#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fr7 n GLY 6 N 0.00 3.01 0.09 -1.67 0.00 0.05 -5.03 105.19 101.64 1fr7 n GLY 6 Ca 0.00 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.72 1fr7 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fr7 n TYR 7 N 0.00 0.00 -2.21 1.61 4.01 -1.26 -3.68 117.16 115.63 1fr7 n TYR 7 Ca 0.00 -0.82 -0.26 0.00 -0.16 0.00 0.00 57.90 56.65 1fr7 n TYR 7 Cb 0.00 -0.12 0.11 0.00 -0.31 0.00 0.00 39.34 39.01 1fr7 n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1fr7 s GLY 8 N -2.37 1.72 0.36 2.72 0.00 -1.26 -4.68 107.32 103.81 1fr7 s GLY 8 Ca 0.24 -1.16 0.03 0.00 0.00 0.00 0.00 44.72 43.83 1fr7 s GLY 8 CO 0.02 -0.63 2.02 1.70 0.00 0.00 0.00 173.10 176.21 1fr7 h LYS 9 N -0.86 0.78 -0.00 2.90 1.63 -1.97 0.22 116.57 119.26 1fr7 h LYS 9 Ca -0.43 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.33 1fr7 h LYS 9 Cb 1.29 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.74 1fr7 h LYS 9 CO 0.51 0.52 -0.67 0.72 -3.45 0.00 0.00 179.45 177.07 1fr7 n HIS 10 N -4.45 0.00 -1.18 1.91 8.25 -1.26 -4.42 115.22 114.08 1fr7 n HIS 10 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1fr7 n HIS 10 Cb 0.05 -0.07 0.01 0.00 1.12 0.00 0.00 29.99 31.09 1fr7 n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1fr7 n ASN 11 N -1.06 0.30 -3.02 0.41 0.23 -1.13 -4.97 115.26 106.04 1fr7 n ASN 11 Ca 0.07 -1.47 -0.16 0.00 -0.53 0.00 0.00 54.58 52.49 1fr7 n ASN 11 Cb 0.36 -0.07 0.11 0.00 -2.08 0.00 0.00 39.78 38.10 1fr7 n ASN 11 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fr7 n GLY 12 N -0.12 -1.61 0.41 4.83 0.00 0.74 -0.77 105.19 108.68 1fr7 n GLY 12 Ca 0.01 -1.64 0.35 0.00 0.00 0.00 0.00 46.02 44.73 1fr7 n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1fr7 h PRO 13 N 0.00 0.07 0.00 1.61 0.11 -1.85 0.15 132.00 132.10 1fr7 h PRO 13 Ca -0.23 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1fr7 h PRO 13 Cb 0.64 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.73 1fr7 h PRO 13 CO 0.16 0.05 0.00 0.93 -0.21 0.00 0.00 178.00 178.92 1fr7 h GLU 14 N 0.07 0.00 0.00 1.05 4.39 -1.94 -3.12 114.58 115.03 1fr7 h GLU 14 Ca 0.83 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 60.48 1fr7 h GLU 14 Cb 2.44 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 31.08 1fr7 h GLU 14 CO -0.55 0.00 -2.03 0.72 -1.16 0.00 0.00 179.01 175.99 1fr7 n HIS 15 N -2.32 0.03 -0.35 4.33 8.25 0.52 -4.62 115.22 121.06 1fr7 n HIS 15 Ca 0.02 0.01 0.15 0.00 -0.26 0.00 0.00 57.72 57.64 1fr7 n HIS 15 Cb 0.26 -0.58 0.36 0.00 1.12 0.00 0.00 29.99 31.15 1fr7 n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1fr7 h TRP 16 N 0.00 1.01 -0.32 4.41 6.55 -1.46 -2.47 115.95 123.67 1fr7 h TRP 16 Ca -0.07 0.03 0.09 0.00 0.95 0.00 0.00 58.89 59.89 1fr7 h TRP 16 Cb 1.17 -0.30 -0.01 0.00 -0.86 0.00 0.00 29.16 29.16 1fr7 h TRP 16 CO 0.00 0.17 0.28 1.12 -1.05 0.00 0.00 178.44 178.97 1fr7 h HIS 17 N 0.68 0.00 -0.73 0.49 2.07 -1.79 0.82 115.15 116.68 1fr7 h HIS 17 Ca 0.60 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 58.05 1fr7 h HIS 17 Cb 1.04 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.99 1fr7 h HIS 17 CO -0.00 0.00 0.22 0.87 -3.07 0.00 0.00 177.93 175.94 1fr7 h LYS 18 N 0.00 1.14 0.00 5.12 1.57 -1.78 -1.13 116.57 121.49 1fr7 h LYS 18 Ca 0.15 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 1fr7 h LYS 18 Cb 0.72 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1fr7 h LYS 18 CO -0.00 0.98 -1.71 -0.25 -0.57 0.00 0.00 179.45 177.90 1fr7 n ASP 19 N -4.26 0.44 -3.60 0.86 8.00 -0.88 -4.61 116.55 112.49 1fr7 n ASP 19 Ca 0.06 0.19 -0.27 0.00 0.71 0.00 0.00 54.79 55.47 1fr7 n ASP 19 Cb 0.23 0.92 -0.11 0.00 -0.02 0.00 0.00 41.12 42.14 1fr7 n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1fr7 n PHE 20 N -2.64 0.90 0.12 1.24 3.72 0.23 -4.98 117.46 116.04 1fr7 n PHE 20 Ca -0.11 -3.74 0.19 0.00 -0.05 0.00 0.00 57.45 53.74 1fr7 n PHE 20 Cb 0.77 -0.13 0.68 0.00 -0.94 0.00 0.00 39.48 39.86 1fr7 n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1fr7 h PRO 21 N 5.47 0.00 0.00 -1.08 0.13 -1.43 0.35 132.00 135.45 1fr7 h PRO 21 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 1fr7 h PRO 21 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1fr7 h PRO 21 CO 0.52 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.80 1fr7 n ILE 22 N -3.39 1.25 0.19 -3.56 0.13 -1.26 -2.04 119.36 110.68 1fr7 n ILE 22 Ca 0.07 0.43 0.18 0.00 -1.10 0.00 0.00 62.75 62.34 1fr7 n ILE 22 Cb 0.71 -1.35 0.82 0.00 -0.84 0.00 0.00 39.64 38.98 1fr7 n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1fr7 h ALA 23 N 2.19 1.80 -0.59 1.51 0.00 -1.24 0.50 119.26 123.43 1fr7 h ALA 23 Ca 0.00 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.68 1fr7 h ALA 23 Cb 0.15 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 17.82 1fr7 h ALA 23 CO 0.00 -0.41 0.20 1.63 0.00 0.00 0.00 179.25 180.66 1fr7 n LYS 24 N -3.59 2.84 -1.20 0.00 5.02 -0.86 -4.97 118.16 115.40 1fr7 n LYS 24 Ca 0.03 -3.06 -0.28 0.00 -2.02 0.00 0.00 58.31 52.98 1fr7 n LYS 24 Cb 0.43 -2.04 0.23 0.00 -0.02 0.00 0.00 35.03 33.62 1fr7 n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fr7 n GLY 25 N -0.64 -2.42 0.18 0.72 0.00 0.17 -5.00 105.19 98.19 1fr7 n GLY 25 Ca 0.39 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 44.97 1fr7 n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1fr7 h GLU 26 N 0.00 0.00 -2.09 1.61 4.39 -1.96 -3.38 114.58 113.15 1fr7 h GLU 26 Ca -0.39 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 58.77 1fr7 h GLU 26 Cb 1.17 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 29.42 1fr7 h GLU 26 CO 0.26 0.03 -0.99 2.89 -1.16 0.00 0.00 179.01 180.04 1fr7 n ARG 27 N -2.95 1.61 -3.27 2.33 1.85 -1.26 -4.69 116.66 110.26 1fr7 n ARG 27 Ca 0.02 -3.82 -0.30 0.00 -1.00 0.00 0.00 57.85 52.75 1fr7 n ARG 27 Cb 0.56 -1.79 -0.04 0.00 -1.05 0.00 0.00 32.46 30.14 1fr7 n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1fr7 s GLN 28 N -2.45 3.72 0.18 2.89 -1.52 -1.26 -2.77 119.66 118.45 1fr7 s GLN 28 Ca 0.41 0.18 0.08 0.00 -1.95 0.00 0.00 55.36 54.08 1fr7 s GLN 28 Cb 0.28 -2.60 -0.04 0.00 -0.22 0.00 0.00 33.01 30.43 1fr7 s GLN 28 CO -0.09 0.20 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.87 1fr7 s SER 29 N -2.90 2.57 0.99 5.90 0.01 -1.26 -4.66 113.70 114.34 1fr7 s SER 29 Ca 0.46 -0.93 -0.15 0.00 1.31 0.00 0.00 55.95 56.64 1fr7 s SER 29 Cb -0.11 -0.14 0.22 0.00 0.21 0.00 0.00 66.02 66.20 1fr7 s SER 29 CO 0.27 -0.11 1.29 -0.81 0.41 0.00 0.00 173.24 174.29 1fr7 n PRO 30 N 0.01 -1.21 -4.15 12.44 -0.04 -1.26 -4.52 135.00 136.27 1fr7 n PRO 30 Ca -0.11 -2.05 -0.10 0.00 -0.04 0.00 0.00 63.50 61.20 1fr7 n PRO 30 Cb 0.59 -1.31 -0.10 0.00 -0.04 0.00 0.00 33.50 32.64 1fr7 n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1fr7 s VAL 31 N -3.81 0.17 -0.08 0.52 -7.23 -1.26 0.27 120.40 108.97 1fr7 s VAL 31 Ca 0.73 -1.90 -0.20 0.00 -1.81 0.00 0.00 61.98 58.80 1fr7 s VAL 31 Cb -0.02 -1.97 -0.04 0.00 0.56 0.00 0.00 36.38 34.91 1fr7 s VAL 31 CO 0.51 -0.55 0.57 -0.62 -0.31 0.00 0.00 175.10 174.71 1fr7 s ASP 32 N -3.04 6.83 -0.60 4.85 2.15 -1.26 -3.17 116.67 122.43 1fr7 s ASP 32 Ca 0.22 1.00 -0.20 0.00 0.43 0.00 0.00 52.55 53.99 1fr7 s ASP 32 Cb 0.07 -2.34 0.09 0.00 -0.30 0.00 0.00 42.92 40.44 1fr7 s ASP 32 CO 0.00 -0.02 0.77 -0.63 -0.17 0.00 0.00 175.17 175.12 1fr7 s ILE 33 N 0.53 4.69 -0.58 4.11 1.01 0.16 -4.93 121.20 126.18 1fr7 s ILE 33 Ca 0.31 -0.77 -0.26 0.00 0.00 0.00 0.00 60.65 59.93 1fr7 s ILE 33 Cb -0.16 -4.53 0.04 0.00 0.01 0.00 0.00 42.46 37.82 1fr7 s ILE 33 CO 0.14 -1.19 1.06 -0.62 0.00 0.00 0.00 174.94 174.33 1fr7 s ASP 34 N 3.56 6.35 0.37 3.58 2.15 -1.26 -1.23 116.67 130.19 1fr7 s ASP 34 Ca 0.15 -0.25 0.26 0.00 0.43 0.00 0.00 52.55 53.15 1fr7 s ASP 34 Cb -0.22 -2.48 1.31 0.00 -0.30 0.00 0.00 42.92 41.22 1fr7 s ASP 34 CO 0.08 -1.38 1.80 0.71 -0.17 0.00 0.00 175.17 176.21 1fr7 h THR 35 N 6.06 0.00 0.00 1.71 1.35 -1.94 0.56 112.91 120.65 1fr7 h THR 35 Ca -0.26 -0.12 -0.03 0.00 -0.55 0.00 0.00 66.41 65.45 1fr7 h THR 35 Cb 1.07 0.79 -0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1fr7 h THR 35 CO 1.14 0.00 -0.14 -0.74 -0.25 0.00 0.00 175.52 175.54 1fr7 h HIS 36 N 0.00 0.00 0.00 4.73 6.17 -2.03 -3.33 115.15 120.68 1fr7 h HIS 36 Ca 0.00 0.00 -0.04 0.00 0.71 0.00 0.00 60.37 61.04 1fr7 h HIS 36 Cb 0.16 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.08 1fr7 h HIS 36 CO 0.00 0.14 -1.33 0.25 0.71 0.00 0.00 177.93 177.70 1fr7 n THR 37 N -3.16 0.14 -1.69 6.26 -2.24 -0.60 -5.01 114.28 107.98 1fr7 n THR 37 Ca 0.03 -0.18 -0.40 0.00 -2.27 0.00 0.00 64.05 61.22 1fr7 n THR 37 Cb 0.52 -0.05 0.02 0.00 -2.10 0.00 0.00 70.33 68.73 1fr7 n THR 37 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fr7 n ALA 38 N -1.89 1.08 -2.82 6.98 0.00 0.09 -4.86 120.51 119.09 1fr7 n ALA 38 Ca -0.04 0.20 -0.26 0.00 0.00 0.00 0.00 53.44 53.34 1fr7 n ALA 38 Cb 0.34 -2.24 -0.16 0.00 0.00 0.00 0.00 19.45 17.39 1fr7 n ALA 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1fr7 s LYS 39 N -2.38 1.78 0.29 0.00 2.20 -0.36 -4.89 119.74 116.36 1fr7 s LYS 39 Ca 0.65 -0.63 -0.30 0.00 -0.36 0.00 0.00 55.97 55.33 1fr7 s LYS 39 Cb -0.48 -1.57 -0.10 0.00 -1.51 0.00 0.00 37.83 34.17 1fr7 s LYS 39 CO 0.55 0.28 1.44 -0.47 -0.36 0.00 0.00 175.35 176.79 1fr7 s TYR 40 N -0.06 2.94 -0.31 4.03 5.04 -1.26 -0.05 117.35 127.67 1fr7 s TYR 40 Ca -0.02 1.09 0.03 0.00 -2.44 0.00 0.00 57.07 55.73 1fr7 s TYR 40 Cb -0.11 -3.85 0.09 0.00 0.35 0.00 0.00 41.96 38.44 1fr7 s TYR 40 CO 0.02 -2.67 0.02 0.34 -1.34 0.00 0.00 175.55 171.91 1fr7 s ASP 41 N 0.16 4.58 0.50 4.32 -1.08 -0.67 -4.81 116.67 119.68 1fr7 s ASP 41 Ca 0.57 -1.90 0.34 0.00 -0.52 0.00 0.00 52.55 51.04 1fr7 s ASP 41 Cb -0.43 -1.52 1.59 0.00 -1.46 0.00 0.00 42.92 41.11 1fr7 s ASP 41 CO 0.48 -0.34 2.01 1.55 0.52 0.00 0.00 175.17 179.39 1fr7 h PRO 42 N 7.71 0.00 0.00 4.34 0.13 -1.94 -2.59 132.00 139.64 1fr7 h PRO 42 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1fr7 h PRO 42 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1fr7 h PRO 42 CO 0.50 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.14 1fr7 n SER 43 N -2.82 0.00 -4.73 1.44 3.41 -1.26 -4.78 113.62 104.88 1fr7 n SER 43 Ca -0.00 0.31 -0.41 0.00 -0.26 0.00 0.00 58.87 58.50 1fr7 n SER 43 Cb 0.19 -0.43 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 1fr7 n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1fr7 s LEU 44 N -2.85 4.44 0.54 1.04 1.43 -0.98 -5.02 118.68 117.27 1fr7 s LEU 44 Ca 0.15 2.11 -0.04 0.00 -1.03 0.00 0.00 54.13 55.32 1fr7 s LEU 44 Cb 0.15 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1fr7 s LEU 44 CO 0.39 -0.35 0.83 -0.54 0.23 0.00 0.00 176.35 176.91 1fr7 s LYS 45 N 0.14 3.03 0.36 1.70 -0.14 -1.08 -4.92 119.74 118.83 1fr7 s LYS 45 Ca 0.53 -0.11 -0.28 0.00 -1.36 0.00 0.00 55.97 54.75 1fr7 s LYS 45 Cb -0.30 -2.36 -0.12 0.00 -1.68 0.00 0.00 37.83 33.37 1fr7 s LYS 45 CO 0.34 -0.53 1.36 -2.30 -0.76 0.00 0.00 175.35 173.46 1fr7 n PRO 46 N -2.41 2.33 -2.58 -1.68 -0.02 -1.26 -1.08 135.00 128.30 1fr7 n PRO 46 Ca 0.03 0.82 -0.41 0.00 -2.02 0.00 0.00 63.50 61.92 1fr7 n PRO 46 Cb 0.57 -2.46 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 1fr7 n PRO 46 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1fr7 s LEU 47 N -1.42 4.51 -0.22 2.45 0.20 -1.26 -2.12 118.68 120.82 1fr7 s LEU 47 Ca 0.55 2.03 0.01 0.00 0.69 0.00 0.00 54.13 57.41 1fr7 s LEU 47 Cb -0.53 -3.60 0.05 0.00 -0.43 0.00 0.00 46.19 41.67 1fr7 s LEU 47 CO 0.63 -0.14 -0.09 -0.55 -0.29 0.00 0.00 176.35 175.90 1fr7 s SER 48 N -0.25 3.71 -0.40 3.68 0.15 0.52 -4.89 113.70 116.22 1fr7 s SER 48 Ca 0.48 -1.06 -0.05 0.00 0.70 0.00 0.00 55.95 56.02 1fr7 s SER 48 Cb -0.28 -1.28 0.09 0.00 -1.71 0.00 0.00 66.02 62.85 1fr7 s SER 48 CO 0.34 -0.18 0.21 -0.69 1.20 0.00 0.00 173.24 174.12 1fr7 s VAL 49 N 1.34 3.63 -0.76 4.45 1.01 -1.26 -0.87 120.40 127.93 1fr7 s VAL 49 Ca -0.04 -1.75 -0.14 0.00 0.00 0.00 0.00 61.98 60.05 1fr7 s VAL 49 Cb -0.18 -3.34 0.20 0.00 0.00 0.00 0.00 36.38 33.06 1fr7 s VAL 49 CO -0.07 -0.57 0.70 -0.44 0.00 0.00 0.00 175.10 174.72 1fr7 s SER 50 N 1.94 6.60 -0.02 3.32 0.01 -0.06 -4.83 113.70 120.66 1fr7 s SER 50 Ca 0.05 -2.52 0.06 0.00 1.31 0.00 0.00 55.95 54.84 1fr7 s SER 50 Cb -0.23 -2.20 0.16 0.00 0.21 0.00 0.00 66.02 63.96 1fr7 s SER 50 CO -0.02 -0.62 1.12 -1.22 0.41 0.00 0.00 173.24 172.92 1fr7 n TYR 51 N 4.20 0.21 0.31 2.43 4.01 -1.26 -1.12 117.16 125.93 1fr7 n TYR 51 Ca 0.08 -0.57 0.20 0.00 -0.16 0.00 0.00 57.90 57.45 1fr7 n TYR 51 Cb 0.45 -0.07 0.98 0.00 -0.31 0.00 0.00 39.34 40.39 1fr7 n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1fr7 h ASP 52 N 0.77 0.00 -0.16 7.72 3.04 -1.88 -2.10 116.42 123.80 1fr7 h ASP 52 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1fr7 h ASP 52 Cb 0.68 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.97 1fr7 h ASP 52 CO 0.01 0.01 0.00 0.00 -2.04 0.00 0.00 179.24 177.22 1fr7 n GLN 53 N -3.13 2.60 -1.63 4.15 6.02 -1.25 -5.04 117.38 119.09 1fr7 n GLN 53 Ca -0.02 -2.19 -0.42 0.00 -0.01 0.00 0.00 57.00 54.36 1fr7 n GLN 53 Cb 0.17 -1.38 0.01 0.00 1.02 0.00 0.00 30.24 30.06 1fr7 n GLN 53 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fr7 n ALA 54 N -0.40 0.41 -3.56 -1.58 0.00 -0.79 -4.59 120.51 110.00 1fr7 n ALA 54 Ca 0.12 0.27 -0.29 0.00 0.00 0.00 0.00 53.44 53.54 1fr7 n ALA 54 Cb 0.53 -2.12 -0.15 0.00 0.00 0.00 0.00 19.45 17.71 1fr7 n ALA 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fr7 s THR 55 N -1.22 -0.01 0.52 0.00 2.01 -1.26 -5.00 115.64 110.69 1fr7 s THR 55 Ca 0.61 -0.77 -0.17 0.00 0.31 0.00 0.00 61.69 61.67 1fr7 s THR 55 Cb -0.57 -1.01 -0.07 0.00 0.01 0.00 0.00 72.50 70.86 1fr7 s THR 55 CO 0.58 -0.70 1.01 -0.94 -0.69 0.00 0.00 174.62 173.87 1fr7 s SER 56 N 2.07 6.40 -0.10 3.53 1.04 -1.26 -0.70 113.70 124.68 1fr7 s SER 56 Ca 0.09 1.69 -0.02 0.00 0.48 0.00 0.00 55.95 58.18 1fr7 s SER 56 Cb -0.16 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 63.38 1fr7 s SER 56 CO -0.35 -0.74 -0.11 0.18 0.98 0.00 0.00 173.24 173.20 1fr7 n LEU 57 N -1.54 1.73 -3.66 2.42 4.77 0.12 -4.17 117.00 116.66 1fr7 n LEU 57 Ca 0.07 0.04 -0.08 0.00 -0.03 0.00 0.00 56.01 56.02 1fr7 n LEU 57 Cb 0.54 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 1fr7 n LEU 57 CO 0.45 0.41 0.50 0.00 -1.33 0.00 0.00 177.39 177.42 1fr7 s ARG 58 N -2.18 1.44 0.01 3.23 1.70 -1.17 -1.39 118.95 120.59 1fr7 s ARG 58 Ca -0.13 -0.70 0.04 0.00 -0.47 0.00 0.00 55.73 54.47 1fr7 s ARG 58 Cb 0.04 0.55 -0.03 0.00 -0.57 0.00 0.00 34.95 34.94 1fr7 s ARG 58 CO 0.19 -0.65 -0.10 0.96 -1.08 0.00 0.00 175.30 174.62 1fr7 s ILE 59 N -3.70 3.36 0.05 4.99 -4.36 0.35 -1.20 121.20 120.70 1fr7 s ILE 59 Ca 0.07 -0.88 -0.03 0.00 -0.26 0.00 0.00 60.65 59.56 1fr7 s ILE 59 Cb -0.03 -2.44 -0.03 0.00 1.25 0.00 0.00 42.46 41.21 1fr7 s ILE 59 CO -0.02 0.40 0.02 -0.76 0.24 0.00 0.00 174.94 174.82 1fr7 s LEU 60 N -1.36 2.22 -0.27 0.37 1.02 0.27 -0.64 118.68 120.29 1fr7 s LEU 60 Ca 0.16 -0.85 0.03 0.00 0.02 0.00 0.00 54.13 53.49 1fr7 s LEU 60 Cb -0.11 0.37 0.07 0.00 0.02 0.00 0.00 46.19 46.54 1fr7 s LEU 60 CO 0.06 -0.59 -0.06 0.21 0.02 0.00 0.00 176.35 175.99 1fr7 s ASN 61 N -2.70 4.42 -0.07 2.29 3.84 -0.23 -0.91 114.94 121.58 1fr7 s ASN 61 Ca 0.03 -1.53 0.19 0.00 0.21 0.00 0.00 52.86 51.76 1fr7 s ASN 61 Cb 0.05 -1.49 0.67 0.00 -0.55 0.00 0.00 41.25 39.93 1fr7 s ASN 61 CO -0.09 -0.24 1.57 -0.46 -2.79 0.00 0.00 177.10 175.09 1fr7 n ASN 62 N 4.44 4.34 0.00 -4.21 6.94 -1.25 -0.45 115.26 125.06 1fr7 n ASN 62 Ca -0.10 -2.28 0.00 0.00 -0.02 0.00 0.00 54.58 52.18 1fr7 n ASN 62 Cb 0.42 -0.54 0.00 0.00 -2.36 0.00 0.00 39.78 37.30 1fr7 n ASN 62 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1fr7 n GLY 63 N 1.29 1.28 0.01 4.83 0.00 -1.26 -4.78 105.19 106.56 1fr7 n GLY 63 Ca 0.25 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.25 1fr7 n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fr7 n HIS 64 N -2.00 0.00 -3.60 1.61 8.25 -1.26 -4.76 115.22 113.46 1fr7 n HIS 64 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 1fr7 n HIS 64 Cb 0.00 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.01 1fr7 n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1fr7 s ALA 65 N -2.04 -2.08 0.28 -1.41 0.00 -1.26 -4.89 121.76 110.35 1fr7 s ALA 65 Ca -0.02 1.54 -0.30 0.00 0.00 0.00 0.00 51.96 53.19 1fr7 s ALA 65 Cb 0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 23.12 22.94 1fr7 s ALA 65 CO 0.06 -0.63 1.47 0.12 0.00 0.00 0.00 175.76 176.78 1fr7 s PHE 66 N -2.42 2.93 0.08 0.00 2.19 -1.26 -3.90 117.98 115.59 1fr7 s PHE 66 Ca 0.10 1.02 0.03 0.00 0.33 0.00 0.00 56.93 58.40 1fr7 s PHE 66 Cb -0.01 -3.88 -0.03 0.00 -1.31 0.00 0.00 43.02 37.79 1fr7 s PHE 66 CO -0.05 -2.83 -0.08 -0.80 1.83 0.00 0.00 175.22 173.29 1fr7 s ASN 67 N 0.27 1.13 -0.05 6.13 0.01 -0.08 -1.91 114.94 120.44 1fr7 s ASN 67 Ca 0.59 -0.77 0.02 0.00 -0.71 0.00 0.00 52.86 51.98 1fr7 s ASN 67 Cb -0.43 0.05 0.02 0.00 0.41 0.00 0.00 41.25 41.29 1fr7 s ASN 67 CO 0.47 -0.30 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.99 1fr7 s VAL 68 N -2.40 0.73 -0.12 1.60 1.01 0.11 -0.56 120.40 120.76 1fr7 s VAL 68 Ca 0.02 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 1fr7 s VAL 68 Cb -0.03 -0.70 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 1fr7 s VAL 68 CO -0.01 0.26 -0.01 -1.61 0.00 0.00 0.00 175.10 173.73 1fr7 s GLU 69 N 0.71 3.34 0.20 2.72 2.02 -0.34 -1.17 118.70 126.17 1fr7 s GLU 69 Ca -0.11 -0.44 0.09 0.00 0.02 0.00 0.00 54.97 54.53 1fr7 s GLU 69 Cb -0.14 -2.88 -0.04 0.00 0.10 0.00 0.00 34.13 31.17 1fr7 s GLU 69 CO 0.01 0.49 -0.08 -0.06 0.02 0.00 0.00 175.26 175.65 1fr7 s PHE 70 N -0.30 2.65 -0.40 1.61 0.40 -0.11 0.11 117.98 121.93 1fr7 s PHE 70 Ca 0.06 -0.22 -0.29 0.00 -0.60 0.00 0.00 56.93 55.89 1fr7 s PHE 70 Cb -0.12 -1.27 0.01 0.00 0.51 0.00 0.00 43.02 42.14 1fr7 s PHE 70 CO 0.02 0.54 1.48 0.34 0.70 0.00 0.00 175.22 178.30 1fr7 s ASP 71 N -2.99 6.26 -0.25 1.36 -1.08 0.12 -4.78 116.67 115.32 1fr7 s ASP 71 Ca 0.26 0.90 0.11 0.00 -0.52 0.00 0.00 52.55 53.30 1fr7 s ASP 71 Cb -0.08 -2.54 0.49 0.00 -1.46 0.00 0.00 42.92 39.33 1fr7 s ASP 71 CO 0.16 -1.49 1.41 -0.90 0.52 0.00 0.00 175.17 174.88 1fr7 n ASP 72 N 9.08 2.67 0.00 -0.34 5.75 -1.26 -4.60 116.55 127.85 1fr7 n ASP 72 Ca 0.18 -3.59 0.12 0.00 -0.01 0.00 0.00 54.79 51.48 1fr7 n ASP 72 Cb 0.48 -0.59 0.55 0.00 -1.03 0.00 0.00 41.12 40.53 1fr7 n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1fr7 n SER 73 N -1.03 0.00 -3.77 -1.12 3.41 -1.26 -4.86 113.62 104.99 1fr7 n SER 73 Ca 0.28 0.38 -0.09 0.00 -0.26 0.00 0.00 58.87 59.19 1fr7 n SER 73 Cb 0.95 -0.46 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 1fr7 n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1fr7 s GLN 74 N -2.91 1.72 -0.77 4.33 -0.21 -1.26 -5.06 119.66 115.50 1fr7 s GLN 74 Ca 0.14 -1.25 -0.08 0.00 0.02 0.00 0.00 55.36 54.19 1fr7 s GLN 74 Cb 0.16 0.52 -0.18 0.00 1.00 0.00 0.00 33.01 34.51 1fr7 s GLN 74 CO 0.44 -0.75 3.31 -0.25 -2.12 0.00 0.00 175.29 175.93 1fr7 n ASP 75 N -0.61 6.90 -0.04 5.90 8.00 -1.26 -4.56 116.55 130.88 1fr7 n ASP 75 Ca -0.03 -2.52 -0.14 0.00 0.71 0.00 0.00 54.79 52.82 1fr7 n ASP 75 Cb 0.61 -1.48 -0.08 0.00 -0.02 0.00 0.00 41.12 40.14 1fr7 n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1fr7 h LYS 76 N 3.95 0.29 -4.08 -1.24 1.57 -1.87 -3.42 116.57 111.78 1fr7 h LYS 76 Ca 0.51 -0.18 -0.55 0.00 -1.87 0.00 0.00 60.65 58.56 1fr7 h LYS 76 Cb 0.93 0.02 -0.38 0.00 0.08 0.00 0.00 32.23 32.88 1fr7 h LYS 76 CO 0.97 0.77 -0.79 0.00 -0.57 0.00 0.00 179.45 179.83 1fr7 s ALA 77 N -4.02 1.45 0.13 3.86 0.00 -1.26 -3.79 121.76 118.13 1fr7 s ALA 77 Ca -0.15 -0.86 0.04 0.00 0.00 0.00 0.00 51.96 50.99 1fr7 s ALA 77 Cb 0.04 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.95 1fr7 s ALA 77 CO 0.75 -0.89 -0.09 0.14 0.00 0.00 0.00 175.76 175.66 1fr7 s VAL 78 N 1.65 1.03 -0.10 0.00 -7.23 -0.28 -1.29 120.40 114.19 1fr7 s VAL 78 Ca -0.00 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.20 1fr7 s VAL 78 Cb -0.16 -1.77 -0.01 0.00 0.56 0.00 0.00 36.38 35.00 1fr7 s VAL 78 CO -0.07 -0.76 -0.18 -0.22 -0.31 0.00 0.00 175.10 173.55 1fr7 s LEU 79 N -3.07 2.43 0.25 1.32 2.96 0.09 -0.88 118.68 121.77 1fr7 s LEU 79 Ca 0.15 -0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 53.61 1fr7 s LEU 79 Cb 0.03 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.19 1fr7 s LEU 79 CO -0.01 0.19 0.28 -0.54 -1.32 0.00 0.00 176.35 174.96 1fr7 s LYS 80 N 0.15 1.45 1.98 1.98 1.02 -0.05 -2.13 119.74 124.14 1fr7 s LYS 80 Ca -0.10 -1.60 0.00 0.00 0.02 0.00 0.00 55.97 54.29 1fr7 s LYS 80 Cb -0.16 0.35 0.00 0.00 -0.52 0.00 0.00 37.83 37.50 1fr7 s LYS 80 CO 0.06 -0.54 0.00 0.41 -0.92 0.00 0.00 175.35 174.36 1fr7 n GLY 81 N -0.38 -1.09 7.00 -3.33 0.00 -1.26 -0.35 105.19 105.78 1fr7 n GLY 81 Ca 0.02 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1fr7 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fr7 n GLY 82 N 0.00 3.22 0.21 -0.02 0.00 -0.24 -1.17 105.19 107.19 1fr7 n GLY 82 Ca 0.00 -0.17 0.13 0.00 0.00 0.00 0.00 46.02 45.99 1fr7 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fr7 n PRO 83 N 13.73 0.84 -2.59 1.61 -0.04 -1.26 -2.62 135.00 144.66 1fr7 n PRO 83 Ca 0.00 -0.43 -0.40 0.00 -0.04 0.00 0.00 63.50 62.63 1fr7 n PRO 83 Cb 0.00 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 1fr7 n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1fr7 s LEU 84 N -2.46 4.57 -0.29 1.53 1.43 -0.32 -5.04 118.68 118.10 1fr7 s LEU 84 Ca 0.27 2.13 -0.04 0.00 -1.03 0.00 0.00 54.13 55.45 1fr7 s LEU 84 Cb 0.20 -3.65 0.03 0.00 0.03 0.00 0.00 46.19 42.79 1fr7 s LEU 84 CO 0.49 -0.03 0.03 -1.81 0.23 0.00 0.00 176.35 175.26 1fr7 s ASP 85 N -1.04 4.90 0.00 2.29 1.01 -1.26 -4.27 116.67 118.29 1fr7 s ASP 85 Ca 0.44 -0.94 0.00 0.00 0.71 0.00 0.00 52.55 52.76 1fr7 s ASP 85 Cb -0.29 -1.79 0.00 0.00 1.01 0.00 0.00 42.92 41.85 1fr7 s ASP 85 CO 0.37 -0.21 0.00 0.61 0.21 0.00 0.00 175.17 176.14 1fr7 n GLY 86 N 4.76 -1.78 3.57 0.21 0.00 -1.26 -4.96 105.19 105.73 1fr7 n GLY 86 Ca -0.14 -1.91 -0.34 0.00 0.00 0.00 0.00 46.02 43.63 1fr7 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fr7 s THR 87 N 0.00 4.18 -0.17 2.61 2.01 -1.26 -4.59 115.64 118.42 1fr7 s THR 87 Ca 0.00 -0.27 0.00 0.00 0.31 0.00 0.00 61.69 61.73 1fr7 s THR 87 Cb 0.00 -2.82 0.01 0.00 0.01 0.00 0.00 72.50 69.69 1fr7 s THR 87 CO 0.00 0.52 -0.16 -0.31 -0.69 0.00 0.00 174.62 173.98 1fr7 s TYR 88 N 0.04 2.79 -0.09 4.92 1.51 -0.91 -1.15 117.35 124.47 1fr7 s TYR 88 Ca 0.02 -1.25 -0.19 0.00 -1.01 0.00 0.00 57.07 54.64 1fr7 s TYR 88 Cb -0.13 -1.92 -0.04 0.00 -0.11 0.00 0.00 41.96 39.75 1fr7 s TYR 88 CO 0.02 -0.61 0.52 0.50 -1.11 0.00 0.00 175.55 174.88 1fr7 s ARG 89 N 1.07 4.33 0.10 -0.62 3.52 0.07 -0.73 118.95 126.68 1fr7 s ARG 89 Ca -0.01 0.55 -0.31 0.00 -0.13 0.00 0.00 55.73 55.84 1fr7 s ARG 89 Cb -0.14 -3.41 -0.07 0.00 -1.56 0.00 0.00 34.95 29.76 1fr7 s ARG 89 CO -0.05 0.21 1.37 -1.17 -0.81 0.00 0.00 175.30 174.85 1fr7 s LEU 90 N 0.43 4.37 0.00 -0.88 2.96 -0.41 -0.73 118.68 124.42 1fr7 s LEU 90 Ca 0.28 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.47 1fr7 s LEU 90 Cb -0.16 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1fr7 s LEU 90 CO 0.13 -0.63 0.00 0.00 -1.32 0.00 0.00 176.35 174.52 1fr7 n ILE 91 N 3.99 0.00 -3.78 6.68 3.06 0.01 -4.40 119.36 124.92 1fr7 n ILE 91 Ca 0.11 0.00 -0.09 0.00 -2.50 0.00 0.00 62.75 60.28 1fr7 n ILE 91 Cb 0.43 -0.61 -0.03 0.00 0.54 0.00 0.00 39.64 39.97 1fr7 n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1fr7 s GLN 92 N -1.79 1.57 -0.04 9.51 1.03 -1.15 -0.94 119.66 127.85 1fr7 s GLN 92 Ca 0.00 -0.91 -0.05 0.00 0.04 0.00 0.00 55.36 54.44 1fr7 s GLN 92 Cb 0.00 0.56 0.01 0.00 0.03 0.00 0.00 33.01 33.62 1fr7 s GLN 92 CO 0.00 -0.69 0.14 0.45 -2.54 0.00 0.00 175.29 172.65 1fr7 s SER 93 N -2.89 -0.12 0.06 12.60 0.15 -0.32 -0.11 113.70 123.07 1fr7 s SER 93 Ca 0.10 0.20 -0.04 0.00 0.70 0.00 0.00 55.95 56.91 1fr7 s SER 93 Cb -0.03 0.28 -0.02 0.00 -1.71 0.00 0.00 66.02 64.54 1fr7 s SER 93 CO 0.01 -0.11 0.07 -1.38 1.20 0.00 0.00 173.24 173.03 1fr7 s HIS 94 N -0.19 0.33 -0.15 3.44 -3.43 -0.71 0.06 115.29 114.64 1fr7 s HIS 94 Ca -0.03 -0.78 0.01 0.00 -0.80 0.00 0.00 55.06 53.46 1fr7 s HIS 94 Cb -0.02 -0.23 -0.00 0.00 -1.43 0.00 0.00 32.58 30.90 1fr7 s HIS 94 CO 0.00 -0.42 -0.17 -1.17 -2.00 0.00 0.00 174.74 170.98 1fr7 s LEU 95 N -2.69 2.41 -0.26 5.38 2.96 -0.80 -1.25 118.68 124.42 1fr7 s LEU 95 Ca 0.03 -0.49 -0.11 0.00 -0.22 0.00 0.00 54.13 53.34 1fr7 s LEU 95 Cb 0.05 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 45.15 1fr7 s LEU 95 CO -0.09 0.09 0.19 -1.00 -1.32 0.00 0.00 176.35 174.23 1fr7 s HIS 96 N 0.76 3.26 0.03 5.38 3.76 -0.47 -4.07 115.29 123.94 1fr7 s HIS 96 Ca -0.07 0.19 0.08 0.00 -0.15 0.00 0.00 55.06 55.12 1fr7 s HIS 96 Cb -0.16 -2.35 -0.03 0.00 1.11 0.00 0.00 32.58 31.16 1fr7 s HIS 96 CO 0.00 -0.07 -0.24 1.41 -0.85 0.00 0.00 174.74 174.99 1fr7 s MET 97 N 1.49 1.72 0.56 1.40 1.75 -1.26 -1.10 119.30 123.86 1fr7 s MET 97 Ca 0.08 -1.00 0.02 0.00 -1.25 0.00 0.00 55.69 53.54 1fr7 s MET 97 Cb -0.15 -1.82 0.04 0.00 2.84 0.00 0.00 34.83 35.74 1fr7 s MET 97 CO 0.08 0.48 0.78 0.20 -0.65 0.00 0.00 175.02 175.91 1fr7 s GLY 98 N -1.05 1.83 0.02 2.11 0.00 -1.07 0.63 107.32 109.79 1fr7 s GLY 98 Ca 0.10 -1.45 0.22 0.00 0.00 0.00 0.00 44.72 43.59 1fr7 s GLY 98 CO 0.01 -1.14 0.89 -1.14 0.00 0.00 0.00 173.10 171.73 1fr7 n SER 99 N -2.33 0.61 -4.02 1.64 3.41 -1.26 -4.32 113.62 107.35 1fr7 n SER 99 Ca 0.09 -0.43 -0.13 0.00 -0.26 0.00 0.00 58.87 58.15 1fr7 n SER 99 Cb 0.60 1.07 -0.12 0.00 -0.26 0.00 0.00 64.21 65.50 1fr7 n SER 99 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1fr7 s LEU 100 N -3.70 2.21 0.55 1.04 1.43 -1.26 -5.05 118.68 113.89 1fr7 s LEU 100 Ca 0.03 -0.45 0.26 0.00 -1.03 0.00 0.00 54.13 52.95 1fr7 s LEU 100 Cb 0.15 -0.13 1.45 0.00 0.03 0.00 0.00 46.19 47.69 1fr7 s LEU 100 CO 0.84 -0.17 2.00 0.44 0.23 0.00 0.00 176.35 179.69 1fr7 h ASP 101 N 4.82 0.00 0.00 2.29 5.19 -1.92 -1.75 116.42 125.06 1fr7 h ASP 101 Ca -0.33 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.08 1fr7 h ASP 101 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1fr7 h ASP 101 CO 0.43 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.16 1fr7 n GLY 102 N -1.58 -0.89 3.36 2.75 0.00 -1.26 -3.57 105.19 104.00 1fr7 n GLY 102 Ca 0.08 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1fr7 n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1fr7 s GLN 103 N -2.00 1.15 0.00 1.61 -2.07 -0.66 -4.61 119.66 113.09 1fr7 s GLN 103 Ca 0.35 -0.98 0.00 0.00 -1.82 0.00 0.00 55.36 52.90 1fr7 s GLN 103 Cb 0.16 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.50 1fr7 s GLN 103 CO 0.27 -0.44 0.00 0.41 -1.32 0.00 0.00 175.29 174.21 1fr7 n GLY 104 N -0.22 2.14 3.84 2.60 0.00 -0.90 -3.72 105.19 108.92 1fr7 n GLY 104 Ca -0.11 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 1fr7 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fr7 s SER 105 N 0.00 6.34 -0.19 1.61 1.04 -0.64 -4.06 113.70 117.80 1fr7 s SER 105 Ca 0.00 1.58 -0.18 0.00 0.48 0.00 0.00 55.95 57.83 1fr7 s SER 105 Cb 0.00 -2.50 -0.15 0.00 0.10 0.00 0.00 66.02 63.47 1fr7 s SER 105 CO 0.00 -0.78 0.10 -0.62 0.98 0.00 0.00 173.24 172.91 1fr7 n GLU 106 N -1.99 0.53 -2.14 4.02 1.02 -1.26 -4.82 120.64 116.01 1fr7 n GLU 106 Ca 0.07 0.56 -0.32 0.00 -0.02 0.00 0.00 57.16 57.45 1fr7 n GLU 106 Cb 0.54 -1.73 -0.01 0.00 -0.02 0.00 0.00 31.44 30.22 1fr7 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1fr7 s HIS 107 N -2.33 3.31 0.09 -0.32 3.76 -1.26 -4.30 115.29 114.24 1fr7 s HIS 107 Ca -0.25 1.45 0.03 0.00 -0.15 0.00 0.00 55.06 56.14 1fr7 s HIS 107 Cb 0.05 -2.85 -0.04 0.00 1.11 0.00 0.00 32.58 30.85 1fr7 s HIS 107 CO 0.49 -0.72 -0.08 0.95 -0.85 0.00 0.00 174.74 174.52 1fr7 s THR 108 N -2.69 0.79 -0.25 1.30 -4.23 -1.19 -4.68 115.64 104.68 1fr7 s THR 108 Ca 0.60 -1.72 0.02 0.00 -1.18 0.00 0.00 61.69 59.41 1fr7 s THR 108 Cb -0.12 -1.42 0.06 0.00 1.34 0.00 0.00 72.50 72.35 1fr7 s THR 108 CO 0.39 -0.69 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.00 1fr7 s VAL 109 N -2.87 1.96 -1.40 2.29 1.01 -0.85 0.38 120.40 120.92 1fr7 s VAL 109 Ca 0.07 -1.50 -0.07 0.00 0.00 0.00 0.00 61.98 60.48 1fr7 s VAL 109 Cb 0.00 -2.12 0.04 0.00 0.00 0.00 0.00 36.38 34.30 1fr7 s VAL 109 CO -0.02 -0.06 0.88 0.47 0.00 0.00 0.00 175.10 176.37 1fr7 n ASP 110 N 4.51 -3.20 0.00 3.32 8.00 -0.36 -1.29 116.55 127.52 1fr7 n ASP 110 Ca -0.13 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.60 1fr7 n ASP 110 Cb 0.43 -4.12 0.00 0.00 -0.02 0.00 0.00 41.12 37.41 1fr7 n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1fr7 n LYS 111 N -4.51 0.00 -2.44 -1.24 4.76 -1.26 -4.99 118.16 108.48 1fr7 n LYS 111 Ca -0.13 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 54.90 1fr7 n LYS 111 Cb 0.60 -2.48 -0.03 0.00 -1.84 0.00 0.00 35.03 31.27 1fr7 n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1fr7 s LYS 112 N -0.08 4.48 -0.03 1.97 2.47 -0.41 -5.00 119.74 123.15 1fr7 s LYS 112 Ca 0.00 1.77 -0.01 0.00 -1.56 0.00 0.00 55.97 56.17 1fr7 s LYS 112 Cb 0.00 -3.31 -0.04 0.00 -1.46 0.00 0.00 37.83 33.02 1fr7 s LYS 112 CO 0.00 -0.15 0.05 0.15 0.16 0.00 0.00 175.35 175.56 1fr7 s LYS 113 N 0.50 3.01 0.43 4.03 1.02 -1.26 -2.00 119.74 125.47 1fr7 s LYS 113 Ca 0.55 -0.48 0.08 0.00 0.02 0.00 0.00 55.97 56.15 1fr7 s LYS 113 Cb -0.30 -2.82 0.01 0.00 -0.52 0.00 0.00 37.83 34.20 1fr7 s LYS 113 CO 0.32 0.66 0.58 0.71 -0.92 0.00 0.00 175.35 176.69 1fr7 s TYR 114 N -1.10 2.69 0.20 3.18 2.02 -1.26 -4.65 117.35 118.42 1fr7 s TYR 114 Ca 0.20 -0.43 0.36 0.00 -0.37 0.00 0.00 57.07 56.82 1fr7 s TYR 114 Cb -0.12 -2.35 1.56 0.00 -0.40 0.00 0.00 41.96 40.65 1fr7 s TYR 114 CO 0.10 -0.46 2.05 0.00 -1.57 0.00 0.00 175.55 175.68 1fr7 h ALA 115 N 0.63 1.00 -1.79 3.71 0.00 -1.39 -1.57 119.26 119.85 1fr7 h ALA 115 Ca -0.39 0.00 0.26 0.00 0.00 0.00 0.00 54.91 54.78 1fr7 h ALA 115 Cb 1.28 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.96 1fr7 h ALA 115 CO 0.45 0.00 0.70 0.00 0.00 0.00 0.00 179.25 180.40 1fr7 s ALA 116 N -3.75 -2.01 -0.09 0.00 0.00 -1.17 -2.61 121.76 112.12 1fr7 s ALA 116 Ca 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 51.96 52.50 1fr7 s ALA 116 Cb 0.10 0.42 0.05 0.00 0.00 0.00 0.00 23.12 23.69 1fr7 s ALA 116 CO 0.52 -1.00 0.20 -2.00 0.00 0.00 0.00 175.76 173.47 1fr7 s GLU 117 N -2.75 0.12 -0.12 0.00 2.12 -0.26 -1.33 118.70 116.49 1fr7 s GLU 117 Ca 0.13 0.52 -0.09 0.00 0.36 0.00 0.00 54.97 55.89 1fr7 s GLU 117 Cb 0.02 -0.16 -0.04 0.00 0.26 0.00 0.00 34.13 34.21 1fr7 s GLU 117 CO -0.02 -0.21 0.18 -1.17 -0.54 0.00 0.00 175.26 173.50 1fr7 s LEU 118 N 1.64 4.37 -0.09 2.70 2.96 0.75 -1.37 118.68 129.63 1fr7 s LEU 118 Ca -0.05 0.50 0.04 0.00 -0.22 0.00 0.00 54.13 54.40 1fr7 s LEU 118 Cb -0.11 -2.15 -0.00 0.00 0.50 0.00 0.00 46.19 44.42 1fr7 s LEU 118 CO -0.07 0.35 -0.23 -1.00 -1.32 0.00 0.00 176.35 174.08 1fr7 s HIS 119 N -0.75 2.44 -0.32 5.38 3.76 -0.38 -0.82 115.29 124.60 1fr7 s HIS 119 Ca 0.15 -0.96 -0.03 0.00 -0.15 0.00 0.00 55.06 54.07 1fr7 s HIS 119 Cb -0.12 -1.64 0.05 0.00 1.11 0.00 0.00 32.58 31.98 1fr7 s HIS 119 CO 0.04 -0.38 0.05 -0.51 -0.85 0.00 0.00 174.74 173.09 1fr7 s LEU 120 N 0.30 4.14 -0.16 0.89 1.43 -0.35 -1.74 118.68 123.19 1fr7 s LEU 120 Ca -0.17 -1.28 -0.19 0.00 -1.03 0.00 0.00 54.13 51.47 1fr7 s LEU 120 Cb -0.17 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 1fr7 s LEU 120 CO 0.08 -0.30 0.51 -0.69 0.23 0.00 0.00 176.35 176.18 1fr7 s VAL 121 N 1.30 5.13 0.05 -1.59 1.01 0.84 -1.48 120.40 125.66 1fr7 s VAL 121 Ca -0.03 0.98 0.06 0.00 0.00 0.00 0.00 61.98 63.00 1fr7 s VAL 121 Cb -0.20 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 1fr7 s VAL 121 CO 0.00 0.23 -0.18 -1.00 0.00 0.00 0.00 175.10 174.16 1fr7 s HIS 122 N 1.23 1.55 0.00 5.22 3.76 -0.37 -0.81 115.29 125.87 1fr7 s HIS 122 Ca 0.26 -0.37 0.07 0.00 -0.15 0.00 0.00 55.06 54.86 1fr7 s HIS 122 Cb -0.15 -0.91 -0.03 0.00 1.11 0.00 0.00 32.58 32.60 1fr7 s HIS 122 CO 0.10 0.08 -0.21 1.67 -0.85 0.00 0.00 174.74 175.54 1fr7 s TRP 123 N -0.89 2.49 -0.13 1.40 1.48 0.09 -0.93 118.94 122.46 1fr7 s TRP 123 Ca 0.04 -0.31 -0.29 0.00 -1.06 0.00 0.00 56.10 54.49 1fr7 s TRP 123 Cb -0.09 -1.50 -0.06 0.00 -1.16 0.00 0.00 33.47 30.67 1fr7 s TRP 123 CO 0.02 0.14 1.91 1.21 -4.06 0.00 0.00 176.95 176.17 1fr7 s ASN 124 N -1.01 6.14 0.00 -2.66 3.84 0.11 -0.75 114.94 120.60 1fr7 s ASN 124 Ca 0.12 2.08 0.10 0.00 0.21 0.00 0.00 52.86 55.36 1fr7 s ASN 124 Cb -0.10 -2.53 0.50 0.00 -0.55 0.00 0.00 41.25 38.57 1fr7 s ASN 124 CO 0.02 -1.39 1.17 0.35 -2.79 0.00 0.00 177.10 174.46 1fr7 n THR 125 N 6.48 0.67 0.55 -5.21 -2.24 -0.30 -2.02 114.28 112.22 1fr7 n THR 125 Ca 0.22 0.17 0.12 0.00 -2.27 0.00 0.00 64.05 62.29 1fr7 n THR 125 Cb 0.44 -1.01 0.45 0.00 -2.10 0.00 0.00 70.33 68.11 1fr7 n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1fr7 n LYS 127 N -1.24 0.16 -0.12 -0.78 2.85 -1.26 -3.21 118.16 114.56 1fr7 n LYS 127 Ca 0.05 0.28 0.12 0.00 -1.05 0.00 0.00 58.31 57.71 1fr7 n LYS 127 Cb 0.07 -1.75 0.22 0.00 -0.65 0.00 0.00 35.03 32.92 1fr7 n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1fr7 n TYR 128 N -2.04 0.31 0.00 5.58 4.01 -0.86 -5.00 117.16 119.16 1fr7 n TYR 128 Ca 0.04 -0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1fr7 n TYR 128 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.32 1fr7 n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fr7 n GLY 129 N 1.41 1.70 3.67 2.72 0.00 -1.20 -4.53 105.19 108.96 1fr7 n GLY 129 Ca 0.18 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1fr7 n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fr7 s ASP 130 N 0.00 -0.29 0.19 1.61 -4.77 -1.26 -5.06 116.67 107.08 1fr7 s ASP 130 Ca 0.00 -0.51 -0.13 0.00 -3.30 0.00 0.00 52.55 48.61 1fr7 s ASP 130 Cb 0.00 0.65 0.19 0.00 -1.09 0.00 0.00 42.92 42.67 1fr7 s ASP 130 CO 0.00 -1.19 1.73 0.15 0.70 0.00 0.00 175.17 176.56 1fr7 h PHE 131 N 2.08 0.22 -0.82 2.11 3.57 -1.94 -1.70 116.94 120.47 1fr7 h PHE 131 Ca -0.25 0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.40 1fr7 h PHE 131 Cb 1.26 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.90 1fr7 h PHE 131 CO 0.37 0.03 0.43 0.78 -2.23 0.00 0.00 178.31 177.70 1fr7 h GLY 132 N 0.28 1.28 1.53 2.40 0.00 -1.97 -0.87 103.07 105.73 1fr7 h GLY 132 Ca 0.25 -0.27 -0.24 0.00 0.00 0.00 0.00 47.33 47.07 1fr7 h GLY 132 CO -0.30 0.04 -1.04 0.50 0.00 0.00 0.00 176.54 175.75 1fr7 h LYS 133 N 0.68 0.41 -0.66 4.80 1.79 -1.75 -3.31 116.57 118.53 1fr7 h LYS 133 Ca 0.42 -0.49 -0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1fr7 h LYS 133 Cb 0.49 0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.26 1fr7 h LYS 133 CO -0.30 1.16 0.40 0.00 -1.08 0.00 0.00 179.45 179.63 1fr7 h ALA 134 N 0.66 0.84 0.00 3.86 0.00 -0.62 -2.38 119.26 121.61 1fr7 h ALA 134 Ca -0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fr7 h ALA 134 Cb 1.69 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1fr7 h ALA 134 CO 0.18 0.32 0.01 1.55 0.00 0.00 0.00 179.25 181.31 1fr7 n VAL 135 N -4.57 1.18 0.29 0.00 3.14 -0.40 -1.13 118.33 116.84 1fr7 n VAL 135 Ca 0.05 0.70 0.09 0.00 -2.96 0.00 0.00 64.34 62.23 1fr7 n VAL 135 Cb 0.06 -1.70 0.26 0.00 -1.06 0.00 0.00 33.84 31.39 1fr7 n VAL 135 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1fr7 n GLN 136 N -2.13 2.29 -4.67 1.45 1.13 -0.90 -4.70 117.38 109.85 1fr7 n GLN 136 Ca -0.01 -1.99 -0.26 0.00 -1.94 0.00 0.00 57.00 52.80 1fr7 n GLN 136 Cb 0.04 -1.44 -0.14 0.00 0.11 0.00 0.00 30.24 28.80 1fr7 n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1fr7 s GLN 137 N -1.31 1.44 0.43 -1.09 -1.52 -0.28 -5.03 119.66 112.29 1fr7 s GLN 137 Ca 0.37 -0.98 0.15 0.00 -1.95 0.00 0.00 55.36 52.96 1fr7 s GLN 137 Cb 0.20 -1.58 1.04 0.00 -0.22 0.00 0.00 33.01 32.45 1fr7 s GLN 137 CO 0.26 0.40 1.93 -1.00 -0.25 0.00 0.00 175.29 176.63 1fr7 h PRO 138 N 4.82 0.41 -0.46 2.91 0.13 -1.86 -1.09 132.00 136.87 1fr7 h PRO 138 Ca -0.43 -0.02 -0.23 0.00 -0.87 0.00 0.00 66.00 64.45 1fr7 h PRO 138 Cb 1.16 -0.09 -0.13 0.00 0.13 0.00 0.00 31.00 32.06 1fr7 h PRO 138 CO 0.44 0.27 0.04 -0.40 -0.23 0.00 0.00 178.00 178.12 1fr7 n ASP 139 N -4.48 2.78 0.02 1.44 5.75 -1.26 -4.05 116.55 116.75 1fr7 n ASP 139 Ca 0.14 -3.71 -0.13 0.00 -0.01 0.00 0.00 54.79 51.08 1fr7 n ASP 139 Cb 0.50 -0.67 -0.02 0.00 -1.03 0.00 0.00 41.12 39.91 1fr7 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1fr7 h GLY 140 N 1.07 0.64 -3.09 6.12 0.00 -1.21 -3.42 103.07 103.18 1fr7 h GLY 140 Ca 0.28 -0.91 -0.61 0.00 0.00 0.00 0.00 47.33 46.09 1fr7 h GLY 140 CO 0.50 0.81 -0.80 1.08 0.00 0.00 0.00 176.54 178.13 1fr7 s LEU 141 N -8.15 2.46 -0.11 3.11 1.43 -0.03 0.07 118.68 117.46 1fr7 s LEU 141 Ca -0.08 -0.89 -0.01 0.00 -1.03 0.00 0.00 54.13 52.13 1fr7 s LEU 141 Cb 0.10 -1.05 0.03 0.00 0.03 0.00 0.00 46.19 45.29 1fr7 s LEU 141 CO 0.87 0.06 -0.05 0.00 0.23 0.00 0.00 176.35 177.47 1fr7 s ALA 142 N -1.90 1.15 -0.13 4.21 0.00 -0.10 -1.34 121.76 123.64 1fr7 s ALA 142 Ca 0.20 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.72 1fr7 s ALA 142 Cb -0.07 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1fr7 s ALA 142 CO 0.09 -0.50 -0.21 0.08 0.00 0.00 0.00 175.76 175.23 1fr7 s VAL 143 N 1.78 2.24 -0.20 0.00 1.01 -0.90 -1.24 120.40 123.10 1fr7 s VAL 143 Ca 0.04 -0.93 -0.16 0.00 0.00 0.00 0.00 61.98 60.93 1fr7 s VAL 143 Cb -0.13 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 1fr7 s VAL 143 CO -0.07 0.54 0.42 -0.22 0.00 0.00 0.00 175.10 175.77 1fr7 s LEU 144 N 0.68 4.15 -0.14 3.92 2.96 -0.55 -1.56 118.68 128.14 1fr7 s LEU 144 Ca -0.10 0.54 -0.04 0.00 -0.22 0.00 0.00 54.13 54.32 1fr7 s LEU 144 Cb -0.16 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.95 1fr7 s LEU 144 CO 0.01 -0.10 -0.01 -0.83 -1.32 0.00 0.00 176.35 174.10 1fr7 s GLY 145 N 1.09 1.78 -0.11 7.98 0.00 0.25 -1.20 107.32 117.10 1fr7 s GLY 145 Ca 0.20 -0.80 0.01 0.00 0.00 0.00 0.00 44.72 44.12 1fr7 s GLY 145 CO 0.08 -0.17 -0.11 -0.42 0.00 0.00 0.00 173.10 172.48 1fr7 s ILE 146 N 0.07 1.24 0.36 0.90 1.01 -0.00 -1.21 121.20 123.57 1fr7 s ILE 146 Ca 0.01 -0.46 -0.24 0.00 0.00 0.00 0.00 60.65 59.96 1fr7 s ILE 146 Cb -0.13 -1.19 -0.10 0.00 0.01 0.00 0.00 42.46 41.05 1fr7 s ILE 146 CO 0.02 0.40 0.96 -0.36 0.00 0.00 0.00 174.94 175.95 1fr7 s PHE 147 N 1.33 3.53 -0.05 3.97 0.08 -1.26 -0.18 117.98 125.40 1fr7 s PHE 147 Ca -0.01 1.72 0.06 0.00 0.12 0.00 0.00 56.93 58.82 1fr7 s PHE 147 Cb -0.14 -2.92 -0.01 0.00 -0.57 0.00 0.00 43.02 39.39 1fr7 s PHE 147 CO -0.05 0.03 -0.24 -0.51 -0.10 0.00 0.00 175.22 174.35 1fr7 s LEU 148 N -2.47 2.05 0.17 -0.37 1.02 -0.44 -0.96 118.68 117.68 1fr7 s LEU 148 Ca 0.55 -0.48 0.07 0.00 0.02 0.00 0.00 54.13 54.28 1fr7 s LEU 148 Cb -0.16 -1.31 -0.04 0.00 0.02 0.00 0.00 46.19 44.70 1fr7 s LEU 148 CO 0.21 0.24 -0.14 -1.59 0.02 0.00 0.00 176.35 175.08 1fr7 s LYS 149 N -0.17 1.22 0.02 1.70 -2.85 -0.50 -1.74 119.74 117.42 1fr7 s LYS 149 Ca -0.03 -1.47 -0.25 0.00 -1.00 0.00 0.00 55.97 53.22 1fr7 s LYS 149 Cb -0.13 -1.04 -0.05 0.00 -2.06 0.00 0.00 37.83 34.55 1fr7 s LYS 149 CO 0.03 0.18 0.78 0.54 0.10 0.00 0.00 175.35 176.98 1fr7 s VAL 150 N -2.69 4.81 0.00 1.79 0.11 -1.26 -1.52 120.40 121.64 1fr7 s VAL 150 Ca 0.18 1.65 0.00 0.00 -2.93 0.00 0.00 61.98 60.87 1fr7 s VAL 150 Cb -0.02 -4.13 0.00 0.00 -1.53 0.00 0.00 36.38 30.70 1fr7 s VAL 150 CO 0.05 0.32 0.00 0.61 -3.33 0.00 0.00 175.10 172.75 1fr7 n GLY 151 N 2.60 -0.02 3.77 6.54 0.00 0.41 -4.86 105.19 113.63 1fr7 n GLY 151 Ca -0.01 0.52 -0.37 0.00 0.00 0.00 0.00 46.02 46.15 1fr7 n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fr7 s SER 152 N 2.00 6.41 0.65 1.61 0.01 -1.26 -3.87 113.70 119.25 1fr7 s SER 152 Ca 0.00 2.25 -0.17 0.00 1.31 0.00 0.00 55.95 59.34 1fr7 s SER 152 Cb 0.00 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.62 1fr7 s SER 152 CO 0.00 -0.74 1.20 0.00 0.41 0.00 0.00 173.24 174.10 1fr7 s ALA 153 N -1.54 2.38 -0.29 1.44 0.00 -1.26 -2.47 121.76 120.02 1fr7 s ALA 153 Ca 0.60 0.91 -0.07 0.00 0.00 0.00 0.00 51.96 53.41 1fr7 s ALA 153 Cb -0.27 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1fr7 s ALA 153 CO 0.34 -1.44 0.07 0.21 0.00 0.00 0.00 175.76 174.93 1fr7 s LYS 154 N -3.63 3.16 0.16 0.00 2.47 -1.25 -4.78 119.74 115.85 1fr7 s LYS 154 Ca 0.75 -0.81 -0.16 0.00 -1.56 0.00 0.00 55.97 54.19 1fr7 s LYS 154 Cb -0.29 -3.34 0.07 0.00 -1.46 0.00 0.00 37.83 32.81 1fr7 s LYS 154 CO 0.39 -0.40 1.74 -1.35 0.16 0.00 0.00 175.35 175.88 1fr7 h PRO 155 N 8.22 0.23 0.00 4.03 0.11 -1.92 -2.22 132.00 140.46 1fr7 h PRO 155 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1fr7 h PRO 155 Cb 1.13 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1fr7 h PRO 155 CO 0.60 0.15 0.01 0.41 -0.21 0.00 0.00 178.00 178.96 1fr7 n GLY 156 N -1.22 -0.10 0.00 -0.55 0.00 -1.26 -1.32 105.19 100.74 1fr7 n GLY 156 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 1fr7 n GLY 156 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fr7 n LEU 157 N -1.07 0.06 -0.27 0.99 4.77 -0.85 -4.73 117.00 115.91 1fr7 n LEU 157 Ca 0.00 -0.19 -0.02 0.00 -0.03 0.00 0.00 56.01 55.77 1fr7 n LEU 157 Cb 0.01 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.26 1fr7 n LEU 157 CO 0.00 0.02 1.19 -0.61 -1.33 0.00 0.00 177.39 176.65 1fr7 h GLN 158 N 0.00 1.12 -0.21 3.23 5.75 -1.07 -1.39 115.11 122.54 1fr7 h GLN 158 Ca 0.00 -0.11 -0.04 0.00 -0.15 0.00 0.00 58.65 58.35 1fr7 h GLN 158 Cb 0.13 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 1fr7 h GLN 158 CO 0.00 0.80 -0.06 0.87 -2.65 0.00 0.00 178.83 177.79 1fr7 h LYS 159 N 1.13 0.33 0.01 1.69 1.57 -1.85 -1.98 116.57 117.46 1fr7 h LYS 159 Ca 0.29 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.92 1fr7 h LYS 159 Cb -0.01 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.26 1fr7 h LYS 159 CO -0.05 0.40 -0.33 0.28 -0.57 0.00 0.00 179.45 179.19 1fr7 h VAL 160 N 0.31 1.55 -0.81 0.50 2.07 -1.78 -3.28 116.25 114.81 1fr7 h VAL 160 Ca 0.07 -2.05 0.15 0.00 0.82 0.00 0.00 66.70 65.69 1fr7 h VAL 160 Cb 0.31 2.84 -0.06 0.00 -1.52 0.00 0.00 31.29 32.86 1fr7 h VAL 160 CO 0.01 0.56 0.54 0.58 0.02 0.00 0.00 177.57 179.28 1fr7 h VAL 161 N -0.48 0.80 0.00 2.57 2.07 -1.03 -1.21 116.25 118.97 1fr7 h VAL 161 Ca -0.04 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1fr7 h VAL 161 Cb 1.10 0.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1fr7 h VAL 161 CO 0.06 0.09 -0.13 0.44 0.02 0.00 0.00 177.57 178.05 1fr7 h ASP 162 N 0.52 0.00 -0.20 0.57 3.32 -1.42 -3.13 116.42 116.07 1fr7 h ASP 162 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1fr7 h ASP 162 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1fr7 h ASP 162 CO -0.15 0.13 0.00 1.33 -1.72 0.00 0.00 179.24 178.83 1fr7 n VAL 163 N -3.52 1.43 0.24 -1.35 0.24 -0.48 -4.66 118.33 110.24 1fr7 n VAL 163 Ca -0.01 -1.38 0.10 0.00 -2.04 0.00 0.00 64.34 61.00 1fr7 n VAL 163 Cb 0.28 0.22 0.67 0.00 -1.47 0.00 0.00 33.84 33.54 1fr7 n VAL 163 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1fr7 h LEU 164 N 1.24 0.00 -2.56 1.34 3.38 -1.44 -0.95 115.31 116.32 1fr7 h LEU 164 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1fr7 h LEU 164 Cb 0.89 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 1fr7 h LEU 164 CO 0.06 0.00 0.02 0.44 0.09 0.00 0.00 178.44 179.04 1fr7 h ASP 165 N 0.00 0.00 0.89 -0.43 3.32 -1.84 -0.99 116.42 117.38 1fr7 h ASP 165 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1fr7 h ASP 165 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1fr7 h ASP 165 CO -0.00 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 175.98 1fr7 n SER 166 N -3.68 0.16 -1.77 6.45 3.41 -0.36 -3.24 113.62 114.59 1fr7 n SER 166 Ca -0.03 0.52 -0.02 0.00 -0.26 0.00 0.00 58.87 59.09 1fr7 n SER 166 Cb 0.10 -0.56 0.07 0.00 -0.26 0.00 0.00 64.21 63.55 1fr7 n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1fr7 n ILE 167 N -1.66 1.28 -0.35 -1.33 -5.35 -0.39 -4.55 119.36 107.01 1fr7 n ILE 167 Ca 0.05 -2.60 0.05 0.00 -0.27 0.00 0.00 62.75 59.98 1fr7 n ILE 167 Cb 0.29 0.43 0.21 0.00 -1.74 0.00 0.00 39.64 38.83 1fr7 n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1fr7 h LYS 168 N 1.66 0.96 -6.20 6.28 3.64 -1.48 -3.41 116.57 118.01 1fr7 h LYS 168 Ca -0.05 -0.06 -0.55 0.00 -1.27 0.00 0.00 60.65 58.72 1fr7 h LYS 168 Cb 1.47 -0.22 -0.09 0.00 -0.41 0.00 0.00 32.23 32.98 1fr7 h LYS 168 CO 0.22 0.63 -0.63 0.95 -2.27 0.00 0.00 179.45 178.35 1fr7 s THR 169 N -6.00 3.51 0.38 1.00 -4.23 -1.26 0.50 115.64 109.54 1fr7 s THR 169 Ca -0.12 -1.87 -0.28 0.00 -1.18 0.00 0.00 61.69 58.23 1fr7 s THR 169 Cb 0.21 -2.89 -0.11 0.00 1.34 0.00 0.00 72.50 71.05 1fr7 s THR 169 CO 0.80 -0.37 1.47 2.29 -0.54 0.00 0.00 174.62 178.27 1fr7 n LYS 170 N -0.92 2.61 -0.05 3.99 2.85 -0.50 -2.45 118.16 123.70 1fr7 n LYS 170 Ca -0.06 0.92 0.00 0.00 -1.05 0.00 0.00 58.31 58.11 1fr7 n LYS 170 Cb 0.59 -2.63 0.00 0.00 -0.65 0.00 0.00 35.03 32.33 1fr7 n LYS 170 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1fr7 n GLY 171 N 0.48 0.57 3.87 2.58 0.00 0.40 -4.60 105.19 108.49 1fr7 n GLY 171 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1fr7 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fr7 s LYS 172 N -0.81 3.83 0.07 1.61 -0.14 -1.03 -4.95 119.74 118.32 1fr7 s LYS 172 Ca 0.00 0.30 -0.12 0.00 -1.36 0.00 0.00 55.97 54.79 1fr7 s LYS 172 Cb 0.00 -2.71 0.02 0.00 -1.68 0.00 0.00 37.83 33.45 1fr7 s LYS 172 CO 0.00 0.36 0.28 -1.54 -0.76 0.00 0.00 175.35 173.69 1fr7 s SER 173 N -2.23 -0.07 -0.08 2.83 1.04 -1.26 -1.06 113.70 112.88 1fr7 s SER 173 Ca 0.45 -0.35 -0.07 0.00 0.48 0.00 0.00 55.95 56.46 1fr7 s SER 173 Cb -0.12 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.39 1fr7 s SER 173 CO 0.21 -0.68 0.20 0.00 0.98 0.00 0.00 173.24 173.94 1fr7 s ALA 174 N -3.13 -0.49 0.27 5.32 0.00 0.19 -4.90 121.76 119.03 1fr7 s ALA 174 Ca -0.01 0.59 -0.30 0.00 0.00 0.00 0.00 51.96 52.24 1fr7 s ALA 174 Cb 0.01 -0.35 -0.10 0.00 0.00 0.00 0.00 23.12 22.68 1fr7 s ALA 174 CO -0.07 -0.10 1.45 -0.51 0.00 0.00 0.00 175.76 176.53 1fr7 s ASP 175 N 0.20 6.61 -0.30 0.00 1.01 -1.26 -0.50 116.67 122.43 1fr7 s ASP 175 Ca -0.01 2.72 0.04 0.00 0.71 0.00 0.00 52.55 56.01 1fr7 s ASP 175 Cb -0.02 -2.63 0.17 0.00 1.01 0.00 0.00 42.92 41.45 1fr7 s ASP 175 CO -0.00 -0.72 0.48 0.12 0.21 0.00 0.00 175.17 175.25 1fr7 s PHE 176 N -0.15 -1.30 -2.56 4.23 5.36 -0.48 -4.79 117.98 118.29 1fr7 s PHE 176 Ca 0.59 0.51 0.25 0.00 -0.96 0.00 0.00 56.93 57.32 1fr7 s PHE 176 Cb -0.43 0.01 0.52 0.00 -0.34 0.00 0.00 43.02 42.78 1fr7 s PHE 176 CO 0.46 -1.03 1.43 0.25 -1.46 0.00 0.00 175.22 174.87 1fr7 n THR 177 N 5.27 0.00 -1.73 0.12 -2.24 -1.26 -3.25 114.28 111.19 1fr7 n THR 177 Ca 0.03 -0.34 -0.08 0.00 -2.27 0.00 0.00 64.05 61.39 1fr7 n THR 177 Cb 0.51 1.01 0.14 0.00 -2.10 0.00 0.00 70.33 69.88 1fr7 n THR 177 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1fr7 n ASN 178 N 0.54 3.17 -4.42 3.42 6.94 -1.26 -4.29 115.26 119.35 1fr7 n ASN 178 Ca 0.15 -3.83 -0.44 0.00 -0.02 0.00 0.00 54.58 50.44 1fr7 n ASN 178 Cb 0.47 -0.49 -0.04 0.00 -2.36 0.00 0.00 39.78 37.36 1fr7 n ASN 178 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 1fr7 s PHE 179 N -3.39 2.79 -0.41 -2.53 5.36 -1.26 -5.00 117.98 113.54 1fr7 s PHE 179 Ca 0.45 -0.71 -0.21 0.00 -0.96 0.00 0.00 56.93 55.49 1fr7 s PHE 179 Cb 0.39 -4.19 0.02 0.00 -0.34 0.00 0.00 43.02 38.90 1fr7 s PHE 179 CO -0.02 -1.52 0.67 0.34 -1.46 0.00 0.00 175.22 173.23 1fr7 s ASP 180 N 3.66 6.38 0.63 6.13 -1.08 -1.26 -4.34 116.67 126.79 1fr7 s ASP 180 Ca 0.18 -0.12 0.40 0.00 -0.52 0.00 0.00 52.55 52.49 1fr7 s ASP 180 Cb -0.19 -2.34 2.08 0.00 -1.46 0.00 0.00 42.92 41.01 1fr7 s ASP 180 CO 0.08 -0.75 2.26 1.55 0.52 0.00 0.00 175.17 178.83 1fr7 h PRO 181 N 8.76 0.00 0.00 4.34 0.13 -1.94 -1.80 132.00 141.48 1fr7 h PRO 181 Ca -0.26 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 1fr7 h PRO 181 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1fr7 h PRO 181 CO 0.89 0.01 -0.14 0.00 -0.23 0.00 0.00 178.00 178.53 1fr7 h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.92 -2.00 114.38 114.41 1fr7 h ARG 182 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1fr7 h ARG 182 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1fr7 h ARG 182 CO 0.00 0.14 0.00 0.41 -1.07 0.00 0.00 179.97 179.45 1fr7 n GLY 183 N -1.06 -0.92 0.33 0.04 0.00 -0.68 -2.81 105.19 100.09 1fr7 n GLY 183 Ca -0.02 -0.11 0.04 0.00 0.00 0.00 0.00 46.02 45.92 1fr7 n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fr7 n LEU 184 N -0.80 1.80 -4.83 0.99 7.99 -0.75 -4.40 117.00 117.00 1fr7 n LEU 184 Ca 0.13 -1.16 -0.37 0.00 -0.01 0.00 0.00 56.01 54.60 1fr7 n LEU 184 Cb 0.06 -0.03 -0.06 0.00 -0.11 0.00 0.00 43.42 43.29 1fr7 n LEU 184 CO 0.10 0.38 0.21 -0.76 -1.51 0.00 0.00 177.39 175.81 1fr7 s LEU 185 N -0.70 4.43 0.99 2.23 1.43 -1.12 -4.90 118.68 121.03 1fr7 s LEU 185 Ca 0.10 1.09 -0.16 0.00 -1.03 0.00 0.00 54.13 54.13 1fr7 s LEU 185 Cb 0.07 -2.97 0.20 0.00 0.03 0.00 0.00 46.19 43.52 1fr7 s LEU 185 CO 0.10 0.21 1.27 -2.16 0.23 0.00 0.00 176.35 176.00 1fr7 s PRO 186 N -1.48 0.47 0.09 1.29 0.04 -1.26 -4.98 135.00 129.17 1fr7 s PRO 186 Ca 0.31 -0.29 -0.18 0.00 0.04 0.00 0.00 61.00 60.89 1fr7 s PRO 186 Cb -0.17 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.49 1fr7 s PRO 186 CO 0.18 -2.55 1.56 0.93 0.04 0.00 0.00 177.00 177.16 1fr7 h GLU 187 N -1.74 0.46 -6.22 4.56 5.08 -1.91 -3.44 114.58 111.37 1fr7 h GLU 187 Ca -0.45 -0.13 -0.57 0.00 -1.00 0.00 0.00 59.36 57.21 1fr7 h GLU 187 Cb 1.26 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 1fr7 h GLU 187 CO 0.41 0.59 -0.19 0.45 -1.00 0.00 0.00 179.01 179.27 1fr7 s SER 188 N -5.90 6.68 -0.08 1.42 0.15 -1.26 -4.99 113.70 109.72 1fr7 s SER 188 Ca -0.14 0.88 0.17 0.00 0.70 0.00 0.00 55.95 57.56 1fr7 s SER 188 Cb 0.08 -2.21 0.58 0.00 -1.71 0.00 0.00 66.02 62.76 1fr7 s SER 188 CO 0.75 0.11 1.50 0.18 1.20 0.00 0.00 173.24 176.98 1fr7 n LEU 189 N 0.69 4.10 -4.70 3.45 4.77 -1.26 -4.71 117.00 119.34 1fr7 n LEU 189 Ca -0.06 -2.38 -0.43 0.00 -0.03 0.00 0.00 56.01 53.11 1fr7 n LEU 189 Cb 0.52 -0.48 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1fr7 n LEU 189 CO 0.43 0.79 1.01 0.47 -1.33 0.00 0.00 177.39 178.76 1fr7 n ASP 190 N 0.78 2.98 -3.88 -1.43 8.00 -1.26 -4.89 116.55 116.85 1fr7 n ASP 190 Ca 0.22 1.17 -0.10 0.00 0.71 0.00 0.00 54.79 56.79 1fr7 n ASP 190 Cb 0.75 -1.49 -0.05 0.00 -0.02 0.00 0.00 41.12 40.31 1fr7 n ASP 190 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1fr7 s TYR 191 N -0.54 0.49 0.07 1.24 -0.85 -1.26 -1.00 117.35 115.50 1fr7 s TYR 191 Ca 0.61 -0.83 0.10 0.00 -0.52 0.00 0.00 57.07 56.43 1fr7 s TYR 191 Cb -0.58 0.14 -0.03 0.00 0.38 0.00 0.00 41.96 41.86 1fr7 s TYR 191 CO 0.55 -1.01 -0.27 -1.58 -1.52 0.00 0.00 175.55 171.73 1fr7 s TRP 192 N -3.85 2.31 0.02 -3.49 0.51 -0.33 -0.78 118.94 113.32 1fr7 s TRP 192 Ca 0.24 -0.40 0.01 0.00 -2.12 0.00 0.00 56.10 53.82 1fr7 s TRP 192 Cb -0.00 -1.34 -0.01 0.00 -0.81 0.00 0.00 33.47 31.30 1fr7 s TRP 192 CO 0.11 0.20 -0.03 -0.08 -0.51 0.00 0.00 176.95 176.63 1fr7 s THR 193 N -0.89 0.18 -0.02 2.01 -1.32 0.51 -0.85 115.64 115.26 1fr7 s THR 193 Ca 0.12 -0.66 -0.28 0.00 -1.21 0.00 0.00 61.69 59.66 1fr7 s THR 193 Cb -0.10 -0.26 0.09 0.00 -1.51 0.00 0.00 72.50 70.72 1fr7 s THR 193 CO 0.03 -0.31 0.78 -0.72 -2.21 0.00 0.00 174.62 172.20 1fr7 s TYR 194 N -0.97 -0.49 -0.03 9.09 1.13 -1.05 -1.21 117.35 123.82 1fr7 s TYR 194 Ca -0.10 0.62 -0.30 0.00 -1.41 0.00 0.00 57.07 55.88 1fr7 s TYR 194 Cb -0.07 0.48 -0.03 0.00 -1.10 0.00 0.00 41.96 41.25 1fr7 s TYR 194 CO -0.00 -0.59 1.08 -1.25 -2.51 0.00 0.00 175.55 172.27 1fr7 s PRO 195 N -2.22 4.45 0.00 -3.49 0.04 -1.26 -1.48 135.00 131.04 1fr7 s PRO 195 Ca -0.02 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.55 1fr7 s PRO 195 Cb -0.01 -3.48 0.00 0.00 0.04 0.00 0.00 34.50 31.05 1fr7 s PRO 195 CO -0.02 -0.25 0.00 0.41 0.04 0.00 0.00 177.00 177.18 1fr7 n GLY 196 N 3.12 4.80 3.30 0.56 0.00 0.11 -4.81 105.19 112.25 1fr7 n GLY 196 Ca 0.08 -0.86 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 1fr7 n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fr7 s SER 197 N 1.34 1.83 0.44 1.61 1.04 -1.11 -2.25 113.70 116.60 1fr7 s SER 197 Ca 0.00 -1.79 -0.23 0.00 0.48 0.00 0.00 55.95 54.41 1fr7 s SER 197 Cb 0.00 0.57 -0.08 0.00 0.10 0.00 0.00 66.02 66.61 1fr7 s SER 197 CO 0.00 -1.08 1.11 -0.76 0.98 0.00 0.00 173.24 173.49 1fr7 s LEU 198 N -3.40 4.04 0.00 2.42 1.43 -0.55 -4.48 118.68 118.15 1fr7 s LEU 198 Ca 0.40 2.16 0.18 0.00 -1.03 0.00 0.00 54.13 55.84 1fr7 s LEU 198 Cb 0.02 -4.25 0.50 0.00 0.03 0.00 0.00 46.19 42.49 1fr7 s LEU 198 CO 0.29 -0.74 1.41 0.35 0.23 0.00 0.00 176.35 177.89 1fr7 n THR 199 N -0.38 0.68 -4.09 5.49 -2.24 -1.26 -4.39 114.28 108.09 1fr7 n THR 199 Ca 0.07 -0.71 -0.12 0.00 -2.27 0.00 0.00 64.05 61.02 1fr7 n THR 199 Cb 0.49 0.42 -0.11 0.00 -2.10 0.00 0.00 70.33 69.03 1fr7 n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1fr7 s THR 200 N -1.32 0.58 0.53 4.28 -4.23 -1.26 -4.71 115.64 109.50 1fr7 s THR 200 Ca 0.37 -1.30 -0.20 0.00 -1.18 0.00 0.00 61.69 59.38 1fr7 s THR 200 Cb 0.19 -0.88 -0.09 0.00 1.34 0.00 0.00 72.50 73.06 1fr7 s THR 200 CO 0.26 -0.50 0.65 -2.65 -0.54 0.00 0.00 174.62 171.83 1fr7 n PRO 201 N 1.08 0.69 0.00 3.99 -0.02 -1.26 -0.35 135.00 139.13 1fr7 n PRO 201 Ca -0.20 0.26 0.06 0.00 -2.02 0.00 0.00 63.50 61.60 1fr7 n PRO 201 Cb 0.56 -1.77 0.34 0.00 -0.02 0.00 0.00 33.50 32.61 1fr7 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1fr7 n PRO 202 N -0.04 0.47 -2.27 0.52 -0.04 -1.26 -4.98 135.00 127.40 1fr7 n PRO 202 Ca 0.12 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.42 1fr7 n PRO 202 Cb 0.45 -1.39 -0.02 0.00 -0.04 0.00 0.00 33.50 32.50 1fr7 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1fr7 n LEU 203 N -0.89 -1.40 -4.75 1.53 4.77 0.53 -4.89 117.00 111.90 1fr7 n LEU 203 Ca 0.09 0.16 -0.42 0.00 -0.03 0.00 0.00 56.01 55.81 1fr7 n LEU 203 Cb 0.04 -2.42 -0.01 0.00 -2.33 0.00 0.00 43.42 38.69 1fr7 n LEU 203 CO 0.07 -0.27 1.22 0.18 -1.33 0.00 0.00 177.39 177.25 1fr7 n LEU 204 N -2.75 4.38 -3.83 2.23 4.77 -1.26 -4.37 117.00 116.17 1fr7 n LEU 204 Ca -0.18 1.16 -0.42 0.00 -0.03 0.00 0.00 56.01 56.54 1fr7 n LEU 204 Cb 0.62 -1.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 1fr7 n LEU 204 CO 0.22 0.13 2.10 -0.62 -1.33 0.00 0.00 177.39 177.89 1fr7 n GLU 205 N 1.87 3.48 -0.18 3.23 1.02 -1.26 -1.48 120.64 127.32 1fr7 n GLU 205 Ca 0.07 -3.35 0.06 0.00 -0.02 0.00 0.00 57.16 53.93 1fr7 n GLU 205 Cb 0.37 -2.99 0.08 0.00 -0.02 0.00 0.00 31.44 28.88 1fr7 n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fr7 s VAL 207 N -1.80 3.03 -0.39 0.00 1.01 -0.95 -0.85 120.40 120.45 1fr7 s VAL 207 Ca 0.19 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 1fr7 s VAL 207 Cb 0.17 -2.23 0.02 0.00 0.00 0.00 0.00 36.38 34.34 1fr7 s VAL 207 CO 0.02 0.56 0.27 -0.89 0.00 0.00 0.00 175.10 175.05 1fr7 s THR 208 N -0.16 5.08 0.02 3.92 2.01 -0.45 0.04 115.64 126.10 1fr7 s THR 208 Ca -0.01 -0.65 -0.23 0.00 0.31 0.00 0.00 61.69 61.12 1fr7 s THR 208 Cb -0.13 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.52 1fr7 s THR 208 CO 0.03 -0.25 0.68 0.26 -0.69 0.00 0.00 174.62 174.65 1fr7 s TRP 209 N 1.65 3.71 -0.30 4.92 0.52 -0.55 -2.13 118.94 126.77 1fr7 s TRP 209 Ca 0.04 1.33 0.00 0.00 0.02 0.00 0.00 56.10 57.50 1fr7 s TRP 209 Cb -0.19 -2.71 0.09 0.00 -1.15 0.00 0.00 33.47 29.51 1fr7 s TRP 209 CO 0.09 0.32 0.06 0.42 0.02 0.00 0.00 176.95 177.86 1fr7 s ILE 210 N -0.15 1.18 -0.29 2.03 1.01 -0.60 -2.52 121.20 121.87 1fr7 s ILE 210 Ca 0.35 -1.47 -0.09 0.00 0.00 0.00 0.00 60.65 59.43 1fr7 s ILE 210 Cb -0.19 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 1fr7 s ILE 210 CO 0.20 -0.55 0.13 -0.69 0.00 0.00 0.00 174.94 174.03 1fr7 s VAL 211 N 1.48 4.60 0.25 2.92 1.01 -0.03 -0.58 120.40 130.06 1fr7 s VAL 211 Ca 0.07 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 1fr7 s VAL 211 Cb -0.18 -3.28 -0.09 0.00 0.00 0.00 0.00 36.38 32.83 1fr7 s VAL 211 CO -0.18 0.16 1.24 -0.76 0.00 0.00 0.00 175.10 175.56 1fr7 s LEU 212 N 1.63 4.46 0.15 3.92 1.43 -0.35 -1.19 118.68 128.72 1fr7 s LEU 212 Ca 0.05 2.42 -0.08 0.00 -1.03 0.00 0.00 54.13 55.49 1fr7 s LEU 212 Cb -0.16 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.41 1fr7 s LEU 212 CO 0.06 -0.41 1.42 0.50 0.23 0.00 0.00 176.35 178.15 1fr7 h LYS 213 N 4.46 0.73 -5.67 1.70 3.64 -1.40 -3.43 116.57 116.61 1fr7 h LYS 213 Ca -0.46 -0.49 -0.60 0.00 -1.27 0.00 0.00 60.65 57.83 1fr7 h LYS 213 Cb 1.22 0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 33.01 1fr7 h LYS 213 CO 0.71 1.11 0.28 -2.00 -2.27 0.00 0.00 179.45 177.29 1fr7 s GLU 214 N -3.99 4.17 0.68 1.90 2.12 -1.26 -5.01 118.70 117.31 1fr7 s GLU 214 Ca -0.09 0.74 -0.11 0.00 0.36 0.00 0.00 54.97 55.86 1fr7 s GLU 214 Cb 0.10 -3.63 -0.00 0.00 0.26 0.00 0.00 34.13 30.86 1fr7 s GLU 214 CO 0.87 -0.42 1.07 -1.25 -0.54 0.00 0.00 175.26 175.00 1fr7 s PRO 215 N 2.50 3.05 0.26 4.30 0.04 -1.26 -4.66 135.00 139.23 1fr7 s PRO 215 Ca 0.31 0.63 0.07 0.00 0.04 0.00 0.00 61.00 62.05 1fr7 s PRO 215 Cb -0.16 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 1fr7 s PRO 215 CO 0.09 -0.94 0.22 0.96 0.04 0.00 0.00 177.00 177.37 1fr7 s ILE 216 N -3.24 4.45 -0.06 0.56 -4.36 -0.13 -4.88 121.20 113.54 1fr7 s ILE 216 Ca 0.57 -1.36 -0.02 0.00 -0.26 0.00 0.00 60.65 59.59 1fr7 s ILE 216 Cb -0.12 -3.43 -0.04 0.00 1.25 0.00 0.00 42.46 40.13 1fr7 s ILE 216 CO 0.53 -0.33 0.05 -0.44 0.24 0.00 0.00 174.94 174.99 1fr7 s SER 217 N -3.87 5.54 0.05 4.36 0.01 -1.26 -1.41 113.70 117.11 1fr7 s SER 217 Ca 0.34 0.18 0.02 0.00 1.31 0.00 0.00 55.95 57.80 1fr7 s SER 217 Cb -0.08 -1.60 -0.03 0.00 0.21 0.00 0.00 66.02 64.53 1fr7 s SER 217 CO 0.26 0.34 -0.07 0.68 0.41 0.00 0.00 173.24 174.86 1fr7 s VAL 218 N -1.02 0.48 0.64 3.43 -7.23 -0.58 -3.83 120.40 112.29 1fr7 s VAL 218 Ca 0.17 -1.18 -0.11 0.00 -1.81 0.00 0.00 61.98 59.05 1fr7 s VAL 218 Cb -0.12 -0.71 -0.03 0.00 0.56 0.00 0.00 36.38 36.09 1fr7 s VAL 218 CO 0.07 -0.48 1.04 -0.94 -0.31 0.00 0.00 175.10 174.48 1fr7 s SER 219 N -1.77 5.98 0.43 4.85 1.04 -1.19 -0.44 113.70 122.59 1fr7 s SER 219 Ca -0.08 1.46 0.10 0.00 0.48 0.00 0.00 55.95 57.91 1fr7 s SER 219 Cb -0.08 -2.46 0.94 0.00 0.10 0.00 0.00 66.02 64.52 1fr7 s SER 219 CO -0.01 -1.04 2.05 0.77 0.98 0.00 0.00 173.24 175.99 1fr7 h SER 220 N -0.44 0.31 -0.18 7.02 4.64 -1.94 -1.14 113.55 121.82 1fr7 h SER 220 Ca -0.44 -0.02 -0.12 0.00 -0.47 0.00 0.00 61.79 60.74 1fr7 h SER 220 Cb 1.20 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1fr7 h SER 220 CO 0.61 0.27 -0.28 -0.08 -0.87 0.00 0.00 176.83 176.48 1fr7 h GLU 221 N 0.36 0.66 -0.23 4.77 4.81 -1.95 0.10 114.58 123.10 1fr7 h GLU 221 Ca 0.09 -0.28 -0.19 0.00 -0.13 0.00 0.00 59.36 58.85 1fr7 h GLU 221 Cb 0.05 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1fr7 h GLU 221 CO -0.01 0.87 -0.62 1.96 -0.73 0.00 0.00 179.01 180.48 1fr7 h GLN 222 N 0.57 0.78 -0.21 1.92 4.20 -1.71 -2.66 115.11 118.00 1fr7 h GLN 222 Ca 0.07 -0.53 -0.02 0.00 0.06 0.00 0.00 58.65 58.24 1fr7 h GLN 222 Cb 0.77 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 1fr7 h GLN 222 CO 0.06 1.16 0.07 0.28 -0.67 0.00 0.00 178.83 179.73 1fr7 h VAL 223 N 0.58 1.18 -0.94 -0.54 2.07 -1.07 -2.76 116.25 114.77 1fr7 h VAL 223 Ca -0.01 -0.57 0.08 0.00 0.82 0.00 0.00 66.70 67.03 1fr7 h VAL 223 Cb 1.22 1.16 -0.07 0.00 -1.52 0.00 0.00 31.29 32.08 1fr7 h VAL 223 CO 0.13 0.18 0.61 -0.07 0.02 0.00 0.00 177.57 178.44 1fr7 h LEU 224 N 0.18 0.92 -0.53 2.57 3.38 -0.96 -1.27 115.31 119.60 1fr7 h LEU 224 Ca 0.07 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 1fr7 h LEU 224 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1fr7 h LEU 224 CO -0.00 0.56 0.10 0.50 0.09 0.00 0.00 178.44 179.69 1fr7 h LYS 225 N 1.03 0.86 -0.08 1.13 1.63 -1.30 -2.51 116.57 117.33 1fr7 h LYS 225 Ca 0.42 -0.22 -0.08 0.00 -0.85 0.00 0.00 60.65 59.92 1fr7 h LYS 225 Cb 0.28 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.80 1fr7 h LYS 225 CO -0.18 0.84 -0.32 0.74 -3.45 0.00 0.00 179.45 177.08 1fr7 h PHE 226 N 0.75 0.16 0.00 1.91 -1.00 -1.09 -2.15 116.94 115.52 1fr7 h PHE 226 Ca 0.16 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.91 1fr7 h PHE 226 Cb 0.38 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 39.90 1fr7 h PHE 226 CO 0.03 0.45 0.00 0.54 -1.61 0.00 0.00 178.31 177.72 1fr7 n ARG 227 N -4.12 0.04 0.00 1.51 1.74 -0.55 -2.62 116.66 112.66 1fr7 n ARG 227 Ca -0.01 0.15 0.13 0.00 -0.77 0.00 0.00 57.85 57.35 1fr7 n ARG 227 Cb 0.39 -1.50 0.38 0.00 -1.02 0.00 0.00 32.46 30.72 1fr7 n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1fr7 n LYS 228 N -1.47 1.21 -1.08 5.56 5.02 -0.81 -4.22 118.16 122.37 1fr7 n LYS 228 Ca 0.05 -0.76 -0.31 0.00 -2.02 0.00 0.00 58.31 55.28 1fr7 n LYS 228 Cb 0.22 -1.48 0.12 0.00 -0.02 0.00 0.00 35.03 33.87 1fr7 n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1fr7 s LEU 229 N -2.31 2.91 -0.01 -0.35 1.43 -1.08 -4.84 118.68 114.43 1fr7 s LEU 229 Ca 0.29 1.91 0.06 0.00 -1.03 0.00 0.00 54.13 55.36 1fr7 s LEU 229 Cb 0.20 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.90 1fr7 s LEU 229 CO 0.45 -2.41 -0.20 0.20 0.23 0.00 0.00 176.35 174.61 1fr7 s ASN 230 N -3.17 3.56 0.06 2.29 -0.87 0.18 -0.29 114.94 116.70 1fr7 s ASN 230 Ca 0.63 -0.38 -0.15 0.00 -1.57 0.00 0.00 52.86 51.38 1fr7 s ASN 230 Cb -0.19 -0.56 -0.21 0.00 -0.02 0.00 0.00 41.25 40.27 1fr7 s ASN 230 CO 0.57 0.31 1.20 -0.26 -2.57 0.00 0.00 177.10 176.35 1fr7 h PHE 231 N 5.14 0.93 -3.91 2.20 0.04 -1.02 -3.35 116.94 116.96 1fr7 h PHE 231 Ca -0.46 -0.47 -0.47 0.00 2.80 0.00 0.00 57.97 59.38 1fr7 h PHE 231 Cb 1.14 -0.12 0.16 0.00 2.20 0.00 0.00 35.95 39.33 1fr7 h PHE 231 CO 0.47 1.30 0.20 0.54 -0.60 0.00 0.00 178.31 180.22 1fr7 s ASN 232 N -7.07 2.83 0.61 2.17 4.22 -1.26 -4.29 114.94 112.15 1fr7 s ASN 232 Ca -0.11 1.39 -0.00 0.00 -2.14 0.00 0.00 52.86 51.99 1fr7 s ASN 232 Cb 0.06 -2.06 0.05 0.00 1.28 0.00 0.00 41.25 40.59 1fr7 s ASN 232 CO 0.89 -3.03 0.85 -0.83 -2.04 0.00 0.00 177.10 172.94 1fr7 s GLY 233 N -3.32 1.79 0.35 0.45 0.00 -1.26 -1.40 107.32 103.94 1fr7 s GLY 233 Ca 0.65 -1.34 -0.29 0.00 0.00 0.00 0.00 44.72 43.75 1fr7 s GLY 233 CO 0.58 -0.98 1.53 1.85 0.00 0.00 0.00 173.10 176.08 1fr7 s GLU 234 N -4.91 4.10 0.00 2.90 2.12 -1.26 -2.15 118.70 119.50 1fr7 s GLU 234 Ca 0.59 2.60 0.00 0.00 0.36 0.00 0.00 54.97 58.52 1fr7 s GLU 234 Cb -0.09 -2.98 0.00 0.00 0.26 0.00 0.00 34.13 31.32 1fr7 s GLU 234 CO 0.40 -0.59 0.00 0.41 -0.54 0.00 0.00 175.26 174.95 1fr7 n GLY 235 N 0.96 2.03 3.94 -1.50 0.00 -1.26 -5.02 105.19 104.34 1fr7 n GLY 235 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1fr7 n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fr7 s GLU 236 N -0.08 3.50 0.21 1.61 2.02 -0.91 -5.03 118.70 120.02 1fr7 s GLU 236 Ca 0.00 -0.40 -0.32 0.00 0.02 0.00 0.00 54.97 54.27 1fr7 s GLU 236 Cb 0.00 -2.79 -0.14 0.00 0.10 0.00 0.00 34.13 31.30 1fr7 s GLU 236 CO 0.00 0.33 1.46 -2.30 0.02 0.00 0.00 175.26 174.77 1fr7 n PRO 237 N -1.08 2.06 -1.86 0.39 -0.02 -1.26 -4.86 135.00 128.36 1fr7 n PRO 237 Ca -0.05 0.74 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 1fr7 n PRO 237 Cb 0.55 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.58 1fr7 n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1fr7 s GLU 238 N -0.00 4.17 -0.26 -0.52 2.12 -1.26 -4.79 118.70 118.16 1fr7 s GLU 238 Ca 0.72 2.48 -0.03 0.00 0.36 0.00 0.00 54.97 58.49 1fr7 s GLU 238 Cb -0.66 -3.06 0.09 0.00 0.26 0.00 0.00 34.13 30.76 1fr7 s GLU 238 CO 0.46 -0.56 0.10 -1.21 -0.54 0.00 0.00 175.26 173.51 1fr7 s GLU 239 N -0.40 0.32 0.37 4.30 2.02 -1.26 -5.04 118.70 119.01 1fr7 s GLU 239 Ca 0.62 -0.52 -0.28 0.00 0.02 0.00 0.00 54.97 54.81 1fr7 s GLU 239 Cb -0.46 -1.59 -0.11 0.00 0.10 0.00 0.00 34.13 32.08 1fr7 s GLU 239 CO 0.46 -0.89 1.48 1.28 0.02 0.00 0.00 175.26 177.61 1fr7 n LEU 240 N 5.15 4.67 -4.08 1.80 4.77 -1.26 -0.47 117.00 127.58 1fr7 n LEU 240 Ca -0.06 1.22 -0.42 0.00 -0.03 0.00 0.00 56.01 56.72 1fr7 n LEU 240 Cb 0.44 -1.61 0.00 0.00 -2.33 0.00 0.00 43.42 39.92 1fr7 n LEU 240 CO 0.08 0.12 2.32 0.80 -1.33 0.00 0.00 177.39 179.37 1fr7 n MET 241 N 0.58 3.06 -4.24 3.23 0.00 0.60 -4.59 117.12 115.75 1fr7 n MET 241 Ca 0.02 -2.97 -0.18 0.00 -0.00 0.00 0.00 57.70 54.57 1fr7 n MET 241 Cb 0.38 -3.33 -0.11 0.00 0.00 0.00 0.00 33.22 30.16 1fr7 n MET 241 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 1fr7 s VAL 242 N 3.29 1.35 -1.42 1.12 -7.23 -1.26 -4.70 120.40 111.55 1fr7 s VAL 242 Ca 0.49 -1.71 -0.09 0.00 -1.81 0.00 0.00 61.98 58.87 1fr7 s VAL 242 Cb 0.09 -1.53 0.02 0.00 0.56 0.00 0.00 36.38 35.52 1fr7 s VAL 242 CO -0.02 -0.40 1.03 0.47 -0.31 0.00 0.00 175.10 175.88 1fr7 n ASP 243 N 0.56 -6.13 -3.31 4.85 8.00 0.20 -4.85 116.55 115.88 1fr7 n ASP 243 Ca -0.16 -0.51 -0.38 0.00 0.71 0.00 0.00 54.79 54.46 1fr7 n ASP 243 Cb 0.57 -4.86 -0.01 0.00 -0.02 0.00 0.00 41.12 36.80 1fr7 n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1fr7 n ASN 244 N -2.88 7.68 -4.13 -2.24 6.94 -1.12 -4.89 115.26 114.61 1fr7 n ASN 244 Ca -0.01 -3.24 -0.20 0.00 -0.02 0.00 0.00 54.58 51.10 1fr7 n ASN 244 Cb 0.57 -1.31 -0.14 0.00 -2.36 0.00 0.00 39.78 36.55 1fr7 n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1fr7 s TRP 245 N -1.73 1.21 -0.03 -2.53 1.48 -1.26 -4.54 118.94 111.54 1fr7 s TRP 245 Ca 0.53 -0.33 -0.16 0.00 -1.06 0.00 0.00 56.10 55.09 1fr7 s TRP 245 Cb 0.23 -0.73 -0.05 0.00 -1.16 0.00 0.00 33.47 31.75 1fr7 s TRP 245 CO -0.13 0.02 0.43 0.50 -4.06 0.00 0.00 176.95 173.71 1fr7 s ARG 246 N -0.96 4.05 0.90 3.25 3.52 -1.26 -5.01 118.95 123.44 1fr7 s ARG 246 Ca 0.02 0.43 -0.12 0.00 -0.13 0.00 0.00 55.73 55.94 1fr7 s ARG 246 Cb -0.07 -3.28 0.13 0.00 -1.56 0.00 0.00 34.95 30.17 1fr7 s ARG 246 CO 0.01 0.55 1.10 -2.14 -0.81 0.00 0.00 175.30 174.01 1fr7 s PRO 247 N -0.64 1.23 0.28 5.12 0.02 -1.26 -4.64 135.00 135.11 1fr7 s PRO 247 Ca 0.24 0.59 -0.30 0.00 0.02 0.00 0.00 61.00 61.55 1fr7 s PRO 247 Cb -0.16 -1.82 -0.13 0.00 0.02 0.00 0.00 34.50 32.40 1fr7 s PRO 247 CO 0.13 -2.20 1.40 0.00 -0.33 0.00 0.00 177.00 176.00 1fr7 n ALA 248 N -3.82 1.36 -2.51 -1.55 0.00 -1.26 -4.35 120.51 108.38 1fr7 n ALA 248 Ca 0.06 0.39 -0.21 0.00 0.00 0.00 0.00 53.44 53.69 1fr7 n ALA 248 Cb 0.57 -2.29 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 1fr7 n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1fr7 s GLN 249 N -0.87 2.77 0.17 0.00 -1.52 0.14 -4.93 119.66 115.43 1fr7 s GLN 249 Ca 0.64 -1.26 -0.33 0.00 -1.95 0.00 0.00 55.36 52.46 1fr7 s GLN 249 Cb -0.60 -2.52 -0.13 0.00 -0.22 0.00 0.00 33.01 29.54 1fr7 s GLN 249 CO 0.53 0.10 1.65 -2.30 -0.25 0.00 0.00 175.29 175.03 1fr7 n PRO 250 N -1.39 2.41 0.14 2.91 -0.02 -1.26 -4.65 135.00 133.14 1fr7 n PRO 250 Ca -0.02 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1fr7 n PRO 250 Cb 0.59 -2.68 0.29 0.00 -0.02 0.00 0.00 33.50 31.69 1fr7 n PRO 250 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1fr7 h LEU 251 N 6.42 0.11 -1.44 2.45 5.85 -1.93 -3.42 115.31 123.35 1fr7 h LEU 251 Ca -0.44 -0.04 -0.47 0.00 0.84 0.00 0.00 57.88 57.77 1fr7 h LEU 251 Cb 1.23 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 1fr7 h LEU 251 CO 0.92 0.49 -0.81 0.29 -0.34 0.00 0.00 178.44 178.99 1fr7 n LYS 252 N -4.06 -4.69 -1.51 1.25 4.76 -1.26 -1.83 118.16 110.83 1fr7 n LYS 252 Ca -0.02 0.55 -0.17 0.00 -2.87 0.00 0.00 58.31 55.80 1fr7 n LYS 252 Cb 0.44 -5.17 -0.07 0.00 -1.84 0.00 0.00 35.03 28.39 1fr7 n LYS 252 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1fr7 n ASN 253 N -2.92 -5.25 -4.80 4.39 3.02 -1.26 -4.98 115.26 103.47 1fr7 n ASN 253 Ca -0.14 0.43 -0.32 0.00 -0.03 0.00 0.00 54.58 54.52 1fr7 n ASN 253 Cb 0.60 -4.28 0.03 0.00 -0.61 0.00 0.00 39.78 35.52 1fr7 n ASN 253 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1fr7 s ARG 254 N -3.46 3.08 -0.22 3.52 0.52 -0.76 -5.01 118.95 116.61 1fr7 s ARG 254 Ca 0.00 1.19 -0.09 0.00 -0.52 0.00 0.00 55.73 56.31 1fr7 s ARG 254 Cb 0.00 -2.00 -0.04 0.00 0.52 0.00 0.00 34.95 33.43 1fr7 s ARG 254 CO 0.00 -1.00 0.10 -1.14 0.02 0.00 0.00 175.30 173.28 1fr7 s GLN 255 N -4.32 3.92 -0.24 3.54 2.00 -1.26 -5.05 119.66 118.25 1fr7 s GLN 255 Ca 0.63 -0.36 -0.13 0.00 -2.00 0.00 0.00 55.36 53.50 1fr7 s GLN 255 Cb -0.17 -3.37 -0.04 0.00 0.80 0.00 0.00 33.01 30.23 1fr7 s GLN 255 CO 0.42 0.06 0.29 0.42 -0.50 0.00 0.00 175.29 175.98 1fr7 s ILE 256 N 1.00 5.26 -0.04 -2.34 1.01 -1.26 -4.65 121.20 120.18 1fr7 s ILE 256 Ca 0.05 0.43 -0.02 0.00 0.00 0.00 0.00 60.65 61.11 1fr7 s ILE 256 Cb -0.14 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 1fr7 s ILE 256 CO 0.03 0.27 0.09 -0.54 0.00 0.00 0.00 174.94 174.79 1fr7 s LYS 257 N 1.41 3.18 0.01 2.79 -0.14 -0.35 -1.23 119.74 125.42 1fr7 s LYS 257 Ca 0.13 -0.38 0.00 0.00 -1.36 0.00 0.00 55.97 54.36 1fr7 s LYS 257 Cb -0.15 -2.95 -0.04 0.00 -1.68 0.00 0.00 37.83 33.02 1fr7 s LYS 257 CO 0.07 0.69 0.06 0.00 -0.76 0.00 0.00 175.35 175.41 1fr7 s ALA 258 N -1.13 3.52 -1.28 5.17 0.00 0.93 -0.37 121.76 128.60 1fr7 s ALA 258 Ca 0.20 -0.91 0.26 0.00 0.00 0.00 0.00 51.96 51.52 1fr7 s ALA 258 Cb -0.12 -1.51 0.76 0.00 0.00 0.00 0.00 23.12 22.25 1fr7 s ALA 258 CO 0.11 0.69 1.58 -1.13 0.00 0.00 0.00 175.76 177.00 1fr7 n SER 259 N 1.13 0.57 -4.34 0.00 3.41 0.04 -1.67 113.62 112.76 1fr7 n SER 259 Ca -0.13 -0.37 -0.20 0.00 -0.26 0.00 0.00 58.87 57.91 1fr7 n SER 259 Cb 0.53 0.09 -0.11 0.00 -0.26 0.00 0.00 64.21 64.45 1fr7 n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1fr7 s PHE 260 N -2.80 1.77 -2.08 7.33 -0.71 -1.26 -4.91 117.98 115.32 1fr7 s PHE 260 Ca 0.17 -0.50 0.31 0.00 -1.04 0.00 0.00 56.93 55.87 1fr7 s PHE 260 Cb 0.18 -0.86 1.78 0.00 -1.21 0.00 0.00 43.02 42.91 1fr7 s PHE 260 CO 0.60 0.34 2.15 1.63 -1.34 0.00 0.00 175.22 178.61