#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f6p s ARG 2 N 0.00 4.62 -0.01 0.03 3.52 -1.26 -4.97 118.95 120.88 1f6p s ARG 2 Ca 0.00 1.76 -0.30 0.00 -0.13 0.00 0.00 55.73 57.06 1f6p s ARG 2 Cb 0.00 -3.23 -0.06 0.00 -1.56 0.00 0.00 34.95 30.09 1f6p s ARG 2 CO 0.00 0.14 1.61 0.34 -0.81 0.00 0.00 175.30 176.58 1f6p s ASP 3 N -0.49 6.68 0.00 -2.12 -1.08 -1.26 -4.93 116.67 113.47 1f6p s ASP 3 Ca 0.47 2.28 0.22 0.00 -0.52 0.00 0.00 52.55 55.00 1f6p s ASP 3 Cb -0.31 -2.55 0.61 0.00 -1.46 0.00 0.00 42.92 39.21 1f6p s ASP 3 CO 0.38 -0.88 1.51 0.18 0.52 0.00 0.00 175.17 176.88 1f6p n LEU 4 N 6.38 3.85 -4.84 -1.34 4.77 -1.26 -4.84 117.00 119.73 1f6p n LEU 4 Ca 0.16 -1.95 -0.30 0.00 -0.03 0.00 0.00 56.01 53.89 1f6p n LEU 4 Cb 0.42 -0.45 0.09 0.00 -2.33 0.00 0.00 43.42 41.15 1f6p n LEU 4 CO 0.62 0.95 0.74 -0.54 -1.33 0.00 0.00 177.39 177.82 1f6p s LYS 5 N -1.05 2.13 0.00 3.23 1.02 -1.26 -4.94 119.74 118.88 1f6p s LYS 5 Ca 0.47 0.45 0.00 0.00 0.02 0.00 0.00 55.97 56.91 1f6p s LYS 5 Cb 0.24 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.62 1f6p s LYS 5 CO 0.32 -1.54 0.00 0.41 -0.92 0.00 0.00 175.35 173.62 1f6p n GLY 6 N -2.55 -1.00 3.61 -3.33 0.00 -0.66 -4.92 105.19 96.34 1f6p n GLY 6 Ca 0.07 -2.06 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 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 5.19 -0.08 -0.61 -1.09 -1.26 -1.63 121.20 121.72 1f6p s ILE 7 Ca 0.00 0.53 0.04 0.00 -2.23 0.00 0.00 60.65 58.99 1f6p s ILE 7 Cb 0.00 -3.68 0.00 0.00 -1.58 0.00 0.00 42.46 37.20 1f6p s ILE 7 CO 0.00 0.17 -0.20 -0.36 -1.23 0.00 0.00 174.94 173.32 1f6p s PHE 8 N 1.99 2.16 0.09 3.97 0.40 -0.01 -0.24 117.98 126.33 1f6p s PHE 8 Ca 0.14 -0.82 -0.22 0.00 -0.60 0.00 0.00 56.93 55.43 1f6p s PHE 8 Cb -0.16 -1.46 -0.07 0.00 0.51 0.00 0.00 43.02 41.84 1f6p s PHE 8 CO 0.10 -0.33 0.67 -1.12 0.70 0.00 0.00 175.22 175.24 1f6p s SER 9 N 0.34 7.18 -0.44 1.36 0.01 -0.89 -1.05 113.70 120.22 1f6p s SER 9 Ca -0.15 1.41 -0.27 0.00 1.31 0.00 0.00 55.95 58.25 1f6p s SER 9 Cb -0.16 -2.42 0.02 0.00 0.21 0.00 0.00 66.02 63.67 1f6p s SER 9 CO 0.06 0.19 1.01 0.00 0.41 0.00 0.00 173.24 174.91 1f6p s ALA 10 N -0.82 3.27 0.08 1.44 0.00 0.14 -1.19 121.76 124.67 1f6p s ALA 10 Ca 0.33 -0.56 -0.32 0.00 0.00 0.00 0.00 51.96 51.41 1f6p s ALA 10 Cb -0.21 -3.71 -0.12 0.00 0.00 0.00 0.00 23.12 19.09 1f6p s ALA 10 CO 0.22 -1.98 1.80 -0.11 0.00 0.00 0.00 175.76 175.69 1f6p n LEU 11 N 7.28 3.73 -4.87 0.00 7.94 -0.15 -4.62 117.00 126.32 1f6p n LEU 11 Ca 0.09 1.00 -0.31 0.00 -1.11 0.00 0.00 56.01 55.67 1f6p n LEU 11 Cb 0.48 -1.48 -0.05 0.00 0.53 0.00 0.00 43.42 42.90 1f6p n LEU 11 CO 0.65 0.03 0.33 -0.76 -1.11 0.00 0.00 177.39 176.54 1f6p s LEU 12 N 2.73 4.05 -0.06 -1.96 1.02 -1.26 -3.06 118.68 120.14 1f6p s LEU 12 Ca 0.84 1.07 0.03 0.00 0.02 0.00 0.00 54.13 56.09 1f6p s LEU 12 Cb -0.57 -3.88 -0.03 0.00 0.02 0.00 0.00 46.19 41.74 1f6p s LEU 12 CO 0.41 -0.20 -0.13 -0.69 0.02 0.00 0.00 176.35 175.76 1f6p s VAL 13 N -2.02 3.18 -0.10 -1.59 1.01 -1.26 -4.93 120.40 114.69 1f6p s VAL 13 Ca 0.50 -0.68 -0.23 0.00 0.00 0.00 0.00 61.98 61.58 1f6p s VAL 13 Cb -0.11 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 1f6p s VAL 13 CO 0.23 0.59 0.70 -0.55 0.00 0.00 0.00 175.10 176.06 1f6p s SER 14 N -0.69 6.93 0.13 3.32 0.15 -1.26 -4.89 113.70 117.38 1f6p s SER 14 Ca 0.11 1.12 0.09 0.00 0.70 0.00 0.00 55.95 57.97 1f6p s SER 14 Cb -0.11 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.76 1f6p s SER 14 CO 0.01 -0.16 -0.19 -0.36 1.20 0.00 0.00 173.24 173.73 1f6p s PHE 15 N 1.10 2.49 0.82 3.44 0.08 -1.19 -1.28 117.98 123.44 1f6p s PHE 15 Ca 0.36 -0.29 -0.12 0.00 0.12 0.00 0.00 56.93 57.00 1f6p s PHE 15 Cb -0.17 -1.31 0.09 0.00 -0.57 0.00 0.00 43.02 41.05 1f6p s PHE 15 CO 0.16 0.39 1.16 -0.80 -0.10 0.00 0.00 175.22 176.03 1f6p s ASN 16 N -2.20 4.36 0.36 1.36 0.01 0.20 -0.78 114.94 118.24 1f6p s ASN 16 Ca 0.18 0.86 0.04 0.00 -0.71 0.00 0.00 52.86 53.23 1f6p s ASN 16 Cb -0.10 -1.40 0.69 0.00 0.41 0.00 0.00 41.25 40.84 1f6p s ASN 16 CO 0.10 -2.01 1.99 -0.08 -1.51 0.00 0.00 177.10 175.59 1f6p h GLU 17 N -1.12 0.78 0.00 -0.60 4.81 -1.94 0.14 114.58 116.64 1f6p h GLU 17 Ca -0.47 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1f6p h GLU 17 Cb 1.32 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.53 1f6p h GLU 17 CO 0.65 0.52 0.00 -0.40 -0.73 0.00 0.00 179.01 179.05 1f6p n ASP 18 N -4.46 0.00 0.00 1.04 5.75 -1.26 -4.89 116.55 112.73 1f6p n ASP 18 Ca 0.08 -1.72 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 1f6p n ASP 18 Cb 0.12 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 1f6p n ASP 18 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f6p n GLY 19 N 0.38 1.47 3.86 6.12 0.00 0.48 -5.03 105.19 112.47 1f6p n GLY 19 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.07 4.68 0.18 2.61 -4.23 -1.26 -4.75 115.64 109.80 1f6p s THR 20 Ca 0.00 0.88 -0.31 0.00 -1.18 0.00 0.00 61.69 61.08 1f6p s THR 20 Cb 0.00 -3.78 -0.09 0.00 1.34 0.00 0.00 72.50 69.96 1f6p s THR 20 CO 0.00 -0.80 1.47 -0.63 -0.54 0.00 0.00 174.62 174.12 1f6p s ILE 21 N -2.74 2.83 -0.69 2.99 1.01 -1.26 0.59 121.20 123.93 1f6p s ILE 21 Ca 0.55 0.63 -0.16 0.00 0.00 0.00 0.00 60.65 61.67 1f6p s ILE 21 Cb -0.10 -3.40 0.16 0.00 0.01 0.00 0.00 42.46 39.13 1f6p s ILE 21 CO 0.39 0.07 0.68 0.21 0.00 0.00 0.00 174.94 176.29 1f6p s ASN 22 N 0.83 6.46 0.18 3.58 3.84 -0.40 -4.75 114.94 124.67 1f6p s ASN 22 Ca 0.64 -2.14 -0.14 0.00 0.21 0.00 0.00 52.86 51.44 1f6p s ASN 22 Cb -0.41 -2.23 0.08 0.00 -0.55 0.00 0.00 41.25 38.13 1f6p s ASN 22 CO 0.35 -0.79 1.84 -0.08 -2.79 0.00 0.00 177.10 175.64 1f6p h GLU 23 N 8.46 0.73 -0.53 0.43 4.81 -1.93 0.39 114.58 126.94 1f6p h GLU 23 Ca -0.10 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.12 1f6p h GLU 23 Cb 1.07 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.25 1f6p h GLU 23 CO 0.93 0.48 0.30 -0.22 -0.73 0.00 0.00 179.01 179.78 1f6p h LYS 24 N 0.75 0.58 -0.44 1.92 3.64 -1.96 0.11 116.57 121.16 1f6p h LYS 24 Ca 0.21 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.43 1f6p h LYS 24 Cb -0.08 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 1f6p h LYS 24 CO -0.05 0.38 -0.22 0.78 -2.27 0.00 0.00 179.45 178.08 1f6p h GLY 25 N 0.60 0.98 0.98 5.01 0.00 -1.60 -1.30 103.07 107.73 1f6p h GLY 25 Ca 0.22 -0.85 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 1f6p h GLY 25 CO -0.11 0.77 0.24 -2.00 0.00 0.00 0.00 176.54 175.44 1f6p h LEU 26 N 0.78 0.48 -1.22 3.11 5.85 -0.55 -0.68 115.31 123.07 1f6p h LEU 26 Ca 0.10 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.80 1f6p h LEU 26 Cb 0.77 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.63 1f6p h LEU 26 CO 0.06 0.39 0.54 0.03 -0.34 0.00 0.00 178.44 179.13 1f6p h ARG 27 N 0.52 1.00 -0.04 1.25 3.08 -0.35 -1.15 114.38 118.69 1f6p h ARG 27 Ca 0.14 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.03 1f6p h ARG 27 Cb 0.01 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 1f6p h ARG 27 CO -0.03 0.66 -0.43 1.96 -1.07 0.00 0.00 179.97 181.06 1f6p h GLN 28 N 1.03 0.09 -0.27 0.04 4.20 -0.13 -0.57 115.11 119.49 1f6p h GLN 28 Ca 0.32 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.89 1f6p h GLN 28 Cb 0.01 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1f6p h GLN 28 CO -0.09 0.51 -0.24 0.82 -0.67 0.00 0.00 178.83 179.16 1f6p h ILE 29 N 0.08 1.31 -0.30 2.54 2.04 -0.08 -1.13 117.51 121.96 1f6p h ILE 29 Ca 0.00 -1.39 -0.01 0.00 1.00 0.00 0.00 64.86 64.46 1f6p h ILE 29 Cb 0.80 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 1f6p h ILE 29 CO 0.06 0.44 0.13 0.40 0.00 0.00 0.00 178.15 179.18 1f6p h ILE 30 N 0.37 1.17 -0.89 -0.67 2.04 -1.12 -1.30 117.51 117.11 1f6p h ILE 30 Ca 0.05 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1f6p h ILE 30 Cb 0.79 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 1f6p h ILE 30 CO 0.06 0.17 0.49 0.03 0.00 0.00 0.00 178.15 178.90 1f6p h ARG 31 N 0.35 1.23 -0.81 2.37 2.47 -1.05 -0.77 114.38 118.17 1f6p h ARG 31 Ca 0.10 -0.14 -0.04 0.00 -1.26 0.00 0.00 59.98 58.64 1f6p h ARG 31 Cb 0.15 -0.24 -0.04 0.00 -1.65 0.00 0.00 29.97 28.19 1f6p h ARG 31 CO -0.01 0.90 0.35 1.25 0.56 0.00 0.00 179.97 183.02 1f6p h HIS 32 N 1.24 1.21 -0.60 3.04 2.76 -0.98 0.49 115.15 122.30 1f6p h HIS 32 Ca 0.31 -0.08 -0.04 0.00 -2.20 0.00 0.00 60.37 58.36 1f6p h HIS 32 Cb 0.02 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 28.59 1f6p h HIS 32 CO 0.01 0.90 0.21 -0.91 -1.30 0.00 0.00 177.93 176.84 1f6p h ASN 33 N 1.17 0.86 0.03 3.26 2.35 -0.47 -0.59 115.58 122.18 1f6p h ASN 33 Ca 0.27 -0.19 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 1f6p h ASN 33 Cb 0.18 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 38.33 1f6p h ASN 33 CO -0.03 0.82 -0.31 0.40 -1.65 0.00 0.00 177.43 176.66 1f6p h ILE 34 N 0.85 1.59 0.09 2.81 2.04 -0.73 -0.72 117.51 123.45 1f6p h ILE 34 Ca 0.20 -2.16 -0.17 0.00 1.00 0.00 0.00 64.86 63.73 1f6p h ILE 34 Cb 0.26 2.99 0.02 0.00 -0.74 0.00 0.00 36.82 39.35 1f6p h ILE 34 CO -0.01 0.59 -0.72 0.44 0.00 0.00 0.00 178.15 178.45 1f6p h ASP 35 N -0.58 0.47 0.00 1.72 3.32 -1.01 -3.26 116.42 117.08 1f6p h ASP 35 Ca -0.05 -0.90 -0.30 0.00 0.02 0.00 0.00 57.03 55.80 1f6p h ASP 35 Cb 1.14 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.49 1f6p h ASP 35 CO 0.06 1.32 -1.84 0.29 -1.72 0.00 0.00 179.24 177.36 1f6p n LYS 36 N -4.17 0.56 0.20 3.56 4.76 -0.39 -4.48 118.16 118.20 1f6p n LYS 36 Ca -0.13 0.35 0.06 0.00 -2.87 0.00 0.00 58.31 55.73 1f6p n LYS 36 Cb 0.76 -1.56 0.38 0.00 -1.84 0.00 0.00 35.03 32.78 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 -1.00 0.00 -5.81 1.97 2.86 -1.12 -3.46 114.93 108.37 1f6p h MET 37 Ca -0.46 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 56.81 1f6p h MET 37 Cb 1.36 0.00 0.13 0.00 0.06 0.00 0.00 31.60 33.15 1f6p h MET 37 CO -0.28 0.35 -0.75 1.63 1.06 0.00 0.00 176.91 178.92 1f6p n LYS 38 N -3.62 -6.69 -1.67 1.72 4.76 -0.31 -4.31 118.16 108.05 1f6p n LYS 38 Ca -0.01 0.80 -0.32 0.00 -2.87 0.00 0.00 58.31 55.91 1f6p n LYS 38 Cb 0.46 -5.75 0.05 0.00 -1.84 0.00 0.00 35.03 27.95 1f6p n LYS 38 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1f6p s VAL 39 N -3.39 3.70 -0.31 -0.18 -7.23 -1.02 -4.94 120.40 107.04 1f6p s VAL 39 Ca 0.21 0.65 0.23 0.00 -1.81 0.00 0.00 61.98 61.26 1f6p s VAL 39 Cb -0.09 -3.24 0.29 0.00 0.56 0.00 0.00 36.38 33.89 1f6p s VAL 39 CO 0.75 -0.62 1.63 0.44 -0.31 0.00 0.00 175.10 176.99 1f6p h ASP 40 N -0.37 0.00 -5.53 4.85 3.32 -0.97 -3.47 116.42 114.26 1f6p h ASP 40 Ca -0.45 0.00 0.21 0.00 0.02 0.00 0.00 57.03 56.81 1f6p h ASP 40 Cb 1.22 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.72 1f6p h ASP 40 CO 0.55 0.10 0.67 -0.83 -1.72 0.00 0.00 179.24 178.01 1f6p s GLY 41 N -4.26 0.01 0.07 2.75 0.00 -0.86 -0.74 107.32 104.30 1f6p s GLY 41 Ca 0.06 -0.17 0.08 0.00 0.00 0.00 0.00 44.72 44.68 1f6p s GLY 41 CO 0.67 2.92 -0.22 1.08 0.00 0.00 0.00 173.10 177.55 1f6p s LEU 42 N -3.45 2.23 -0.34 0.66 1.43 -0.31 -2.10 118.68 116.80 1f6p s LEU 42 Ca 0.23 -0.61 0.02 0.00 -1.03 0.00 0.00 54.13 52.74 1f6p s LEU 42 Cb -0.02 -0.99 0.09 0.00 0.03 0.00 0.00 46.19 45.31 1f6p s LEU 42 CO 0.03 0.13 0.05 -0.47 0.23 0.00 0.00 176.35 176.32 1f6p s TYR 43 N -0.96 3.62 -0.09 0.29 5.04 -0.33 -1.43 117.35 123.50 1f6p s TYR 43 Ca 0.08 -2.72 -0.09 0.00 -2.44 0.00 0.00 57.07 51.90 1f6p s TYR 43 Cb -0.09 -2.76 -0.04 0.00 0.35 0.00 0.00 41.96 39.41 1f6p s TYR 43 CO 0.03 -0.93 0.21 0.08 -1.34 0.00 0.00 175.55 173.60 1f6p s VAL 44 N 1.00 5.39 0.00 3.14 1.01 -0.56 -0.98 120.40 129.40 1f6p s VAL 44 Ca 0.06 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1f6p s VAL 44 Cb -0.20 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1f6p s VAL 44 CO -0.06 0.60 0.00 0.61 0.00 0.00 0.00 175.10 176.25 1f6p n GLY 45 N 1.92 0.49 2.86 4.51 0.00 -1.26 -0.26 105.19 113.44 1f6p n GLY 45 Ca -0.18 -0.54 -0.20 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.90 -0.57 0.37 -0.02 0.00 -1.26 -4.61 105.19 96.19 1f6p n GLY 46 Ca 0.00 -1.82 0.11 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.95 0.75 0.22 1.61 0.02 -1.96 -2.06 113.55 111.19 1f6p h SER 47 Ca -0.29 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.68 1f6p h SER 47 Cb 0.89 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.32 1f6p h SER 47 CO 0.24 0.38 -0.13 0.74 -1.14 0.00 0.00 176.83 176.92 1f6p h THR 48 N 0.80 0.81 -0.01 -2.27 2.02 -1.91 -1.71 112.91 110.64 1f6p h THR 48 Ca 0.47 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1f6p h THR 48 Cb 0.66 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1f6p h THR 48 CO -0.24 0.12 0.00 0.61 0.37 0.00 0.00 175.52 176.39 1f6p n GLY 49 N -0.94 -0.95 2.46 2.16 0.00 -0.77 -4.53 105.19 102.62 1f6p n GLY 49 Ca -0.02 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.53 -1.41 -0.10 1.61 1.02 -0.64 -4.48 120.64 116.11 1f6p n GLU 50 Ca 0.03 1.05 -0.06 0.00 -0.02 0.00 0.00 57.16 58.17 1f6p n GLU 50 Cb 0.02 -5.47 0.01 0.00 -0.02 0.00 0.00 31.44 25.98 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 -0.48 0.00 1.62 -0.73 -1.72 -2.27 115.58 112.00 1f6p h ASN 51 Ca -0.42 0.13 0.00 0.00 1.87 0.00 0.00 56.30 57.88 1f6p h ASN 51 Cb 1.28 0.28 0.00 0.00 0.27 0.00 0.00 38.32 40.15 1f6p h ASN 51 CO 0.55 -0.17 0.00 0.49 -0.37 0.00 0.00 177.43 177.93 1f6p n PHE 52 N -5.33 0.00 0.32 0.67 3.72 -1.26 -1.80 117.46 113.78 1f6p n PHE 52 Ca 0.02 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.48 1f6p n PHE 52 Cb 0.24 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 38.87 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 -0.75 1.34 -3.90 -1.08 2.81 -0.85 -5.02 117.12 109.68 1f6p n MET 53 Ca 0.07 -1.50 -0.22 0.00 -1.81 0.00 0.00 57.70 54.24 1f6p n MET 53 Cb 0.03 -1.26 -0.05 0.00 -0.71 0.00 0.00 33.22 31.23 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 -1.04 3.40 0.70 4.03 1.43 -0.75 -5.01 118.68 121.45 1f6p s LEU 54 Ca 0.18 -0.68 -0.05 0.00 -1.03 0.00 0.00 54.13 52.55 1f6p s LEU 54 Cb 0.11 -1.96 0.08 0.00 0.03 0.00 0.00 46.19 44.46 1f6p s LEU 54 CO 0.16 -0.40 0.99 -0.94 0.23 0.00 0.00 176.35 176.39 1f6p s SER 55 N -3.96 4.66 0.26 2.29 1.04 -1.26 -4.94 113.70 111.80 1f6p s SER 55 Ca 0.41 0.20 -0.01 0.00 0.48 0.00 0.00 55.95 57.03 1f6p s SER 55 Cb -0.03 -0.79 0.35 0.00 0.10 0.00 0.00 66.02 65.64 1f6p s SER 55 CO 0.25 -1.66 1.73 0.74 0.98 0.00 0.00 173.24 175.28 1f6p h THR 56 N -0.55 1.25 -0.50 2.02 2.02 -2.00 -2.33 112.91 112.82 1f6p h THR 56 Ca -0.42 -1.14 -0.13 0.00 0.77 0.00 0.00 66.41 65.48 1f6p h THR 56 Cb 1.30 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.80 1f6p h THR 56 CO 0.53 0.38 -0.19 -0.33 0.37 0.00 0.00 175.52 176.28 1f6p h GLU 57 N 0.61 1.02 -0.24 6.66 4.39 -1.99 -2.25 114.58 122.77 1f6p h GLU 57 Ca 0.10 -0.42 -0.10 0.00 0.34 0.00 0.00 59.36 59.28 1f6p h GLU 57 Cb 0.57 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1f6p h GLU 57 CO 0.04 1.10 -0.28 0.93 -1.16 0.00 0.00 179.01 179.64 1f6p h GLU 58 N 0.88 0.48 -0.24 2.33 5.08 -1.90 0.63 114.58 121.84 1f6p h GLU 58 Ca 0.12 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1f6p h GLU 58 Cb 0.77 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1f6p h GLU 58 CO 0.06 0.71 0.11 0.87 -1.00 0.00 0.00 179.01 179.77 1f6p h LYS 59 N 0.42 0.34 -0.68 2.33 1.57 -1.05 0.17 116.57 119.68 1f6p h LYS 59 Ca 0.06 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1f6p h LYS 59 Cb 0.71 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.91 1f6p h LYS 59 CO 0.05 0.36 0.40 0.87 -0.57 0.00 0.00 179.45 180.57 1f6p h LYS 60 N 0.24 0.75 -0.63 3.15 1.57 -1.20 -0.62 116.57 119.84 1f6p h LYS 60 Ca 0.08 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1f6p h LYS 60 Cb 0.14 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.24 1f6p h LYS 60 CO -0.01 0.50 0.39 0.93 -0.57 0.00 0.00 179.45 180.69 1f6p h GLU 61 N 0.77 0.75 -0.56 3.15 4.39 0.11 0.85 114.58 124.05 1f6p h GLU 61 Ca 0.28 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.93 1f6p h GLU 61 Cb 0.09 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 1f6p h GLU 61 CO -0.14 0.50 0.30 0.82 -1.16 0.00 0.00 179.01 179.33 1f6p h ILE 62 N 0.77 1.19 -0.81 3.13 2.04 -0.16 -0.99 117.51 122.69 1f6p h ILE 62 Ca 0.25 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1f6p h ILE 62 Cb 0.00 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 1f6p h ILE 62 CO -0.09 0.21 0.51 -0.26 0.00 0.00 0.00 178.15 178.52 1f6p h PHE 63 N 0.76 1.04 0.14 1.37 0.04 -0.56 -1.13 116.94 118.59 1f6p h PHE 63 Ca 0.20 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.97 1f6p h PHE 63 Cb 0.06 -0.35 0.00 0.00 2.20 0.00 0.00 35.95 37.86 1f6p h PHE 63 CO -0.01 0.68 -0.07 -0.09 -0.60 0.00 0.00 178.31 178.22 1f6p h ARG 64 N 1.11 -0.18 -0.40 1.51 2.43 0.00 -2.55 114.38 116.31 1f6p h ARG 64 Ca 0.29 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.52 1f6p h ARG 64 Cb -0.09 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 1f6p h ARG 64 CO -0.06 0.17 0.15 0.82 -1.51 0.00 0.00 179.97 179.54 1f6p h ILE 65 N -0.55 0.90 -0.83 1.20 2.04 -1.11 0.56 117.51 119.72 1f6p h ILE 65 Ca -0.02 -0.11 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1f6p h ILE 65 Cb 0.43 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1f6p h ILE 65 CO 0.03 0.06 0.50 0.00 0.00 0.00 0.00 178.15 178.74 1f6p h ALA 66 N 1.25 1.05 -0.16 1.87 0.00 -1.20 0.22 119.26 122.29 1f6p h ALA 66 Ca 0.18 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 1f6p h ALA 66 Cb 0.15 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1f6p h ALA 66 CO -0.17 0.52 -0.65 -0.22 0.00 0.00 0.00 179.25 178.73 1f6p h LYS 67 N 1.13 0.60 -0.48 0.00 1.63 -1.11 0.11 116.57 118.44 1f6p h LYS 67 Ca 0.30 -0.43 -0.03 0.00 -0.85 0.00 0.00 60.65 59.64 1f6p h LYS 67 Cb -0.04 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1f6p h LYS 67 CO -0.06 1.05 0.19 0.22 -3.45 0.00 0.00 179.45 177.41 1f6p h ASP 68 N 0.44 0.67 -0.01 4.20 3.58 -0.07 -0.27 116.42 124.96 1f6p h ASP 68 Ca -0.01 -0.17 -0.25 0.00 0.42 0.00 0.00 57.03 57.02 1f6p h ASP 68 Cb 1.23 -0.17 0.02 0.00 1.72 0.00 0.00 39.33 42.12 1f6p h ASP 68 CO 0.12 0.65 -0.96 -0.08 -2.88 0.00 0.00 179.24 176.10 1f6p h GLU 69 N 0.64 0.67 0.00 0.28 4.57 -0.51 -3.30 114.58 116.93 1f6p h GLU 69 Ca 0.16 -0.70 -0.18 0.00 -1.18 0.00 0.00 59.36 57.45 1f6p h GLU 69 Cb 0.19 0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.96 1f6p h GLU 69 CO -0.01 1.29 -0.86 0.00 -1.18 0.00 0.00 179.01 178.25 1f6p h ALA 70 N 0.40 0.58 -0.64 2.92 0.00 -0.75 -3.49 119.26 118.28 1f6p h ALA 70 Ca -0.12 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.03 1f6p h ALA 70 Cb 1.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1f6p h ALA 70 CO 0.19 1.03 0.00 1.63 0.00 0.00 0.00 179.25 182.10 1f6p n LYS 71 N -3.56 0.00 -0.30 0.00 5.02 -0.12 -2.20 118.16 117.01 1f6p n LYS 71 Ca -0.01 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.36 1f6p n LYS 71 Cb 0.81 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 36.02 1f6p n LYS 71 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1f6p n ASP 72 N 6.10 3.29 0.22 4.39 5.75 -1.26 -4.68 116.55 130.37 1f6p n ASP 72 Ca 0.00 -2.80 0.08 0.00 -0.01 0.00 0.00 54.79 52.06 1f6p n ASP 72 Cb 0.00 -0.43 0.53 0.00 -1.03 0.00 0.00 41.12 40.18 1f6p n ASP 72 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 1f6p h GLN 73 N 1.36 0.00 -4.52 0.11 4.20 -1.84 -3.46 115.11 110.96 1f6p h GLN 73 Ca 0.00 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.45 1f6p h GLN 73 Cb 1.18 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.82 1f6p h GLN 73 CO 0.13 0.23 -0.53 0.96 -0.67 0.00 0.00 178.83 178.95 1f6p s ILE 74 N -4.19 0.00 0.50 2.54 -4.36 -1.26 -5.03 121.20 109.40 1f6p s ILE 74 Ca -0.03 -1.92 -0.17 0.00 -0.26 0.00 0.00 60.65 58.27 1f6p s ILE 74 Cb 0.14 -2.47 -0.08 0.00 1.25 0.00 0.00 42.46 41.29 1f6p s ILE 74 CO 0.66 0.00 0.98 0.00 0.24 0.00 0.00 174.94 176.82 1f6p s ALA 75 N -3.99 3.04 -0.08 2.27 0.00 0.08 -4.96 121.76 118.13 1f6p s ALA 75 Ca 0.37 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.57 1f6p s ALA 75 Cb 0.05 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 20.06 1f6p s ALA 75 CO 0.14 -0.20 -0.04 -0.51 0.00 0.00 0.00 175.76 175.15 1f6p s LEU 76 N -3.93 1.05 -0.10 0.00 1.43 -1.26 -1.16 118.68 114.71 1f6p s LEU 76 Ca 0.60 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 1f6p s LEU 76 Cb -0.10 -0.60 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 1f6p s LEU 76 CO 0.28 -0.12 -0.10 -0.63 0.23 0.00 0.00 176.35 176.02 1f6p s ILE 77 N 1.51 3.40 -0.23 -0.59 1.01 -0.51 -1.13 121.20 124.66 1f6p s ILE 77 Ca -0.01 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.04 1f6p s ILE 77 Cb -0.13 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.92 1f6p s ILE 77 CO -0.04 0.55 -0.03 0.00 0.00 0.00 0.00 174.94 175.42 1f6p s ALA 78 N -0.18 2.84 -0.36 9.38 0.00 -0.42 -1.50 121.76 131.52 1f6p s ALA 78 Ca 0.01 -1.20 -0.21 0.00 0.00 0.00 0.00 51.96 50.56 1f6p s ALA 78 Cb -0.13 -1.75 0.01 0.00 0.00 0.00 0.00 23.12 21.25 1f6p s ALA 78 CO 0.03 -0.49 0.69 -1.14 0.00 0.00 0.00 175.76 174.86 1f6p s GLN 79 N 1.48 3.69 -0.00 0.00 -0.44 0.63 -1.17 119.66 123.85 1f6p s GLN 79 Ca 0.05 0.13 0.00 0.00 -2.50 0.00 0.00 55.36 53.05 1f6p s GLN 79 Cb -0.15 -3.82 0.01 0.00 -1.64 0.00 0.00 33.01 27.42 1f6p s GLN 79 CO -0.03 -0.79 0.97 1.33 0.50 0.00 0.00 175.29 177.27 1f6p n VAL 80 N 5.68 0.94 -1.33 1.34 0.24 -0.04 -4.58 118.33 120.58 1f6p n VAL 80 Ca 0.00 -0.95 -0.32 0.00 -2.04 0.00 0.00 64.34 61.03 1f6p n VAL 80 Cb 0.48 0.52 0.09 0.00 -1.47 0.00 0.00 33.84 33.47 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 -0.97 1.98 0.10 7.63 0.00 -1.25 -4.29 107.32 110.53 1f6p s GLY 81 Ca 0.01 0.56 -0.26 0.00 0.00 0.00 0.00 44.72 45.02 1f6p s GLY 81 CO 0.00 0.93 0.92 -0.45 0.00 0.00 0.00 173.10 174.51 1f6p s SER 82 N -2.70 -0.25 0.50 1.64 0.15 -1.26 -4.81 113.70 106.97 1f6p s SER 82 Ca 0.67 -0.27 0.29 0.00 0.70 0.00 0.00 55.95 57.34 1f6p s SER 82 Cb -0.22 0.46 1.00 0.00 -1.71 0.00 0.00 66.02 65.55 1f6p s SER 82 CO 0.50 -0.82 1.85 0.58 1.20 0.00 0.00 173.24 176.55 1f6p h VAL 83 N 2.00 0.10 -2.77 4.45 2.07 -1.94 -3.39 116.25 116.77 1f6p h VAL 83 Ca -0.24 -0.77 -0.68 0.00 0.82 0.00 0.00 66.70 65.83 1f6p h VAL 83 Cb 1.24 1.70 -0.18 0.00 -1.52 0.00 0.00 31.29 32.53 1f6p h VAL 83 CO 0.27 0.04 0.41 0.21 0.02 0.00 0.00 177.57 178.52 1f6p s ASN 84 N -5.92 6.30 0.42 0.57 3.84 -1.26 -4.95 114.94 113.94 1f6p s ASN 84 Ca 0.03 -1.48 0.12 0.00 0.21 0.00 0.00 52.86 51.74 1f6p s ASN 84 Cb 0.08 -2.36 0.97 0.00 -0.55 0.00 0.00 41.25 39.39 1f6p s ASN 84 CO 0.60 -1.19 1.97 0.25 -2.79 0.00 0.00 177.10 175.94 1f6p h LEU 85 N 10.41 0.43 -0.67 3.21 5.85 -2.00 0.27 115.31 132.82 1f6p h LEU 85 Ca -0.18 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.42 1f6p h LEU 85 Cb 1.07 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1f6p h LEU 85 CO 1.11 0.26 -0.35 0.11 -0.34 0.00 0.00 178.44 179.24 1f6p h LYS 86 N 0.49 0.65 -0.54 1.25 1.57 -1.96 -0.09 116.57 117.94 1f6p h LYS 86 Ca 0.29 -0.31 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 1f6p h LYS 86 Cb 0.49 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1f6p h LYS 86 CO -0.09 0.90 0.14 1.49 -0.57 0.00 0.00 179.45 181.32 1f6p h GLU 87 N 0.54 0.85 -0.73 3.15 4.81 -1.53 -1.20 114.58 120.48 1f6p h GLU 87 Ca 0.06 -0.20 0.01 0.00 -0.13 0.00 0.00 59.36 59.10 1f6p h GLU 87 Cb 0.86 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.08 1f6p h GLU 87 CO 0.07 0.80 0.48 0.00 -0.73 0.00 0.00 179.01 179.63 1f6p h ALA 88 N 1.01 0.93 0.08 2.92 0.00 -0.60 0.96 119.26 124.56 1f6p h ALA 88 Ca 0.17 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1f6p h ALA 88 Cb 0.33 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1f6p h ALA 88 CO 0.00 0.32 -0.04 0.28 0.00 0.00 0.00 179.25 179.82 1f6p h VAL 89 N 0.97 0.94 -0.75 0.00 2.07 -0.93 0.45 116.25 118.99 1f6p h VAL 89 Ca 0.27 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.70 1f6p h VAL 89 Cb -0.09 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1f6p h VAL 89 CO -0.07 0.01 0.25 -0.08 0.02 0.00 0.00 177.57 177.70 1f6p h GLU 90 N -0.12 1.16 -0.50 1.57 4.81 -0.69 0.10 114.58 120.90 1f6p h GLU 90 Ca -0.01 -0.24 -0.04 0.00 -0.13 0.00 0.00 59.36 58.94 1f6p h GLU 90 Cb 0.10 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1f6p h GLU 90 CO 0.02 0.98 0.17 -0.07 -0.73 0.00 0.00 179.01 179.38 1f6p h LEU 91 N 1.12 0.71 -0.89 1.64 3.38 -0.70 -2.39 115.31 118.18 1f6p h LEU 91 Ca 0.24 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1f6p h LEU 91 Cb 0.29 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1f6p h LEU 91 CO -0.01 0.71 0.54 1.23 0.09 0.00 0.00 178.44 181.00 1f6p h GLY 92 N 0.67 1.30 0.97 0.83 0.00 -0.38 0.59 103.07 107.06 1f6p h GLY 92 Ca 0.16 -0.54 -0.04 0.00 0.00 0.00 0.00 47.33 46.91 1f6p h GLY 92 CO -0.01 0.53 0.16 0.50 0.00 0.00 0.00 176.54 177.72 1f6p h LYS 93 N 1.23 0.77 -0.32 4.80 1.57 -0.90 0.47 116.57 124.20 1f6p h LYS 93 Ca 0.32 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1f6p h LYS 93 Cb -0.05 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 1f6p h LYS 93 CO -0.06 0.72 0.18 -0.92 -0.57 0.00 0.00 179.45 178.79 1f6p h TYR 94 N 0.68 0.43 -0.51 -1.35 3.20 -0.84 0.30 116.97 118.87 1f6p h TYR 94 Ca 0.16 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.93 1f6p h TYR 94 Cb 0.26 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 1f6p h TYR 94 CO 0.01 0.34 -0.06 0.00 -1.64 0.00 0.00 178.16 176.81 1f6p h ALA 95 N 1.05 0.92 -0.71 1.82 0.00 -0.88 -0.24 119.26 121.22 1f6p h ALA 95 Ca 0.11 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1f6p h ALA 95 Cb 0.05 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1f6p h ALA 95 CO -0.02 0.63 0.47 1.15 0.00 0.00 0.00 179.25 181.48 1f6p h THR 96 N 0.83 1.17 -0.61 0.00 2.02 -0.18 -2.20 112.91 113.93 1f6p h THR 96 Ca 0.14 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1f6p h THR 96 Cb 0.58 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1f6p h THR 96 CO 0.04 0.17 0.29 -0.33 0.37 0.00 0.00 175.52 176.06 1f6p h GLU 97 N 0.94 0.87 0.00 6.66 5.08 0.05 -0.30 114.58 127.88 1f6p h GLU 97 Ca 0.26 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1f6p h GLU 97 Cb -0.09 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.00 1f6p h GLU 97 CO -0.06 0.67 0.00 1.28 -1.00 0.00 0.00 179.01 179.90 1f6p n LEU 98 N -4.35 0.67 0.00 1.33 4.77 -0.14 -4.91 117.00 114.37 1f6p n LEU 98 Ca 0.06 0.66 0.00 0.00 -0.03 0.00 0.00 56.01 56.70 1f6p n LEU 98 Cb 0.13 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1f6p n LEU 98 CO 0.38 -0.54 0.00 0.61 -1.33 0.00 0.00 177.39 176.51 1f6p n GLY 99 N 0.06 0.93 3.68 -0.72 0.00 -0.12 -5.05 105.19 103.97 1f6p n GLY 99 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.87 1.85 0.22 1.61 4.02 -0.97 -4.89 117.16 117.13 1f6p n TYR 100 Ca 0.00 0.51 0.06 0.00 -0.01 0.00 0.00 57.90 58.46 1f6p n TYR 100 Cb 0.00 -2.33 0.51 0.00 -0.02 0.00 0.00 39.34 37.50 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 1.84 0.00 -4.71 7.72 3.32 -1.49 -3.46 116.42 119.64 1f6p h ASP 101 Ca -0.47 0.00 0.07 0.00 0.02 0.00 0.00 57.03 56.64 1f6p h ASP 101 Cb 1.31 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.71 1f6p h ASP 101 CO 0.59 0.22 0.41 0.00 -1.72 0.00 0.00 179.24 178.73 1f6p s LEU 103 N -2.35 3.84 0.02 0.00 1.43 -0.40 -1.30 118.68 119.92 1f6p s LEU 103 Ca 0.02 -0.29 -0.15 0.00 -1.03 0.00 0.00 54.13 52.69 1f6p s LEU 103 Cb -0.01 -2.70 0.02 0.00 0.03 0.00 0.00 46.19 43.53 1f6p s LEU 103 CO -0.08 -0.56 0.31 -0.55 0.23 0.00 0.00 176.35 175.71 1f6p s SER 104 N -4.24 -0.16 -0.22 2.29 0.15 -0.32 -0.26 113.70 110.94 1f6p s SER 104 Ca 0.49 -0.07 -0.08 0.00 0.70 0.00 0.00 55.95 56.99 1f6p s SER 104 Cb -0.10 0.34 0.10 0.00 -1.71 0.00 0.00 66.02 64.66 1f6p s SER 104 CO 0.32 -0.55 0.49 0.00 1.20 0.00 0.00 173.24 174.69 1f6p s ALA 105 N -2.07 -1.39 0.51 5.45 0.00 -1.01 -0.86 121.76 122.38 1f6p s ALA 105 Ca -0.08 1.75 -0.23 0.00 0.00 0.00 0.00 51.96 53.40 1f6p s ALA 105 Cb -0.02 -1.41 -0.07 0.00 0.00 0.00 0.00 23.12 21.62 1f6p s ALA 105 CO -0.00 -0.75 1.25 1.55 0.00 0.00 0.00 175.76 177.81 1f6p n VAL 106 N 5.28 3.29 -1.63 0.00 3.14 -1.26 -2.27 118.33 124.87 1f6p n VAL 106 Ca -0.11 -0.50 -0.46 0.00 -2.96 0.00 0.00 64.34 60.31 1f6p n VAL 106 Cb 0.50 -1.52 -0.03 0.00 -1.06 0.00 0.00 33.84 31.73 1f6p n VAL 106 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1f6p n THR 107 N -0.83 1.04 -1.82 1.55 -2.24 -1.09 -4.63 114.28 106.25 1f6p n THR 107 Ca 0.09 -0.26 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 1f6p n THR 107 Cb 0.43 -1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 67.45 1f6p n THR 107 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1f6p s PRO 108 N -0.52 4.15 0.00 -0.78 0.04 -1.26 -4.95 135.00 131.68 1f6p s PRO 108 Ca 0.69 2.52 0.00 0.00 0.04 0.00 0.00 61.00 64.25 1f6p s PRO 108 Cb -0.73 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 30.76 1f6p s PRO 108 CO 0.52 -0.61 0.00 1.97 0.04 0.00 0.00 177.00 178.92 1f6p n PHE 109 N 2.54 -0.00 0.00 0.56 -1.74 -1.26 -4.78 117.46 112.78 1f6p n PHE 109 Ca 0.09 -0.01 0.00 0.00 -0.56 0.00 0.00 57.45 56.97 1f6p n PHE 109 Cb 0.38 -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 -0.01 0.00 -1.41 2.97 9.36 -1.26 -4.81 117.16 121.99 1f6p n TYR 110 Ca -0.00 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.89 1f6p n TYR 110 Cb 0.00 0.00 0.09 0.00 -0.63 0.00 0.00 39.34 38.80 1f6p n TYR 110 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 1f6p s TYR 111 N 0.00 2.23 -1.20 2.98 2.02 -1.26 -4.93 117.35 117.19 1f6p s TYR 111 Ca 0.00 1.61 -0.15 0.00 -0.37 0.00 0.00 57.07 58.16 1f6p s TYR 111 Cb 0.00 -3.31 0.16 0.00 -0.40 0.00 0.00 41.96 38.40 1f6p s TYR 111 CO 0.00 -2.26 1.44 0.15 -1.57 0.00 0.00 175.55 173.31 1f6p s LYS 112 N -4.18 4.05 0.39 -0.62 -0.14 -1.26 -5.02 119.74 112.95 1f6p s LYS 112 Ca 0.70 -2.46 -0.26 0.00 -1.36 0.00 0.00 55.97 52.58 1f6p s LYS 112 Cb -0.24 -5.10 -0.09 0.00 -1.68 0.00 0.00 37.83 30.72 1f6p s LYS 112 CO 0.47 -1.82 1.19 -0.06 -0.76 0.00 0.00 175.35 174.37 1f6p s PHE 113 N 1.93 3.07 0.83 3.18 0.08 -1.26 -5.02 117.98 120.78 1f6p s PHE 113 Ca 0.43 1.54 -0.12 0.00 0.12 0.00 0.00 56.93 58.90 1f6p s PHE 113 Cb -0.02 -3.44 0.09 0.00 -0.57 0.00 0.00 43.02 39.07 1f6p s PHE 113 CO 0.00 -1.40 1.11 -1.54 -0.10 0.00 0.00 175.22 173.29 1f6p s SER 114 N -1.02 4.23 0.20 1.36 1.04 -1.26 -4.85 113.70 113.40 1f6p s SER 114 Ca 0.55 1.17 -0.11 0.00 0.48 0.00 0.00 55.95 58.05 1f6p s SER 114 Cb -0.32 -1.85 0.16 0.00 0.10 0.00 0.00 66.02 64.10 1f6p s SER 114 CO 0.41 -2.12 1.86 0.15 0.98 0.00 0.00 173.24 174.52 1f6p h PHE 115 N -1.20 0.83 -0.50 5.02 3.57 -1.99 0.49 116.94 123.17 1f6p h PHE 115 Ca -0.48 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1f6p h PHE 115 Cb 1.29 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 1f6p h PHE 115 CO 0.41 0.49 0.31 -1.35 -2.23 0.00 0.00 178.31 175.94 1f6p h PRO 116 N 0.88 0.66 -0.54 6.41 0.11 -1.99 0.22 132.00 137.75 1f6p h PRO 116 Ca 0.27 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.29 1f6p h PRO 116 Cb -0.03 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 30.91 1f6p h PRO 116 CO -0.08 0.45 0.17 0.93 -0.21 0.00 0.00 178.00 179.26 1f6p h GLU 117 N 0.68 0.84 -0.56 1.05 5.08 -1.34 0.22 114.58 120.55 1f6p h GLU 117 Ca 0.18 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1f6p h GLU 117 Cb -0.05 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1f6p h GLU 117 CO -0.04 0.76 0.12 0.82 -1.00 0.00 0.00 179.01 179.68 1f6p h ILE 118 N 0.74 1.25 -0.45 3.13 2.04 0.63 -0.73 117.51 124.12 1f6p h ILE 118 Ca 0.17 -0.92 -0.12 0.00 1.00 0.00 0.00 64.86 65.00 1f6p h ILE 118 Cb 0.28 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1f6p h ILE 118 CO -0.01 0.34 -0.19 0.50 0.00 0.00 0.00 178.15 178.79 1f6p h LYS 119 N 0.80 0.93 -0.82 2.37 3.64 -0.42 -1.92 116.57 121.15 1f6p h LYS 119 Ca 0.17 -0.39 0.03 0.00 -1.27 0.00 0.00 60.65 59.20 1f6p h LYS 119 Cb 0.37 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 1f6p h LYS 119 CO 0.01 1.05 0.52 1.25 -2.27 0.00 0.00 179.45 180.01 1f6p h HIS 120 N 0.76 0.98 -0.61 1.91 2.76 -0.22 0.28 115.15 121.02 1f6p h HIS 120 Ca 0.11 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.31 1f6p h HIS 120 Cb 0.75 -0.32 -0.03 0.00 1.55 0.00 0.00 27.41 29.36 1f6p h HIS 120 CO 0.05 0.56 0.39 -0.92 -1.30 0.00 0.00 177.93 176.72 1f6p h TYR 121 N 1.02 0.74 -0.30 5.26 5.03 -0.89 -0.34 116.97 127.48 1f6p h TYR 121 Ca 0.33 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.61 1f6p h TYR 121 Cb 0.02 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 38.04 1f6p h TYR 121 CO -0.03 0.45 -0.02 1.88 -1.32 0.00 0.00 178.16 179.13 1f6p h TYR 122 N 0.79 0.60 -0.80 -3.82 0.05 -0.60 -2.75 116.97 110.44 1f6p h TYR 122 Ca 0.23 -0.11 0.02 0.00 0.05 0.00 0.00 58.73 58.92 1f6p h TYR 122 Cb -0.05 -0.15 -0.04 0.00 1.01 0.00 0.00 36.73 37.49 1f6p h TYR 122 CO -0.04 0.69 0.53 -0.44 -1.05 0.00 0.00 178.16 177.85 1f6p h ASP 123 N 0.34 0.89 -0.37 3.88 3.32 -0.80 -2.01 116.42 121.66 1f6p h ASP 123 Ca 0.08 -0.02 -0.14 0.00 0.02 0.00 0.00 57.03 56.98 1f6p h ASP 123 Cb 0.47 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1f6p h ASP 123 CO 0.02 0.63 -0.30 0.74 -1.72 0.00 0.00 179.24 178.62 1f6p h THR 124 N 1.05 1.27 -0.20 0.35 2.02 -0.99 0.87 112.91 117.28 1f6p h THR 124 Ca 0.30 -1.46 -0.03 0.00 0.77 0.00 0.00 66.41 66.00 1f6p h THR 124 Cb -0.06 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1f6p h THR 124 CO -0.07 0.49 0.02 0.40 0.37 0.00 0.00 175.52 176.73 1f6p h ILE 125 N 0.75 1.23 0.29 3.11 2.04 -1.16 0.68 117.51 124.45 1f6p h ILE 125 Ca 0.08 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 1f6p h ILE 125 Cb 0.86 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1f6p h ILE 125 CO 0.08 0.24 -0.20 0.40 0.00 0.00 0.00 178.15 178.66 1f6p h ILE 126 N 0.11 0.58 -0.32 -0.67 2.04 -1.40 -0.68 117.51 117.17 1f6p h ILE 126 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1f6p h ILE 126 Cb 0.33 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1f6p h ILE 126 CO 0.01 0.00 0.20 0.00 0.00 0.00 0.00 178.15 178.36 1f6p h ALA 127 N 0.20 0.41 0.00 1.87 0.00 -0.55 0.45 119.26 121.63 1f6p h ALA 127 Ca -0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1f6p h ALA 127 Cb 0.41 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1f6p h ALA 127 CO 0.01 -0.11 -0.27 0.93 0.00 0.00 0.00 179.25 179.81 1f6p h GLU 128 N 0.42 0.00 0.00 0.00 4.39 -0.90 -3.28 114.58 115.21 1f6p h GLU 128 Ca 0.12 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.54 1f6p h GLU 128 Cb -0.02 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.58 1f6p h GLU 128 CO -0.02 0.27 -2.20 0.25 -1.16 0.00 0.00 179.01 176.14 1f6p n THR 129 N -3.45 1.02 -0.70 1.13 -2.24 -0.26 -4.93 114.28 104.85 1f6p n THR 129 Ca -0.00 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 1f6p n THR 129 Cb 0.45 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 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 1.76 0.78 3.96 3.38 0.00 0.15 -4.93 105.19 110.29 1f6p n GLY 130 Ca -0.25 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.67 6.33 0.70 1.61 0.01 -1.25 -5.04 113.70 113.39 1f6p s SER 131 Ca 0.00 0.16 -0.13 0.00 1.31 0.00 0.00 55.95 57.29 1f6p s SER 131 Cb 0.00 -1.90 0.02 0.00 0.21 0.00 0.00 66.02 64.35 1f6p s SER 131 CO 0.00 -0.07 1.09 0.20 0.41 0.00 0.00 173.24 174.86 1f6p s ASN 132 N -3.80 5.04 -0.01 2.44 0.01 -1.26 -4.62 114.94 112.74 1f6p s ASN 132 Ca 0.35 1.83 0.03 0.00 -0.71 0.00 0.00 52.86 54.37 1f6p s ASN 132 Cb -0.10 -2.53 -0.01 0.00 0.41 0.00 0.00 41.25 39.03 1f6p s ASN 132 CO 0.30 -1.68 -0.11 -0.32 -1.51 0.00 0.00 177.10 173.78 1f6p s MET 133 N -4.57 0.95 -0.33 -0.60 -2.45 0.58 -1.28 119.30 111.60 1f6p s MET 133 Ca 0.63 -0.40 -0.05 0.00 -1.25 0.00 0.00 55.69 54.61 1f6p s MET 133 Cb -0.17 -0.91 0.04 0.00 1.25 0.00 0.00 34.83 35.04 1f6p s MET 133 CO 0.49 0.23 0.08 0.42 1.05 0.00 0.00 175.02 177.28 1f6p s ILE 134 N -0.20 3.56 0.27 10.11 1.01 0.64 -0.50 121.20 136.10 1f6p s ILE 134 Ca 0.03 -1.21 -0.30 0.00 0.00 0.00 0.00 60.65 59.18 1f6p s ILE 134 Cb -0.05 -3.03 -0.10 0.00 0.01 0.00 0.00 42.46 39.29 1f6p s ILE 134 CO -0.00 -0.16 1.47 0.68 0.00 0.00 0.00 174.94 176.93 1f6p s VAL 135 N 1.36 2.48 -0.38 2.92 -7.23 -0.40 -2.40 120.40 116.75 1f6p s VAL 135 Ca -0.03 0.41 -0.01 0.00 -1.81 0.00 0.00 61.98 60.55 1f6p s VAL 135 Cb -0.20 -3.26 0.10 0.00 0.56 0.00 0.00 36.38 33.58 1f6p s VAL 135 CO 0.02 0.07 0.14 -0.47 -0.31 0.00 0.00 175.10 174.55 1f6p s TYR 136 N -0.17 3.61 -0.09 2.82 5.04 -0.96 0.21 117.35 127.81 1f6p s TYR 136 Ca 0.59 -2.54 -0.13 0.00 -2.44 0.00 0.00 57.07 52.55 1f6p s TYR 136 Cb -0.43 -3.05 -0.05 0.00 0.35 0.00 0.00 41.96 38.78 1f6p s TYR 136 CO 0.47 -0.95 0.32 -1.12 -1.34 0.00 0.00 175.55 172.92 1f6p s SER 137 N 1.52 6.59 -0.48 4.32 0.01 -0.58 -2.69 113.70 122.39 1f6p s SER 137 Ca 0.08 0.69 0.06 0.00 1.31 0.00 0.00 55.95 58.10 1f6p s SER 137 Cb -0.21 -2.19 0.23 0.00 0.21 0.00 0.00 66.02 64.05 1f6p s SER 137 CO -0.05 0.24 0.79 0.00 0.41 0.00 0.00 173.24 174.62 1f6p n ILE 138 N 2.62 -0.13 -0.19 1.44 3.06 -1.26 -1.39 119.36 123.51 1f6p n ILE 138 Ca -0.14 -1.76 0.11 0.00 -2.50 0.00 0.00 62.75 58.46 1f6p n ILE 138 Cb 0.53 0.85 0.42 0.00 0.54 0.00 0.00 39.64 41.98 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 4.30 0.57 -0.06 9.51 0.11 -1.74 0.33 132.00 145.03 1f6p h PRO 139 Ca -0.06 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.97 1f6p h PRO 139 Cb 1.03 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1f6p h PRO 139 CO 0.27 0.38 -0.18 0.35 -0.21 0.00 0.00 178.00 178.62 1f6p h PHE 140 N 0.59 0.10 0.03 0.65 3.57 -1.90 0.35 116.94 120.32 1f6p h PHE 140 Ca 0.36 -0.01 -0.37 0.00 3.53 0.00 0.00 57.97 61.48 1f6p h PHE 140 Cb 0.60 -0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 1f6p h PHE 140 CO -0.00 0.27 -2.13 1.28 -2.23 0.00 0.00 178.31 175.49 1f6p n LEU 141 N -4.29 2.34 0.19 0.59 4.77 -0.56 -4.56 117.00 115.48 1f6p n LEU 141 Ca -0.02 0.21 0.10 0.00 -0.03 0.00 0.00 56.01 56.27 1f6p n LEU 141 Cb 0.27 -0.94 0.12 0.00 -2.33 0.00 0.00 43.42 40.54 1f6p n LEU 141 CO 0.37 0.66 0.67 0.71 -1.33 0.00 0.00 177.39 178.48 1f6p h THR 142 N -0.53 0.21 0.00 -5.08 1.35 -0.99 -3.48 112.91 104.39 1f6p h THR 142 Ca -0.54 -1.30 0.00 0.00 -0.55 0.00 0.00 66.41 64.02 1f6p h THR 142 Cb 1.70 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 1f6p h THR 142 CO -0.19 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 175.81 1f6p n GLY 143 N 1.14 0.76 3.68 5.82 0.00 0.12 -4.65 105.19 112.06 1f6p n GLY 143 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.92 5.05 -0.16 1.61 1.01 -1.26 -5.04 120.40 118.69 1f6p s VAL 144 Ca 0.00 1.22 0.01 0.00 0.00 0.00 0.00 61.98 63.21 1f6p s VAL 144 Cb 0.00 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.45 1f6p s VAL 144 CO 0.00 0.18 -0.19 0.20 0.00 0.00 0.00 175.10 175.29 1f6p s ASN 145 N 1.00 2.97 -0.07 3.32 0.01 -1.26 -4.24 114.94 116.68 1f6p s ASN 145 Ca 0.31 -0.59 -0.02 0.00 -0.71 0.00 0.00 52.86 51.85 1f6p s ASN 145 Cb -0.16 -1.37 -0.04 0.00 0.41 0.00 0.00 41.25 40.09 1f6p s ASN 145 CO 0.12 0.00 0.05 -0.04 -1.51 0.00 0.00 177.10 175.72 1f6p s MET 146 N 1.23 3.07 0.53 -0.60 -1.94 -1.26 -5.11 119.30 115.21 1f6p s MET 146 Ca 0.02 -0.39 0.05 0.00 -1.71 0.00 0.00 55.69 53.66 1f6p s MET 146 Cb -0.14 -2.87 0.04 0.00 2.01 0.00 0.00 34.83 33.88 1f6p s MET 146 CO -0.10 0.70 0.73 0.20 -0.01 0.00 0.00 175.02 176.54 1f6p s GLY 147 N -1.15 1.85 0.25 -0.03 0.00 -1.26 -4.95 107.32 102.03 1f6p s GLY 147 Ca 0.16 -1.64 -0.05 0.00 0.00 0.00 0.00 44.72 43.20 1f6p s GLY 147 CO 0.06 -1.33 1.85 -2.22 0.00 0.00 0.00 173.10 171.46 1f6p h ILE 148 N 0.23 1.03 -0.47 0.90 1.08 -1.99 -2.06 117.51 116.23 1f6p h ILE 148 Ca -0.39 -0.34 -0.01 0.00 -0.39 0.00 0.00 64.86 63.74 1f6p h ILE 148 Cb 1.29 -0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 34.97 1f6p h ILE 148 CO 0.46 0.18 0.26 -0.08 -0.69 0.00 0.00 178.15 178.28 1f6p h GLU 149 N 0.98 0.65 -0.79 2.37 4.81 -1.99 -2.29 114.58 118.33 1f6p h GLU 149 Ca 0.39 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1f6p h GLU 149 Cb 0.20 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 1f6p h GLU 149 CO -0.18 0.51 0.51 1.96 -0.73 0.00 0.00 179.01 181.08 1f6p h GLN 150 N 0.62 1.05 -0.64 1.92 4.20 -1.86 -1.01 115.11 119.39 1f6p h GLN 150 Ca 0.17 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 1f6p h GLN 150 Cb 0.04 -0.23 -0.03 0.00 0.30 0.00 0.00 27.48 27.56 1f6p h GLN 150 CO -0.03 0.71 0.21 0.74 -0.67 0.00 0.00 178.83 179.79 1f6p h PHE 151 N 1.07 1.00 -0.96 2.96 0.04 -1.20 -1.23 116.94 118.63 1f6p h PHE 151 Ca 0.29 -0.08 0.02 0.00 2.80 0.00 0.00 57.97 60.99 1f6p h PHE 151 Cb -0.10 -0.30 -0.05 0.00 2.20 0.00 0.00 35.95 37.70 1f6p h PHE 151 CO -0.01 0.79 0.63 0.78 -0.60 0.00 0.00 178.31 179.90 1f6p h GLY 152 N 1.04 1.36 0.85 -1.45 0.00 -0.64 0.51 103.07 104.75 1f6p h GLY 152 Ca 0.21 -0.49 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 1f6p h GLY 152 CO -0.01 0.46 -0.06 0.83 0.00 0.00 0.00 176.54 177.76 1f6p h GLU 153 N 1.27 0.49 -0.90 4.80 4.39 -0.67 -2.39 114.58 121.58 1f6p h GLU 153 Ca 0.36 -0.19 0.03 0.00 0.34 0.00 0.00 59.36 59.90 1f6p h GLU 153 Cb -0.10 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.47 1f6p h GLU 153 CO -0.09 0.71 0.59 -0.07 -1.16 0.00 0.00 179.01 178.99 1f6p h LEU 154 N 0.24 0.98 0.00 1.33 3.38 -0.49 -1.18 115.31 119.56 1f6p h LEU 154 Ca 0.06 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1f6p h LEU 154 Cb 0.53 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1f6p h LEU 154 CO 0.03 0.68 0.00 -1.22 0.09 0.00 0.00 178.44 178.01 1f6p n TYR 155 N -4.44 0.00 0.16 1.13 4.01 0.10 -1.06 117.16 117.06 1f6p n TYR 155 Ca 0.12 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.90 1f6p n TYR 155 Cb 0.09 -0.46 0.45 0.00 -0.31 0.00 0.00 39.34 39.12 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 0.16 -6.24 -0.72 1.57 -0.68 -3.37 116.57 107.28 1f6p h LYS 156 Ca 0.00 -0.03 -0.56 0.00 -1.87 0.00 0.00 60.65 58.19 1f6p h LYS 156 Cb 0.25 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1f6p h LYS 156 CO 0.00 0.27 0.81 1.21 -0.57 0.00 0.00 179.45 181.18 1f6p s ASN 157 N -6.93 6.97 0.07 0.86 3.84 -0.23 -4.89 114.94 114.64 1f6p s ASN 157 Ca -0.05 1.80 0.21 0.00 0.21 0.00 0.00 52.86 55.02 1f6p s ASN 157 Cb 0.16 -2.55 0.85 0.00 -0.55 0.00 0.00 41.25 39.16 1f6p s ASN 157 CO 0.71 -0.68 1.65 -0.81 -2.79 0.00 0.00 177.10 175.18 1f6p n PRO 158 N 5.90 0.06 0.00 0.43 -0.04 -1.26 -2.26 135.00 137.83 1f6p n PRO 158 Ca 0.13 0.22 0.14 0.00 -0.04 0.00 0.00 63.50 63.94 1f6p n PRO 158 Cb 0.45 -1.60 0.57 0.00 -0.04 0.00 0.00 33.50 32.89 1f6p n PRO 158 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1f6p n LYS 159 N -1.71 0.39 -2.62 0.54 5.02 -1.26 -4.66 118.16 113.87 1f6p n LYS 159 Ca 0.04 -0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.79 1f6p n LYS 159 Cb 0.24 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.73 1f6p n LYS 159 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1f6p s VAL 160 N -2.69 4.20 -0.31 -0.18 1.01 -0.96 -0.31 120.40 121.16 1f6p s VAL 160 Ca 0.22 1.14 0.23 0.00 0.00 0.00 0.00 61.98 63.57 1f6p s VAL 160 Cb 0.19 -4.61 0.11 0.00 0.00 0.00 0.00 36.38 32.07 1f6p s VAL 160 CO 0.52 -1.04 1.23 -0.07 0.00 0.00 0.00 175.10 175.74 1f6p h LEU 161 N 11.27 0.00 0.00 3.92 3.38 -1.06 -3.47 115.31 129.35 1f6p h LEU 161 Ca -0.23 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1f6p h LEU 161 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1f6p h LEU 161 CO 1.13 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.27 1f6p n GLY 162 N 1.16 -0.49 3.05 0.83 0.00 -1.25 -1.61 105.19 106.88 1f6p n GLY 162 Ca 0.01 -1.16 -0.17 0.00 0.00 0.00 0.00 46.02 44.71 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 -3.00 0.69 -0.62 1.61 0.11 -0.61 -1.27 120.40 117.30 1f6p s VAL 163 Ca 0.00 -0.67 -0.20 0.00 -2.93 0.00 0.00 61.98 58.18 1f6p s VAL 163 Cb 0.00 -0.63 0.09 0.00 -1.53 0.00 0.00 36.38 34.31 1f6p s VAL 163 CO 0.00 -0.02 0.81 -0.75 -3.33 0.00 0.00 175.10 171.82 1f6p s LYS 164 N -0.76 3.07 -1.07 1.54 2.20 0.13 -1.64 119.74 123.22 1f6p s LYS 164 Ca -0.01 -1.13 -0.15 0.00 -0.36 0.00 0.00 55.97 54.33 1f6p s LYS 164 Cb -0.06 -4.26 0.17 0.00 -1.51 0.00 0.00 37.83 32.18 1f6p s LYS 164 CO 0.00 -1.66 1.24 0.12 -0.36 0.00 0.00 175.35 174.69 1f6p s PHE 165 N 3.25 3.49 -1.15 4.03 5.36 -0.32 -1.52 117.98 131.11 1f6p s PHE 165 Ca 0.16 -1.94 -0.05 0.00 -0.96 0.00 0.00 56.93 54.14 1f6p s PHE 165 Cb -0.21 -4.21 0.25 0.00 -0.34 0.00 0.00 43.02 38.51 1f6p s PHE 165 CO 0.08 -1.34 1.76 2.41 -1.46 0.00 0.00 175.22 176.66 1f6p n THR 166 N 4.63 5.20 -3.85 0.12 -1.04 -0.49 -1.57 114.28 117.28 1f6p n THR 166 Ca 0.29 -5.34 -0.11 0.00 -2.04 0.00 0.00 64.05 56.84 1f6p n THR 166 Cb 0.45 -2.06 -0.09 0.00 -1.82 0.00 0.00 70.33 66.80 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 -2.00 -0.39 -0.20 2.41 0.00 -1.26 -3.95 121.76 116.36 1f6p s ALA 167 Ca 0.37 -0.13 0.16 0.00 0.00 0.00 0.00 51.96 52.36 1f6p s ALA 167 Cb 0.10 0.16 0.58 0.00 0.00 0.00 0.00 23.12 23.95 1f6p s ALA 167 CO 0.02 -0.26 1.47 0.41 0.00 0.00 0.00 175.76 177.40 1f6p n GLY 168 N 1.18 3.86 3.45 0.00 0.00 -1.26 -4.81 105.19 107.61 1f6p n GLY 168 Ca -0.21 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.74 6.26 0.42 1.61 -1.08 -1.26 -4.83 116.67 116.04 1f6p s ASP 169 Ca 0.44 -1.21 0.27 0.00 -0.52 0.00 0.00 52.55 51.53 1f6p s ASP 169 Cb 0.35 -2.41 0.78 0.00 -1.46 0.00 0.00 42.92 40.18 1f6p s ASP 169 CO 0.10 -1.36 1.76 -0.26 0.52 0.00 0.00 175.17 175.93 1f6p h PHE 170 N 9.42 0.00 -0.00 -5.34 -1.00 -1.99 -1.70 116.94 116.33 1f6p h PHE 170 Ca -0.20 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.58 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 1.00 0.00 -0.01 -0.92 -1.61 0.00 0.00 178.31 176.77 1f6p h TYR 171 N 0.00 0.02 -0.82 -0.55 3.20 -2.00 -2.12 116.97 114.70 1f6p h TYR 171 Ca 0.00 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.93 1f6p h TYR 171 Cb 0.75 -0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.96 1f6p h TYR 171 CO 0.00 0.65 0.49 1.25 -1.64 0.00 0.00 178.16 178.91 1f6p h LEU 172 N -0.61 0.76 -0.03 2.82 5.85 -1.92 -0.66 115.31 121.51 1f6p h LEU 172 Ca -0.00 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1f6p h LEU 172 Cb 0.65 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1f6p h LEU 172 CO 0.00 0.47 -0.08 0.25 -0.34 0.00 0.00 178.44 178.74 1f6p h LEU 173 N 0.88 -0.24 -0.33 2.25 5.85 -1.30 0.33 115.31 122.74 1f6p h LEU 173 Ca 0.37 0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.17 1f6p h LEU 173 Cb 0.22 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 1f6p h LEU 173 CO -0.19 -0.12 0.12 -0.08 -0.34 0.00 0.00 178.44 177.83 1f6p h GLU 174 N -0.13 0.26 -0.84 1.25 4.22 -1.00 -2.66 114.58 115.68 1f6p h GLU 174 Ca 0.04 -0.02 0.01 0.00 0.08 0.00 0.00 59.36 59.48 1f6p h GLU 174 Cb 0.19 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1f6p h GLU 174 CO -0.11 0.17 0.56 0.00 -2.18 0.00 0.00 179.01 177.45 1f6p h ARG 175 N 0.27 1.09 -0.60 1.92 2.47 -0.48 -1.35 114.38 117.70 1f6p h ARG 175 Ca 0.15 -0.07 0.05 0.00 -1.26 0.00 0.00 59.98 58.85 1f6p h ARG 175 Cb 0.11 -0.25 -0.05 0.00 -1.65 0.00 0.00 29.97 28.14 1f6p h ARG 175 CO -0.15 0.72 0.33 -0.07 0.56 0.00 0.00 179.97 181.36 1f6p h LEU 176 N 1.12 0.48 -0.44 3.04 3.38 -0.61 0.35 115.31 122.64 1f6p h LEU 176 Ca 0.31 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.16 1f6p h LEU 176 Cb -0.10 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1f6p h LEU 176 CO -0.07 0.32 -0.35 0.11 0.09 0.00 0.00 178.44 178.54 1f6p h LYS 177 N 0.62 0.93 0.55 1.13 1.79 -1.35 0.32 116.57 120.56 1f6p h LYS 177 Ca 0.27 -0.47 -0.03 0.00 -2.18 0.00 0.00 60.65 58.24 1f6p h LYS 177 Cb 0.15 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1f6p h LYS 177 CO -0.17 1.12 -0.27 -0.22 -1.08 0.00 0.00 179.45 178.84 1f6p h LYS 178 N 0.77 -0.72 -0.16 3.15 1.63 -0.61 -2.86 116.57 117.77 1f6p h LYS 178 Ca 0.07 0.05 -0.15 0.00 -0.85 0.00 0.00 60.65 59.77 1f6p h LYS 178 Cb 0.93 0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.72 1f6p h LYS 178 CO 0.09 -0.42 -0.54 0.00 -3.45 0.00 0.00 179.45 175.12 1f6p h ALA 179 N -0.54 0.76 -2.15 5.00 0.00 -0.32 -3.36 119.26 118.65 1f6p h ALA 179 Ca -0.08 -0.51 -0.58 0.00 0.00 0.00 0.00 54.91 53.75 1f6p h ALA 179 Cb 0.63 -0.09 -0.41 0.00 0.00 0.00 0.00 17.79 17.92 1f6p h ALA 179 CO 0.12 0.69 -0.78 0.66 0.00 0.00 0.00 179.25 179.94 1f6p n TYR 180 N -3.95 2.50 0.24 0.00 4.01 0.11 -4.96 117.16 115.12 1f6p n TYR 180 Ca -0.03 -3.96 0.15 0.00 -0.16 0.00 0.00 57.90 53.91 1f6p n TYR 180 Cb 0.59 -0.48 0.84 0.00 -0.31 0.00 0.00 39.34 39.98 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 3.72 0.00 0.00 -0.72 0.13 -1.66 0.25 132.00 133.71 1f6p h PRO 181 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1f6p h PRO 181 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1f6p h PRO 181 CO 0.72 0.00 -0.28 0.09 -0.23 0.00 0.00 178.00 178.30 1f6p n ASN 182 N -3.94 0.42 -4.80 1.44 3.02 -1.26 -4.86 115.26 105.27 1f6p n ASN 182 Ca -0.01 0.20 -0.37 0.00 -0.03 0.00 0.00 54.58 54.37 1f6p n ASN 182 Cb 0.20 -0.18 -0.06 0.00 -0.61 0.00 0.00 39.78 39.13 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 -3.05 3.74 0.49 3.10 3.76 0.87 -5.05 115.29 119.16 1f6p s HIS 183 Ca 0.11 1.45 -0.13 0.00 -0.15 0.00 0.00 55.06 56.35 1f6p s HIS 183 Cb 0.16 -2.65 -0.06 0.00 1.11 0.00 0.00 32.58 31.14 1f6p s HIS 183 CO 0.63 0.42 0.91 -0.51 -0.85 0.00 0.00 174.74 175.33 1f6p s LEU 184 N -1.64 3.62 -0.06 0.89 1.43 -0.63 -4.97 118.68 117.33 1f6p s LEU 184 Ca 0.39 1.35 -0.01 0.00 -1.03 0.00 0.00 54.13 54.83 1f6p s LEU 184 Cb -0.19 -4.29 0.03 0.00 0.03 0.00 0.00 46.19 41.77 1f6p s LEU 184 CO 0.22 -0.57 0.02 -0.63 0.23 0.00 0.00 176.35 175.62 1f6p s ILE 185 N -2.65 0.22 -0.25 -0.59 1.01 -1.26 -1.58 121.20 116.11 1f6p s ILE 185 Ca 0.55 0.20 -0.07 0.00 0.00 0.00 0.00 60.65 61.33 1f6p s ILE 185 Cb -0.10 -0.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.94 1f6p s ILE 185 CO 0.36 0.23 0.06 0.26 0.00 0.00 0.00 174.94 175.85 1f6p s TRP 186 N 1.93 3.08 0.36 3.97 0.51 -0.65 -0.41 118.94 127.73 1f6p s TRP 186 Ca 0.03 -0.45 -0.28 0.00 -2.12 0.00 0.00 56.10 53.28 1f6p s TRP 186 Cb -0.12 -2.23 -0.10 0.00 -0.81 0.00 0.00 33.47 30.20 1f6p s TRP 186 CO -0.04 -0.37 1.37 0.00 -0.51 0.00 0.00 176.95 177.39 1f6p s ALA 187 N 1.61 3.47 -0.78 0.98 0.00 -0.25 -1.17 121.76 125.61 1f6p s ALA 187 Ca 0.06 1.36 0.07 0.00 0.00 0.00 0.00 51.96 53.45 1f6p s ALA 187 Cb -0.15 -3.52 0.04 0.00 0.00 0.00 0.00 23.12 19.49 1f6p s ALA 187 CO 0.03 -0.82 0.67 0.41 0.00 0.00 0.00 175.76 176.06 1f6p n GLY 188 N 0.66 -0.71 3.28 0.00 0.00 -0.61 -1.22 105.19 106.59 1f6p n GLY 188 Ca 0.01 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.63 3.32 0.50 1.61 0.08 -1.26 -4.78 117.98 116.81 1f6p s PHE 189 Ca 0.07 -1.45 0.17 0.00 0.12 0.00 0.00 56.93 55.84 1f6p s PHE 189 Cb 0.05 -2.78 1.23 0.00 -0.57 0.00 0.00 43.02 40.95 1f6p s PHE 189 CO 0.09 -0.80 2.09 -0.44 -0.10 0.00 0.00 175.22 176.06 1f6p h ASP 190 N 8.37 0.09 0.74 1.36 5.19 -1.90 -0.37 116.42 129.90 1f6p h ASP 190 Ca -0.23 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.18 1f6p h ASP 190 Cb 1.08 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.57 1f6p h ASP 190 CO 0.72 0.06 0.00 -1.84 -3.12 0.00 0.00 179.24 175.06 1f6p n GLU 191 N -4.49 0.18 -0.40 3.56 0.00 -1.26 -3.08 120.64 115.15 1f6p n GLU 191 Ca 0.02 0.04 0.07 0.00 0.00 0.00 0.00 57.16 57.28 1f6p n GLU 191 Cb 0.22 -1.50 0.18 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 -1.40 1.51 0.03 3.44 2.81 -0.16 -4.83 117.12 118.52 1f6p n MET 192 Ca 0.09 -3.01 -0.10 0.00 -1.81 0.00 0.00 57.70 52.87 1f6p n MET 192 Cb 0.27 -1.59 -0.04 0.00 -0.71 0.00 0.00 33.22 31.15 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 0.63 -0.16 0.31 0.03 4.05 -1.45 -2.27 114.93 116.06 1f6p h MET 193 Ca 0.01 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1f6p h MET 193 Cb 1.04 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.86 1f6p h MET 193 CO 0.02 -0.11 -0.35 1.25 0.23 0.00 0.00 176.91 177.95 1f6p h LEU 194 N -0.17 -0.98 -1.30 3.39 5.85 -1.88 0.43 115.31 120.66 1f6p h LEU 194 Ca 0.06 0.08 0.25 0.00 0.84 0.00 0.00 57.88 59.11 1f6p h LEU 194 Cb 0.25 0.33 -0.10 0.00 0.37 0.00 0.00 40.66 41.51 1f6p h LEU 194 CO -0.15 -0.45 0.65 1.55 -0.34 0.00 0.00 178.44 179.70 1f6p h PRO 195 N -0.67 0.44 -0.32 5.25 0.13 -1.95 -0.45 132.00 134.44 1f6p h PRO 195 Ca -0.04 -0.03 -0.18 0.00 -0.87 0.00 0.00 66.00 64.89 1f6p h PRO 195 Cb 0.59 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.62 1f6p h PRO 195 CO -0.07 0.29 -0.50 0.00 -0.23 0.00 0.00 178.00 177.49 1f6p h ALA 196 N 1.63 0.50 0.00 -0.56 0.00 -0.64 -2.58 119.26 117.62 1f6p h ALA 196 Ca 0.59 -0.50 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1f6p h ALA 196 Cb 1.39 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1f6p h ALA 196 CO -0.32 0.68 -0.14 0.00 0.00 0.00 0.00 179.25 179.48 1f6p h ALA 197 N 0.71 1.07 0.00 0.00 0.00 0.65 -2.55 119.26 119.14 1f6p h ALA 197 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1f6p h ALA 197 Cb 1.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1f6p h ALA 197 CO 0.12 0.17 0.00 0.66 0.00 0.00 0.00 179.25 180.20 1f6p h SER 198 N 0.00 0.00 -0.42 0.00 4.64 -0.70 -2.66 113.55 114.42 1f6p h SER 198 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1f6p h SER 198 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1f6p h SER 198 CO 0.02 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.16 1f6p n LEU 199 N -2.78 2.76 0.00 5.97 4.77 -0.97 -4.94 117.00 121.80 1f6p n LEU 199 Ca 0.04 -1.39 0.00 0.00 -0.03 0.00 0.00 56.01 54.64 1f6p n LEU 199 Cb 0.48 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1f6p n LEU 199 CO 0.32 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 1f6p n GLY 200 N 0.98 0.44 3.67 -0.72 0.00 -1.00 -4.91 105.19 103.65 1f6p n GLY 200 Ca 0.15 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 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 -3.33 2.21 1.13 1.61 0.24 -1.13 -4.91 118.33 114.14 1f6p n VAL 201 Ca 0.00 -0.24 0.12 0.00 -2.04 0.00 0.00 64.34 62.18 1f6p n VAL 201 Cb 0.21 -1.18 0.22 0.00 -1.47 0.00 0.00 33.84 31.62 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 -2.93 1.20 0.00 -1.34 8.00 0.45 -4.90 116.55 117.04 1f6p n ASP 202 Ca 0.13 -0.96 0.00 0.00 0.71 0.00 0.00 54.79 54.67 1f6p n ASP 202 Cb 0.50 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.91 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 1.40 -1.32 3.18 0.44 0.00 -1.19 -1.65 105.19 106.05 1f6p n GLY 203 Ca 0.10 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.02 -0.69 -0.25 4.61 0.00 -0.65 -1.09 121.76 122.67 1f6p s ALA 204 Ca 0.00 0.61 0.01 0.00 0.00 0.00 0.00 51.96 52.58 1f6p s ALA 204 Cb 0.00 -0.29 0.05 0.00 0.00 0.00 0.00 23.12 22.88 1f6p s ALA 204 CO 0.00 -0.17 -0.10 0.42 0.00 0.00 0.00 175.76 175.91 1f6p s ILE 205 N -0.34 2.41 0.03 0.00 1.01 -0.35 -0.83 121.20 123.13 1f6p s ILE 205 Ca -0.05 -1.41 0.01 0.00 0.00 0.00 0.00 60.65 59.21 1f6p s ILE 205 Cb -0.03 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 1f6p s ILE 205 CO 0.01 0.07 -0.06 -0.83 0.00 0.00 0.00 174.94 174.13 1f6p s GLY 206 N 1.19 0.40 0.20 6.18 0.00 -0.21 -4.40 107.32 110.68 1f6p s GLY 206 Ca -0.05 -0.70 0.11 0.00 0.00 0.00 0.00 44.72 44.08 1f6p s GLY 206 CO -0.05 -0.76 1.38 1.48 0.00 0.00 0.00 173.10 175.15 1f6p h SER 207 N 4.56 0.00 0.45 1.64 4.64 -1.88 0.39 113.55 123.34 1f6p h SER 207 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1f6p h SER 207 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1f6p h SER 207 CO 0.41 0.77 -0.13 0.35 -0.87 0.00 0.00 176.83 177.36 1f6p n THR 208 N -3.34 0.00 0.35 2.95 -2.24 -1.26 -3.22 114.28 107.52 1f6p n THR 208 Ca 0.01 -0.05 0.14 0.00 -2.27 0.00 0.00 64.05 61.88 1f6p n THR 208 Cb 0.83 -0.12 0.54 0.00 -2.10 0.00 0.00 70.33 69.48 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 0.44 0.00 -0.30 4.78 0.04 -1.87 0.29 116.94 120.32 1f6p h PHE 209 Ca 0.00 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.81 1f6p h PHE 209 Cb 0.38 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 1f6p h PHE 209 CO 0.00 0.00 0.20 -0.91 -0.60 0.00 0.00 178.31 177.00 1f6p h ASN 210 N 0.00 0.22 0.00 2.17 2.35 -1.77 -2.84 115.58 115.70 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 0.52 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1f6p h ASN 210 CO 0.00 0.15 -0.93 1.33 -1.65 0.00 0.00 177.43 176.33 1f6p n VAL 211 N -4.49 0.00 -1.35 2.81 0.24 -0.62 -4.80 118.33 110.12 1f6p n VAL 211 Ca 0.03 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.30 1f6p n VAL 211 Cb 0.19 -0.23 0.21 0.00 -1.47 0.00 0.00 33.84 32.54 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 -1.64 2.82 -0.34 -1.34 5.15 0.94 -4.78 115.26 116.07 1f6p n ASN 212 Ca 0.00 -3.62 0.13 0.00 -0.60 0.00 0.00 54.58 50.49 1f6p n ASN 212 Cb 0.23 -0.63 0.34 0.00 -0.53 0.00 0.00 39.78 39.19 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 1.15 1.64 0.84 8.20 0.00 -1.69 -1.75 103.07 111.45 1f6p h GLY 213 Ca 0.21 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 1f6p h GLY 213 CO 0.41 -0.03 -0.03 -2.08 0.00 0.00 0.00 176.54 174.80 1f6p h VAL 214 N 0.74 1.05 -0.07 4.60 2.07 -1.87 -1.57 116.25 121.19 1f6p h VAL 214 Ca 0.56 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.71 1f6p h VAL 214 Cb 0.90 1.29 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1f6p h VAL 214 CO -0.34 0.09 0.03 0.03 0.02 0.00 0.00 177.57 177.40 1f6p h ARG 215 N -0.25 0.10 -0.65 1.57 3.08 -1.91 -1.30 114.38 115.03 1f6p h ARG 215 Ca -0.01 -0.02 0.13 0.00 0.07 0.00 0.00 59.98 60.15 1f6p h ARG 215 Cb 0.22 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 30.16 1f6p h ARG 215 CO 0.01 0.22 0.14 0.00 -1.07 0.00 0.00 179.97 179.28 1f6p h ALA 216 N 0.88 0.79 -0.52 0.04 0.00 -1.28 0.16 119.26 119.33 1f6p h ALA 216 Ca 0.02 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1f6p h ALA 216 Cb 0.16 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1f6p h ALA 216 CO -0.00 -0.31 0.25 -0.09 0.00 0.00 0.00 179.25 179.10 1f6p h ARG 217 N 0.26 0.74 -0.31 0.00 2.43 -1.18 -2.32 114.38 114.00 1f6p h ARG 217 Ca 0.35 -0.11 0.05 0.00 -0.81 0.00 0.00 59.98 59.46 1f6p h ARG 217 Cb 0.55 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.92 1f6p h ARG 217 CO -0.45 0.61 0.04 1.96 -1.51 0.00 0.00 179.97 180.62 1f6p h GLN 218 N 0.69 0.13 -0.23 0.20 4.20 0.05 0.29 115.11 120.44 1f6p h GLN 218 Ca 0.18 -0.01 0.05 0.00 0.06 0.00 0.00 58.65 58.93 1f6p h GLN 218 Cb 0.11 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.81 1f6p h GLN 218 CO -0.02 0.09 -0.07 0.82 -0.67 0.00 0.00 178.83 178.98 1f6p h ILE 219 N 0.14 0.75 0.13 2.54 2.04 -0.47 -0.19 117.51 122.45 1f6p h ILE 219 Ca 0.15 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.02 1f6p h ILE 219 Cb 0.17 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1f6p h ILE 219 CO -0.21 0.00 -0.26 0.15 0.00 0.00 0.00 178.15 177.82 1f6p h PHE 220 N -0.01 -0.71 -0.18 1.37 3.57 -1.19 0.12 116.94 119.92 1f6p h PHE 220 Ca 0.11 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.46 1f6p h PHE 220 Cb 0.18 0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 1f6p h PHE 220 CO -0.25 -0.37 -0.59 0.93 -2.23 0.00 0.00 178.31 175.80 1f6p h GLU 221 N -0.48 0.58 -0.27 1.11 5.08 -0.81 -0.55 114.58 119.24 1f6p h GLU 221 Ca 0.03 -0.39 -0.09 0.00 -1.00 0.00 0.00 59.36 57.91 1f6p h GLU 221 Cb 0.50 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1f6p h GLU 221 CO -0.14 1.00 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.63 1f6p h LEU 222 N 0.43 0.63 0.06 1.33 3.38 -0.84 -2.17 115.31 118.13 1f6p h LEU 222 Ca -0.00 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.55 1f6p h LEU 222 Cb 1.15 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1f6p h LEU 222 CO 0.11 0.92 -0.11 0.74 0.09 0.00 0.00 178.44 180.20 1f6p h THR 223 N 0.33 0.75 -0.45 0.22 2.02 -0.58 -1.29 112.91 113.90 1f6p h THR 223 Ca 0.06 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.34 1f6p h THR 223 Cb 0.71 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 1f6p h THR 223 CO 0.05 0.00 0.32 0.11 0.37 0.00 0.00 175.52 176.37 1f6p h LYS 224 N -0.21 0.13 -0.00 6.66 1.79 -1.03 -0.12 116.57 123.78 1f6p h LYS 224 Ca 0.02 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1f6p h LYS 224 Cb 0.23 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1f6p h LYS 224 CO -0.06 0.09 -0.01 0.00 -1.08 0.00 0.00 179.45 178.39 1f6p n ALA 225 N -2.58 2.64 -0.91 3.86 0.00 -0.82 -4.93 120.51 117.76 1f6p n ALA 225 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1f6p n ALA 225 Cb 0.43 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.40 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 1.09 0.72 2.45 0.00 0.00 -0.06 -4.94 105.19 104.46 1f6p n GLY 226 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.51 4.35 -0.04 1.61 5.02 -0.54 -4.76 118.16 121.29 1f6p n LYS 227 Ca 0.00 -3.16 -0.09 0.00 -2.02 0.00 0.00 58.31 53.04 1f6p n LYS 227 Cb 0.00 -2.69 -0.03 0.00 -0.02 0.00 0.00 35.03 32.30 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 6.02 -0.01 -0.85 -0.35 3.38 -1.88 -1.84 115.31 119.78 1f6p h LEU 228 Ca 0.74 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.76 1f6p h LEU 228 Cb 0.31 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 1f6p h LEU 228 CO 1.56 0.03 0.55 0.11 0.09 0.00 0.00 178.44 180.78 1f6p h LYS 229 N 0.11 1.07 -0.33 1.13 1.57 -1.98 -1.52 116.57 116.62 1f6p h LYS 229 Ca 0.09 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.67 1f6p h LYS 229 Cb 0.09 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 1f6p h LYS 229 CO -0.13 0.71 -0.35 1.49 -0.57 0.00 0.00 179.45 180.60 1f6p h GLU 230 N 1.10 0.75 -0.51 3.15 4.81 -1.93 -3.06 114.58 118.90 1f6p h GLU 230 Ca 0.33 -0.37 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1f6p h GLU 230 Cb -0.06 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1f6p h GLU 230 CO -0.09 0.99 0.26 0.00 -0.73 0.00 0.00 179.01 179.43 1f6p h ALA 231 N 0.98 0.65 -0.85 2.92 0.00 -1.02 -3.02 119.26 118.92 1f6p h ALA 231 Ca 0.06 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1f6p h ALA 231 Cb 0.89 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1f6p h ALA 231 CO 0.08 0.20 0.56 1.25 0.00 0.00 0.00 179.25 181.34 1f6p h LEU 232 N 0.68 0.85 0.08 0.00 5.85 -1.19 0.23 115.31 121.81 1f6p h LEU 232 Ca 0.18 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1f6p h LEU 232 Cb 0.10 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1f6p h LEU 232 CO -0.02 0.56 -0.04 -0.33 -0.34 0.00 0.00 178.44 178.26 1f6p h GLU 233 N 0.97 -0.11 -0.59 1.25 4.39 -1.46 0.32 114.58 119.36 1f6p h GLU 233 Ca 0.36 0.01 -0.07 0.00 0.34 0.00 0.00 59.36 60.00 1f6p h GLU 233 Cb 0.18 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 1f6p h GLU 233 CO -0.13 0.07 0.11 0.82 -1.16 0.00 0.00 179.01 178.73 1f6p h ILE 234 N -0.27 1.26 -0.65 3.13 2.04 -1.35 0.91 117.51 122.58 1f6p h ILE 234 Ca -0.01 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.87 1f6p h ILE 234 Cb 0.23 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1f6p h ILE 234 CO 0.02 0.36 0.35 -0.61 0.00 0.00 0.00 178.15 178.26 1f6p h GLN 235 N 0.87 0.90 0.09 2.37 5.75 -0.20 0.34 115.11 125.24 1f6p h GLN 235 Ca 0.18 -0.10 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1f6p h GLN 235 Cb 0.40 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.75 1f6p h GLN 235 CO 0.01 0.67 -0.15 0.45 -2.65 0.00 0.00 178.83 177.16 1f6p h HIS 236 N 0.91 -0.38 -0.62 3.99 3.86 0.60 0.32 115.15 123.84 1f6p h HIS 236 Ca 0.23 0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.38 1f6p h HIS 236 Cb 0.03 0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.63 1f6p h HIS 236 CO 0.01 -0.22 0.12 0.28 0.86 0.00 0.00 177.93 178.97 1f6p h VAL 237 N -0.29 1.26 -0.62 2.45 2.07 -0.51 -1.18 116.25 119.42 1f6p h VAL 237 Ca 0.02 -0.98 0.07 0.00 0.82 0.00 0.00 66.70 66.63 1f6p h VAL 237 Cb 0.30 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1f6p h VAL 237 CO -0.08 0.36 0.32 0.74 0.02 0.00 0.00 177.57 178.93 1f6p h THR 238 N 0.92 0.91 0.00 2.57 2.02 0.11 -2.19 112.91 117.25 1f6p h THR 238 Ca 0.19 -0.20 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 1f6p h THR 238 Cb 0.40 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 1f6p h THR 238 CO 0.01 0.11 -0.28 0.78 0.37 0.00 0.00 175.52 176.50 1f6p h ASN 239 N 0.58 0.00 -0.12 4.18 4.21 -0.01 0.22 115.58 124.64 1f6p h ASN 239 Ca 0.29 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.61 1f6p h ASN 239 Cb 0.23 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.43 1f6p h ASN 239 CO -0.21 0.28 -0.60 0.44 -1.29 0.00 0.00 177.43 176.05 1f6p h ASP 240 N 0.00 0.82 -0.24 5.81 3.32 -0.73 0.75 116.42 126.14 1f6p h ASP 240 Ca -0.00 -0.46 -0.08 0.00 0.02 0.00 0.00 57.03 56.51 1f6p h ASP 240 Cb 0.75 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.05 1f6p h ASP 240 CO 0.04 1.23 -0.17 0.25 -1.72 0.00 0.00 179.24 178.86 1f6p h LEU 241 N 0.54 0.56 -0.02 1.55 5.85 -0.65 -2.38 115.31 120.76 1f6p h LEU 241 Ca -0.00 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.30 1f6p h LEU 241 Cb 1.19 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 1f6p h LEU 241 CO 0.12 0.88 -0.13 0.40 -0.34 0.00 0.00 178.44 179.38 1f6p h ILE 242 N 0.24 0.67 -0.40 4.05 2.04 -0.57 0.18 117.51 123.72 1f6p h ILE 242 Ca 0.05 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.98 1f6p h ILE 242 Cb 0.70 0.67 -0.07 0.00 -0.74 0.00 0.00 36.82 37.38 1f6p h ILE 242 CO 0.05 0.00 -0.04 -0.08 0.00 0.00 0.00 178.15 178.07 1f6p h GLU 243 N -0.21 0.06 -0.90 2.37 4.81 -0.88 0.42 114.58 120.24 1f6p h GLU 243 Ca 0.05 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1f6p h GLU 243 Cb 0.28 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 1f6p h GLU 243 CO -0.14 0.04 0.59 0.78 -0.73 0.00 0.00 179.01 179.54 1f6p h GLY 244 N 0.06 1.27 0.99 1.92 0.00 -0.77 -1.65 103.07 104.89 1f6p h GLY 244 Ca 0.19 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1f6p h GLY 244 CO -0.36 0.47 0.31 -2.22 0.00 0.00 0.00 176.54 174.73 1f6p h ILE 245 N 1.22 1.20 -0.25 2.60 2.04 0.56 -1.95 117.51 122.93 1f6p h ILE 245 Ca 0.33 -0.54 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 1f6p h ILE 245 Cb -0.14 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 1f6p h ILE 245 CO -0.07 0.22 -0.08 -0.07 0.00 0.00 0.00 178.15 178.15 1f6p h LEU 246 N 0.81 0.51 -1.07 1.44 3.38 0.22 -2.14 115.31 118.45 1f6p h LEU 246 Ca 0.21 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1f6p h LEU 246 Cb 0.08 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1f6p h LEU 246 CO -0.03 0.77 0.33 0.00 0.09 0.00 0.00 178.44 179.60 1f6p h ALA 247 N 0.75 1.28 0.00 1.53 0.00 -1.29 -2.69 119.26 118.83 1f6p h ALA 247 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1f6p h ALA 247 Cb 0.56 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1f6p h ALA 247 CO 0.03 0.56 -0.23 -1.71 0.00 0.00 0.00 179.25 177.90 1f6p n ASN 248 N -4.33 0.24 0.00 0.00 4.05 -0.74 -4.99 115.26 109.49 1f6p n ASN 248 Ca 0.06 0.17 0.00 0.00 0.45 0.00 0.00 54.58 55.27 1f6p n ASN 248 Cb 0.14 -0.17 0.00 0.00 1.23 0.00 0.00 39.78 40.98 1f6p n ASN 248 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1f6p n GLY 249 N 1.49 1.33 0.40 8.20 0.00 -0.83 -4.70 105.19 111.09 1f6p n GLY 249 Ca 0.06 -0.83 -0.13 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.56 -0.14 0.99 5.85 -1.68 0.89 115.31 119.66 1f6p h LEU 250 Ca 0.00 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 1f6p h LEU 250 Cb 0.00 0.62 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 1f6p h LEU 250 CO 0.00 -0.39 0.02 1.88 -0.34 0.00 0.00 178.44 179.61 1f6p h TYR 251 N -0.44 0.25 -0.62 1.25 -1.99 -1.96 -1.93 116.97 111.54 1f6p h TYR 251 Ca 0.04 -0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 1f6p h TYR 251 Cb 0.56 -0.07 -0.03 0.00 2.00 0.00 0.00 36.73 39.19 1f6p h TYR 251 CO -0.63 0.42 0.25 -0.07 -0.00 0.00 0.00 178.16 178.13 1f6p h LEU 252 N 0.01 0.85 -0.59 3.88 3.38 -1.92 -1.27 115.31 119.66 1f6p h LEU 252 Ca 0.04 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1f6p h LEU 252 Cb 0.31 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1f6p h LEU 252 CO 0.00 0.79 0.06 0.74 0.09 0.00 0.00 178.44 180.13 1f6p h THR 253 N 0.86 1.26 -0.68 0.22 2.02 -0.73 0.69 112.91 116.55 1f6p h THR 253 Ca 0.21 -1.04 -0.06 0.00 0.77 0.00 0.00 66.41 66.28 1f6p h THR 253 Cb 0.20 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1f6p h THR 253 CO -0.02 0.38 0.19 0.40 0.37 0.00 0.00 175.52 176.85 1f6p h ILE 254 N 0.89 1.26 -0.57 3.11 2.04 -1.28 -0.95 117.51 122.00 1f6p h ILE 254 Ca 0.17 -0.91 -0.06 0.00 1.00 0.00 0.00 64.86 65.06 1f6p h ILE 254 Cb 0.47 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1f6p h ILE 254 CO 0.02 0.35 0.12 0.11 0.00 0.00 0.00 178.15 178.75 1f6p h LYS 255 N 1.01 0.93 -0.58 2.37 1.57 -0.54 -1.94 116.57 119.39 1f6p h LYS 255 Ca 0.22 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1f6p h LYS 255 Cb 0.33 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1f6p h LYS 255 CO -0.00 0.87 0.12 0.93 -0.57 0.00 0.00 179.45 180.80 1f6p h GLU 256 N 0.83 0.90 -0.69 3.15 4.39 -0.72 -1.54 114.58 120.90 1f6p h GLU 256 Ca 0.18 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 1f6p h GLU 256 Cb 0.38 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 1f6p h GLU 256 CO 0.01 0.82 0.37 -0.07 -1.16 0.00 0.00 179.01 178.97 1f6p h LEU 257 N 0.86 0.87 -0.66 1.33 3.38 -0.94 -1.97 115.31 118.18 1f6p h LEU 257 Ca 0.18 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1f6p h LEU 257 Cb 0.34 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1f6p h LEU 257 CO 0.00 0.72 0.29 -0.07 0.09 0.00 0.00 178.44 179.48 1f6p h LEU 258 N 0.95 0.89 -1.32 1.67 3.38 -1.02 -2.39 115.31 117.47 1f6p h LEU 258 Ca 0.24 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1f6p h LEU 258 Cb 0.06 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 1f6p h LEU 258 CO -0.04 0.80 0.48 0.11 0.09 0.00 0.00 178.44 179.88 1f6p h LYS 259 N 0.93 0.86 0.00 1.13 1.57 -0.81 0.59 116.57 120.83 1f6p h LYS 259 Ca 0.23 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1f6p h LYS 259 Cb 0.16 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1f6p h LYS 259 CO -0.02 0.57 0.00 1.28 -0.57 0.00 0.00 179.45 180.70 1f6p n LEU 260 N -4.45 0.00 -1.18 2.94 4.77 -0.78 -0.44 117.00 117.85 1f6p n LEU 260 Ca 0.09 0.49 0.12 0.00 -0.03 0.00 0.00 56.01 56.67 1f6p n LEU 260 Cb 0.12 -0.49 0.23 0.00 -2.33 0.00 0.00 43.42 40.96 1f6p n LEU 260 CO 0.35 -0.28 0.71 -0.62 -1.33 0.00 0.00 177.39 176.22 1f6p n GLU 261 N -1.49 2.54 -1.01 3.23 -0.58 0.20 -4.94 120.64 118.59 1f6p n GLU 261 Ca 0.03 -2.36 -0.00 0.00 -0.42 0.00 0.00 57.16 54.41 1f6p n GLU 261 Cb 0.14 -1.52 -0.00 0.00 -0.57 0.00 0.00 31.44 29.49 1f6p n GLU 261 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1f6p n GLY 262 N 1.50 0.45 3.69 0.62 0.00 0.41 -5.03 105.19 106.83 1f6p n GLY 262 Ca 0.20 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 45.16 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 5.25 -1.31 1.61 1.01 -0.64 -4.98 120.40 119.32 1f6p s VAL 263 Ca 0.00 0.62 -0.17 0.00 0.00 0.00 0.00 61.98 62.43 1f6p s VAL 263 Cb 0.00 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.72 1f6p s VAL 263 CO 0.00 0.30 1.99 -0.67 0.00 0.00 0.00 175.10 176.73 1f6p n ASP 264 N 4.17 4.08 0.00 3.32 2.03 -1.26 -3.02 116.55 125.86 1f6p n ASP 264 Ca -0.10 -2.84 0.11 0.00 0.52 0.00 0.00 54.79 52.47 1f6p n ASP 264 Cb 0.51 -1.65 0.53 0.00 -0.72 0.00 0.00 41.12 39.80 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 7.73 2.10 -0.75 -1.67 0.00 -1.26 -4.33 120.51 122.33 1f6p n ALA 265 Ca 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1f6p n ALA 265 Cb 0.42 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.65 1.63 4.02 0.00 0.00 -1.26 -4.11 105.19 106.12 1f6p n GLY 266 Ca 0.09 -0.50 -0.19 0.00 0.00 0.00 0.00 46.02 45.42 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 1.92 0.48 1.61 1.51 0.04 -4.80 117.35 118.11 1f6p s TYR 267 Ca 0.00 -0.54 -0.01 0.00 -1.01 0.00 0.00 57.07 55.52 1f6p s TYR 267 Cb 0.00 -2.38 0.00 0.00 -0.11 0.00 0.00 41.96 39.47 1f6p s TYR 267 CO 0.00 -0.99 0.71 0.00 -1.11 0.00 0.00 175.55 174.17 1f6p s ARG 269 N -4.64 4.23 0.20 0.00 6.06 -1.26 -4.28 118.95 119.26 1f6p s ARG 269 Ca 0.50 0.38 -0.32 0.00 -2.50 0.00 0.00 55.73 53.79 1f6p s ARG 269 Cb -0.10 -3.52 -0.11 0.00 0.06 0.00 0.00 34.95 31.27 1f6p s ARG 269 CO 0.39 -0.04 1.68 -1.21 -2.50 0.00 0.00 175.30 173.62 1f6p s GLU 270 N 1.29 4.15 0.00 5.12 2.02 -1.26 -2.41 118.70 127.61 1f6p s GLU 270 Ca 0.23 2.55 0.12 0.00 0.02 0.00 0.00 54.97 57.89 1f6p s GLU 270 Cb -0.15 -3.09 0.15 0.00 0.10 0.00 0.00 34.13 31.14 1f6p s GLU 270 CO 0.09 -0.71 0.97 -0.35 0.02 0.00 0.00 175.26 175.28 1f6p n PRO 271 N 3.90 1.16 -2.61 0.39 -0.04 -1.26 -5.04 135.00 131.51 1f6p n PRO 271 Ca 0.15 -1.41 -0.40 0.00 -0.04 0.00 0.00 63.50 61.81 1f6p n PRO 271 Cb 0.36 -1.24 -0.05 0.00 -0.04 0.00 0.00 33.50 32.53 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 -0.98 4.67 -0.14 0.54 -1.94 -1.01 -4.98 119.30 115.46 1f6p s MET 272 Ca 0.16 1.63 -0.35 0.00 -1.71 0.00 0.00 55.69 55.42 1f6p s MET 272 Cb 0.10 -3.13 -0.12 0.00 2.01 0.00 0.00 34.83 33.69 1f6p s MET 272 CO 0.15 0.30 1.89 2.41 -0.01 0.00 0.00 175.02 179.76 1f6p n THR 273 N 1.13 0.52 0.09 2.05 -1.04 -1.26 -4.52 114.28 111.25 1f6p n THR 273 Ca -0.01 -0.11 -0.04 0.00 -2.04 0.00 0.00 64.05 61.85 1f6p n THR 273 Cb 0.46 -1.79 0.00 0.00 -1.82 0.00 0.00 70.33 67.19 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 9.24 0.00 -4.32 8.00 4.64 -1.89 -3.40 113.55 125.82 1f6p h SER 274 Ca -0.47 0.00 -0.69 0.00 -0.47 0.00 0.00 61.79 60.16 1f6p h SER 274 Cb 1.28 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.10 1f6p h SER 274 CO 0.96 0.82 -0.85 -0.54 -0.87 0.00 0.00 176.83 176.34 1f6p s LYS 275 N -3.06 2.09 0.40 4.77 1.02 -1.26 -0.94 119.74 122.75 1f6p s LYS 275 Ca 0.00 -0.95 -0.24 0.00 0.02 0.00 0.00 55.97 54.80 1f6p s LYS 275 Cb 0.11 -2.11 -0.09 0.00 -0.52 0.00 0.00 37.83 35.22 1f6p s LYS 275 CO 0.79 0.56 1.07 0.00 -0.92 0.00 0.00 175.35 176.84 1f6p s ALA 276 N -0.74 3.10 0.95 5.17 0.00 -1.26 -5.05 121.76 123.93 1f6p s ALA 276 Ca 0.11 0.74 -0.14 0.00 0.00 0.00 0.00 51.96 52.68 1f6p s ALA 276 Cb -0.10 -3.29 0.16 0.00 0.00 0.00 0.00 23.12 19.89 1f6p s ALA 276 CO 0.01 -0.26 1.17 0.95 0.00 0.00 0.00 175.76 177.63 1f6p s THR 277 N -1.61 1.95 0.17 0.00 -4.23 -1.26 -4.85 115.64 105.81 1f6p s THR 277 Ca 0.58 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.94 1f6p s THR 277 Cb -0.23 -2.79 0.05 0.00 1.34 0.00 0.00 72.50 70.87 1f6p s THR 277 CO 0.29 0.00 1.83 0.00 -0.54 0.00 0.00 174.62 176.20 1f6p h ALA 278 N -1.61 0.63 -0.59 3.99 0.00 -1.99 -1.18 119.26 118.52 1f6p h ALA 278 Ca -0.48 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.43 1f6p h ALA 278 Cb 1.31 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1f6p h ALA 278 CO 0.54 0.07 0.35 0.93 0.00 0.00 0.00 179.25 181.14 1f6p h GLU 279 N 0.67 0.66 -0.63 0.00 3.07 -1.99 0.28 114.58 116.64 1f6p h GLU 279 Ca 0.18 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 58.94 1f6p h GLU 279 Cb -0.07 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 27.67 1f6p h GLU 279 CO -0.04 0.44 0.13 1.96 -1.40 0.00 0.00 179.01 180.09 1f6p h GLN 280 N 0.68 1.02 -0.63 2.33 4.20 -1.63 -0.50 115.11 120.59 1f6p h GLN 280 Ca 0.24 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1f6p h GLN 280 Cb 0.05 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 1f6p h GLN 280 CO -0.11 0.94 0.24 0.28 -0.67 0.00 0.00 178.83 179.51 1f6p h VAL 281 N 0.94 1.24 -0.21 -0.54 2.07 -0.87 -1.07 116.25 117.80 1f6p h VAL 281 Ca 0.19 -0.75 -0.14 0.00 0.82 0.00 0.00 66.70 66.83 1f6p h VAL 281 Cb 0.39 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1f6p h VAL 281 CO 0.01 0.29 -0.45 0.00 0.02 0.00 0.00 177.57 177.44 1f6p h ALA 282 N 1.10 0.82 -0.41 1.67 0.00 -0.01 -1.71 119.26 120.72 1f6p h ALA 282 Ca 0.21 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 1f6p h ALA 282 Cb 0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1f6p h ALA 282 CO -0.02 0.66 -0.20 -0.22 0.00 0.00 0.00 179.25 179.47 1f6p h LYS 283 N 0.43 0.81 -0.41 0.00 3.64 -0.89 -0.45 116.57 119.71 1f6p h LYS 283 Ca 0.03 -0.32 -0.03 0.00 -1.27 0.00 0.00 60.65 59.06 1f6p h LYS 283 Cb 0.95 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.71 1f6p h LYS 283 CO 0.08 0.95 0.14 0.00 -2.27 0.00 0.00 179.45 178.35 1f6p h ALA 284 N 1.06 0.54 -0.66 5.00 0.00 -0.92 -0.87 119.26 123.40 1f6p h ALA 284 Ca 0.10 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1f6p h ALA 284 Cb 0.72 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1f6p h ALA 284 CO 0.06 0.18 0.38 -0.22 0.00 0.00 0.00 179.25 179.64 1f6p h LYS 285 N 0.53 0.68 -0.18 0.00 3.64 -1.05 0.22 116.57 120.41 1f6p h LYS 285 Ca 0.13 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1f6p h LYS 285 Cb 0.25 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1f6p h LYS 285 CO -0.01 0.45 -0.12 -0.44 -2.27 0.00 0.00 179.45 177.06 1f6p h ASP 286 N 0.70 0.28 -0.23 4.20 5.19 -0.63 -1.65 116.42 124.28 1f6p h ASP 286 Ca 0.29 -0.06 -0.13 0.00 -0.62 0.00 0.00 57.03 56.51 1f6p h ASP 286 Cb 0.15 -0.07 -0.01 0.00 0.18 0.00 0.00 39.33 39.58 1f6p h ASP 286 CO -0.17 0.43 -0.31 -0.07 -3.12 0.00 0.00 179.24 176.01 1f6p h LEU 287 N 0.28 0.77 0.03 1.55 3.38 0.50 -2.50 115.31 119.31 1f6p h LEU 287 Ca 0.06 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 1f6p h LEU 287 Cb 0.39 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1f6p h LEU 287 CO 0.02 1.02 -0.01 0.50 0.09 0.00 0.00 178.44 180.06 1f6p h LYS 288 N 0.63 -0.04 -0.02 1.13 1.63 -0.26 -1.77 116.57 117.87 1f6p h LYS 288 Ca 0.07 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.84 1f6p h LYS 288 Cb 0.83 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.46 1f6p h LYS 288 CO 0.07 0.07 -0.14 0.00 -3.45 0.00 0.00 179.45 176.00 1f6p h ALA 289 N 0.84 1.73 0.14 5.00 0.00 -1.23 -1.43 119.26 124.31 1f6p h ALA 289 Ca -0.00 -0.14 -0.32 0.00 0.00 0.00 0.00 54.91 54.45 1f6p h ALA 289 Cb 0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1f6p h ALA 289 CO 0.01 0.20 -1.59 -0.22 0.00 0.00 0.00 179.25 177.65 1f6p h LYS 290 N 0.03 0.30 0.00 0.00 3.64 -1.27 -3.44 116.57 115.83 1f6p h LYS 290 Ca 0.01 -0.51 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 1f6p h LYS 290 Cb 0.27 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1f6p h LYS 290 CO 0.02 1.17 -0.89 1.19 -2.27 0.00 0.00 179.45 178.67 1f6p n PHE 291 N -3.49 0.00 -1.93 1.91 3.72 -0.68 -4.86 117.46 112.13 1f6p n PHE 291 Ca -0.19 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.25 1f6p n PHE 291 Cb 1.05 0.00 0.14 0.00 -0.94 0.00 0.00 39.48 39.73 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 -1.44 2.34 -0.15 4.37 4.77 -0.56 -5.06 117.00 121.28 1f6p n LEU 292 Ca 0.00 -3.39 0.02 0.00 -0.03 0.00 0.00 56.01 52.61 1f6p n LEU 292 Cb 0.09 -0.33 0.02 0.00 -2.33 0.00 0.00 43.42 40.86 1f6p n LEU 292 CO 0.00 1.19 0.31 -1.20 -1.33 0.00 0.00 177.39 176.35