00 -1.11 0.00 0.00 175.55 173.48 1f6p s ARG 269 N -3.87 4.34 -0.06 0.00 6.06 -1.26 -4.25 118.95 119.90 1f6p s ARG 269 Ca 0.37 0.58 -0.29 0.00 -2.50 0.00 0.00 55.73 53.89 1f6p s ARG 269 Cb -0.10 -3.47 -0.07 0.00 0.06 0.00 0.00 34.95 31.37 1f6p s ARG 269 CO 0.31 0.05 1.93 -1.21 -2.50 0.00 0.00 175.30 173.88 1f6p s GLU 270 N 0.94 3.89 0.00 5.12 2.02 -1.26 -1.18 118.70 128.23 1f6p s GLU 270 Ca 0.29 2.31 0.24 0.00 0.02 0.00 0.00 54.97 57.83 1f6p s GLU 270 Cb -0.16 -4.17 0.22 0.00 0.10 0.00 0.00 34.13 30.12 1f6p s GLU 270 CO 0.12 -1.23 1.27 -0.35 0.02 0.00 0.00 175.26 175.09 1f6p n PRO 271 N 7.76 2.14 -2.59 0.39 -0.04 -1.26 -5.04 135.00 136.36 1f6p n PRO 271 Ca 0.21 -1.75 -0.37 0.00 -0.04 0.00 0.00 63.50 61.56 1f6p n PRO 271 Cb 0.43 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.38 1f6p n PRO 271 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1f6p s MET 272 N -2.07 4.30 -0.21 0.54 -1.94 -0.32 -4.93 119.30 114.67 1f6p s MET 272 Ca 0.27 1.50 -0.34 0.00 -1.71 0.00 0.00 55.69 55.41 1f6p s MET 272 Cb 0.20 -2.66 -0.11 0.00 2.01 0.00 0.00 34.83 34.27 1f6p s MET 272 CO 0.34 -0.02 2.01 2.41 -0.01 0.00 0.00 175.02 179.75 1f6p n THR 273 N 0.18 0.39 0.15 2.05 -1.04 -1.26 -4.51 114.28 110.25 1f6p n THR 273 Ca 0.04 -0.19 0.03 0.00 -2.04 0.00 0.00 64.05 61.89 1f6p n THR 273 Cb 0.49 -1.81 0.12 0.00 -1.82 0.00 0.00 70.33 67.31 1f6p n THR 273 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1f6p h SER 274 N 10.76 0.00 -4.08 8.00 4.64 -1.89 -3.42 113.55 127.57 1f6p h SER 274 Ca -0.40 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.23 1f6p h SER 274 Cb 1.29 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.11 1f6p h SER 274 CO 0.97 0.47 -0.82 -0.54 -0.87 0.00 0.00 176.83 176.05 1f6p s LYS 275 N -3.14 2.52 0.20 4.77 1.02 -1.26 -1.62 119.74 122.24 1f6p s LYS 275 Ca 0.03 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 54.94 1f6p s LYS 275 Cb 0.09 -2.29 -0.08 0.00 -0.52 0.00 0.00 37.83 35.02 1f6p s LYS 275 CO 0.73 0.52 1.20 0.00 -0.92 0.00 0.00 175.35 176.87 1f6p s ALA 276 N -0.48 3.44 1.10 5.17 0.00 -1.26 -5.04 121.76 124.69 1f6p s ALA 276 Ca 0.06 0.97 -0.17 0.00 0.00 0.00 0.00 51.96 52.81 1f6p s ALA 276 Cb -0.12 -3.41 0.25 0.00 0.00 0.00 0.00 23.12 19.84 1f6p s ALA 276 CO 0.01 -0.37 1.17 0.95 0.00 0.00 0.00 175.76 177.53 1f6p s THR 277 N -0.22 1.76 0.15 0.00 -4.23 -1.26 -4.79 115.64 107.04 1f6p s THR 277 Ca 0.52 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.90 1f6p s THR 277 Cb -0.33 -2.66 0.02 0.00 1.34 0.00 0.00 72.50 70.88 1f6p s THR 277 CO 0.38 0.00 1.64 0.00 -0.54 0.00 0.00 174.62 176.10 1f6p h ALA 278 N -2.20 0.65 -0.66 3.99 0.00 -1.99 -0.88 119.26 118.17 1f6p h ALA 278 Ca -0.46 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.31 1f6p h ALA 278 Cb 1.28 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1f6p h ALA 278 CO 0.39 0.36 0.32 0.93 0.00 0.00 0.00 179.25 181.24 1f6p h GLU 279 N 0.68 0.55 -0.71 0.00 3.07 -2.00 -1.59 114.58 114.58 1f6p h GLU 279 Ca 0.15 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.93 1f6p h GLU 279 Cb 0.36 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1f6p h GLU 279 CO 0.01 0.36 0.26 1.96 -1.40 0.00 0.00 179.01 180.20 1f6p h GLN 280 N 0.57 1.07 -0.67 2.33 4.20 -1.69 -1.70 115.11 119.22 1f6p h GLN 280 Ca 0.32 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.77 1f6p h GLN 280 Cb 0.31 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 1f6p h GLN 280 CO -0.25 0.90 0.21 0.28 -0.67 0.00 0.00 178.83 179.30 1f6p h VAL 281 N 1.02 1.25 -0.29 -0.54 2.07 -0.49 -1.75 116.25 117.52 1f6p h VAL 281 Ca 0.23 -0.85 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1f6p h VAL 281 Cb 0.24 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1f6p h VAL 281 CO -0.02 0.33 -0.05 0.00 0.02 0.00 0.00 177.57 177.86 1f6p h ALA 282 N 1.23 0.39 -0.62 1.67 0.00 -0.85 -2.25 119.26 118.84 1f6p h ALA 282 Ca 0.22 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1f6p h ALA 282 Cb 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1f6p h ALA 282 CO -0.01 0.19 0.06 -0.22 0.00 0.00 0.00 179.25 179.27 1f6p h LYS 283 N 0.31 1.04 -0.50 0.00 3.64 -1.31 -0.15 116.57 119.59 1f6p h LYS 283 Ca 0.08 -0.29 0.07 0.00 -1.27 0.00 0.00 60.65 59.24 1f6p h LYS 283 Cb 0.52 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 1f6p h LYS 283 CO 0.02 0.98 0.16 0.00 -2.27 0.00 0.00 179.45 178.35 1f6p h ALA 284 N 1.09 0.60 -0.34 5.00 0.00 -0.97 -0.37 119.26 124.27 1f6p h ALA 284 Ca 0.18 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 1f6p h ALA 284 Cb 0.47 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1f6p h ALA 284 CO 0.02 -0.24 -0.17 -0.22 0.00 0.00 0.00 179.25 178.65 1f6p h LYS 285 N 0.33 0.62 -0.55 0.00 3.64 -0.81 -0.25 116.57 119.54 1f6p h LYS 285 Ca 0.24 -0.21 -0.11 0.00 -1.27 0.00 0.00 60.65 59.30 1f6p h LYS 285 Cb 0.27 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1f6p h LYS 285 CO -0.26 0.76 -0.08 -0.44 -2.27 0.00 0.00 179.45 177.16 1f6p h ASP 286 N 0.56 1.03 -0.15 4.20 3.32 -0.09 -2.31 116.42 122.97 1f6p h ASP 286 Ca 0.09 -0.34 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 1f6p h ASP 286 Cb 0.60 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1f6p h ASP 286 CO 0.04 1.12 0.04 -0.07 -1.72 0.00 0.00 179.24 178.65 1f6p h LEU 287 N 0.91 0.29 0.74 1.55 3.38 -0.81 -1.09 115.31 120.29 1f6p h LEU 287 Ca 0.15 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1f6p h LEU 287 Cb 0.64 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.32 1f6p h LEU 287 CO 0.04 0.32 -0.36 0.50 0.09 0.00 0.00 178.44 179.03 1f6p h LYS 288 N 0.32 -0.96 -0.03 1.13 3.11 -0.68 -1.95 116.57 117.51 1f6p h LYS 288 Ca 0.08 0.07 0.04 0.00 -2.81 0.00 0.00 60.65 58.02 1f6p h LYS 288 Cb 0.16 0.22 -0.05 0.00 -1.00 0.00 0.00 32.23 31.55 1f6p h LYS 288 CO -0.00 -0.63 -0.31 0.00 -2.81 0.00 0.00 179.45 175.70 1f6p h ALA 289 N -1.14 -0.43 -0.14 5.00 0.00 -1.22 -1.66 119.26 119.67 1f6p h ALA 289 Ca -0.10 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1f6p h ALA 289 Cb 0.78 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 1f6p h ALA 289 CO 0.17 -0.82 -0.03 -0.22 0.00 0.00 0.00 179.25 178.36 1f6p h LYS 290 N -0.45 0.01 0.00 0.00 3.64 -1.27 -3.38 116.57 115.13 1f6p h LYS 290 Ca 0.07 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.39 1f6p h LYS 290 Cb 0.55 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1f6p h LYS 290 CO -0.28 0.01 -1.43 1.19 -2.27 0.00 0.00 179.45 176.67 1f6p n PHE 291 N -5.15 0.00 -2.02 1.91 3.72 -0.73 -4.75 117.46 110.43 1f6p n PHE 291 Ca -0.04 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1f6p n PHE 291 Cb 0.09 -0.26 0.11 0.00 -0.94 0.00 0.00 39.48 38.48 1f6p n PHE 291 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1f6p n LEU 292 N -1.99 2.55 -0.26 4.37 4.77 -0.65 -5.05 117.00 120.74 1f6p n LEU 292 Ca -0.06 -3.48 0.03 0.00 -0.03 0.00 0.00 56.01 52.47 1f6p n LEU 292 Cb 0.43 -0.27 0.03 0.00 -2.33 0.00 0.00 43.42 41.28 1f6p n LEU 292 CO 0.17 1.26 0.35 -1.20 -1.33 0.00 0.00 177.39 176.64