#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rf6 s LYS 2 N 0.00 4.41 0.10 3.17 2.20 -1.26 -1.09 119.74 127.28 1rf6 s LYS 2 Ca 0.00 0.96 -0.05 0.00 -0.36 0.00 0.00 55.97 56.52 1rf6 s LYS 2 Cb 0.00 -3.48 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 1rf6 s LYS 2 CO 0.00 -0.05 0.34 -0.51 -0.36 0.00 0.00 175.35 174.77 1rf6 s LEU 3 N 1.17 4.30 0.30 5.43 1.02 -1.03 -4.99 118.68 124.88 1rf6 s LEU 3 Ca 0.39 0.56 -0.29 0.00 0.02 0.00 0.00 54.13 54.81 1rf6 s LEU 3 Cb -0.18 -3.13 -0.10 0.00 0.02 0.00 0.00 46.19 42.79 1rf6 s LEU 3 CO 0.18 0.11 1.42 -0.54 0.02 0.00 0.00 176.35 177.54 1rf6 s LYS 4 N -2.42 4.25 0.34 1.70 3.01 -1.26 -4.65 119.74 120.70 1rf6 s LYS 4 Ca 0.37 2.35 0.04 0.00 -1.01 0.00 0.00 55.97 57.73 1rf6 s LYS 4 Cb -0.13 -3.06 -0.07 0.00 -1.01 0.00 0.00 37.83 33.56 1rf6 s LYS 4 CO 0.23 -0.39 0.05 -0.08 0.51 0.00 0.00 175.35 175.67 1rf6 s THR 5 N -0.54 1.28 -1.35 2.17 -1.32 -1.26 -3.62 115.64 111.00 1rf6 s THR 5 Ca 0.55 -2.00 -0.05 0.00 -1.21 0.00 0.00 61.69 58.98 1rf6 s THR 5 Cb -0.43 -2.82 0.00 0.00 -1.51 0.00 0.00 72.50 67.75 1rf6 s THR 5 CO 0.50 0.00 0.50 -3.20 -2.21 0.00 0.00 174.62 170.21 1rf6 n ASN 6 N -0.72 -1.40 -4.72 8.08 4.05 0.48 -4.90 115.26 116.14 1rf6 n ASN 6 Ca -0.03 -1.02 -0.42 0.00 0.45 0.00 0.00 54.58 53.56 1rf6 n ASN 6 Cb 0.67 -3.05 -0.03 0.00 1.23 0.00 0.00 39.78 38.59 1rf6 n ASN 6 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 1rf6 s ILE 7 N -3.85 3.28 -1.87 -1.44 1.10 0.61 -4.93 121.20 114.10 1rf6 s ILE 7 Ca 0.11 0.95 0.24 0.00 -0.51 0.00 0.00 60.65 61.44 1rf6 s ILE 7 Cb -0.04 -3.61 0.07 0.00 0.15 0.00 0.00 42.46 39.03 1rf6 s ILE 7 CO 0.89 0.09 1.25 0.54 -2.11 0.00 0.00 174.94 175.59 1rf6 n ARG 8 N 3.64 1.00 0.00 3.50 5.12 -1.26 -4.67 116.66 124.00 1rf6 n ARG 8 Ca 0.10 -0.76 0.00 0.00 -1.93 0.00 0.00 57.85 55.26 1rf6 n ARG 8 Cb 0.42 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.24 1rf6 n ARG 8 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 1rf6 n HIS 9 N -0.33 0.00 -3.85 -1.55 1.44 -1.25 -4.56 115.22 105.12 1rf6 n HIS 9 Ca 0.10 0.00 -0.20 0.00 -2.01 0.00 0.00 57.72 55.61 1rf6 n HIS 9 Cb 0.42 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.36 1rf6 n HIS 9 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1rf6 s LEU 10 N 0.00 0.79 -0.10 2.39 1.43 -1.20 -4.70 118.68 117.29 1rf6 s LEU 10 Ca 0.00 -0.03 -0.19 0.00 -1.03 0.00 0.00 54.13 52.87 1rf6 s LEU 10 Cb 0.00 -0.30 0.04 0.00 0.03 0.00 0.00 46.19 45.97 1rf6 s LEU 10 CO 0.00 -0.16 0.47 -1.38 0.23 0.00 0.00 176.35 175.52 1rf6 s HIS 11 N 1.55 -0.45 0.00 0.29 -3.43 -1.17 -1.21 115.29 110.87 1rf6 s HIS 11 Ca -0.02 0.94 0.00 0.00 -0.80 0.00 0.00 55.06 55.18 1rf6 s HIS 11 Cb -0.13 0.20 0.00 0.00 -1.43 0.00 0.00 32.58 31.22 1rf6 s HIS 11 CO -0.03 -0.37 0.00 0.41 -2.00 0.00 0.00 174.74 172.75 1rf6 n GLY 12 N 1.94 2.37 3.70 -1.38 0.00 -1.21 -4.49 105.19 106.11 1rf6 n GLY 12 Ca -0.17 -1.66 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 1rf6 n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rf6 s ILE 13 N -1.79 4.84 -0.02 -0.61 1.01 -1.26 -1.56 121.20 121.81 1rf6 s ILE 13 Ca 0.00 -0.03 0.04 0.00 0.00 0.00 0.00 60.65 60.66 1rf6 s ILE 13 Cb 0.00 -3.13 -0.01 0.00 0.01 0.00 0.00 42.46 39.33 1rf6 s ILE 13 CO 0.00 0.53 -0.13 -0.63 0.00 0.00 0.00 174.94 174.70 1rf6 s ILE 14 N -0.19 1.06 -0.51 2.92 -1.09 0.23 -4.98 121.20 118.64 1rf6 s ILE 14 Ca 0.08 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 57.94 1rf6 s ILE 14 Cb -0.12 -0.90 0.13 0.00 -1.58 0.00 0.00 42.46 39.99 1rf6 s ILE 14 CO 0.01 0.31 0.28 -0.13 -1.23 0.00 0.00 174.94 174.18 1rf6 s ARG 15 N -0.19 2.10 0.74 2.79 0.52 -1.26 -2.19 118.95 121.46 1rf6 s ARG 15 Ca 0.03 -2.32 -0.15 0.00 -0.52 0.00 0.00 55.73 52.76 1rf6 s ARG 15 Cb -0.07 -3.49 0.02 0.00 0.52 0.00 0.00 34.95 31.93 1rf6 s ARG 15 CO -0.00 -1.10 1.01 1.33 0.02 0.00 0.00 175.30 176.56 1rf6 n VAL 16 N 3.70 2.67 -1.05 3.52 0.24 -1.26 -4.97 118.33 121.18 1rf6 n VAL 16 Ca 0.04 -0.34 -0.29 0.00 -2.04 0.00 0.00 64.34 61.72 1rf6 n VAL 16 Cb 0.37 -1.12 0.18 0.00 -1.47 0.00 0.00 33.84 31.81 1rf6 n VAL 16 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1rf6 s PRO 17 N -3.49 0.31 0.80 7.34 0.04 -1.26 -4.60 135.00 134.13 1rf6 s PRO 17 Ca 0.73 0.64 -0.15 0.00 0.04 0.00 0.00 61.00 62.27 1rf6 s PRO 17 Cb -0.33 -1.71 0.02 0.00 0.04 0.00 0.00 34.50 32.51 1rf6 s PRO 17 CO 0.50 -2.85 0.75 0.41 0.04 0.00 0.00 177.00 175.86 1rf6 n GLY 18 N -0.72 -1.05 3.66 0.56 0.00 -1.26 -1.59 105.19 104.79 1rf6 n GLY 18 Ca 0.05 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.17 1rf6 n GLY 18 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rf6 s ASP 19 N -1.79 6.59 0.13 1.61 -1.08 -0.19 -4.11 116.67 117.83 1rf6 s ASP 19 Ca 0.67 2.39 -0.19 0.00 -0.52 0.00 0.00 52.55 54.90 1rf6 s ASP 19 Cb -0.30 -2.53 -0.04 0.00 -1.46 0.00 0.00 42.92 38.58 1rf6 s ASP 19 CO 0.57 -0.96 1.79 0.50 0.52 0.00 0.00 175.17 177.58 1rf6 h LYS 20 N 9.80 0.33 -0.35 4.34 3.64 -1.91 -0.74 116.57 131.69 1rf6 h LYS 20 Ca -0.43 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1rf6 h LYS 20 Cb 1.20 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 1rf6 h LYS 20 CO 0.95 0.22 0.21 0.77 -2.27 0.00 0.00 179.45 179.33 1rf6 h SER 21 N 0.34 0.41 -0.06 4.20 0.02 -2.00 -1.00 113.55 115.47 1rf6 h SER 21 Ca 0.10 -0.05 -0.13 0.00 -0.84 0.00 0.00 61.79 60.87 1rf6 h SER 21 Cb -0.03 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1rf6 h SER 21 CO -0.03 0.34 -0.38 0.40 -1.14 0.00 0.00 176.83 176.02 1rf6 h ILE 22 N 0.45 1.30 -0.48 3.27 2.04 -1.95 -2.58 117.51 119.55 1rf6 h ILE 22 Ca 0.12 -1.53 -0.12 0.00 1.00 0.00 0.00 64.86 64.33 1rf6 h ILE 22 Cb -0.00 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1rf6 h ILE 22 CO -0.02 0.49 -0.18 0.77 0.00 0.00 0.00 178.15 179.20 1rf6 h SER 23 N 0.47 0.97 -0.38 1.72 4.64 -0.91 0.60 113.55 120.67 1rf6 h SER 23 Ca 0.04 -0.35 0.01 0.00 -0.47 0.00 0.00 61.79 61.03 1rf6 h SER 23 Cb 0.88 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.68 1rf6 h SER 23 CO 0.08 1.12 0.24 0.45 -0.87 0.00 0.00 176.83 177.85 1rf6 h HIS 24 N 0.83 0.45 -0.07 4.77 3.86 -1.10 -2.64 115.15 121.26 1rf6 h HIS 24 Ca 0.12 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.24 1rf6 h HIS 24 Cb 0.74 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.04 1rf6 h HIS 24 CO 0.05 0.28 -0.41 0.00 0.86 0.00 0.00 177.93 178.70 1rf6 h ARG 25 N 0.49 0.15 -0.29 2.45 3.08 -1.20 -2.73 114.38 116.34 1rf6 h ARG 25 Ca 0.15 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1rf6 h ARG 25 Cb -0.03 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1rf6 h ARG 25 CO -0.05 0.54 0.11 0.66 -1.07 0.00 0.00 179.97 180.16 1rf6 h SER 26 N 0.13 0.36 0.11 7.04 4.64 -0.52 0.32 113.55 125.64 1rf6 h SER 26 Ca 0.01 -0.03 -0.27 0.00 -0.47 0.00 0.00 61.79 61.03 1rf6 h SER 26 Cb 0.78 -0.09 0.02 0.00 -0.31 0.00 0.00 62.40 62.80 1rf6 h SER 26 CO 0.06 0.34 -1.10 0.40 -0.87 0.00 0.00 176.83 175.66 1rf6 h ILE 27 N 0.40 1.30 0.04 0.95 1.08 -1.35 -1.66 117.51 118.28 1rf6 h ILE 27 Ca 0.10 -2.37 -0.00 0.00 -0.39 0.00 0.00 64.86 62.20 1rf6 h ILE 27 Cb 0.10 2.50 0.00 0.00 -3.07 0.00 0.00 36.82 36.35 1rf6 h ILE 27 CO -0.01 0.72 -0.02 0.40 -0.69 0.00 0.00 178.15 178.56 1rf6 h ILE 28 N 0.32 1.22 -0.60 -0.67 2.04 -1.17 -1.64 117.51 117.01 1rf6 h ILE 28 Ca -0.14 -0.83 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 1rf6 h ILE 28 Cb 1.76 1.77 -0.03 0.00 -0.74 0.00 0.00 36.82 39.59 1rf6 h ILE 28 CO 0.21 0.21 0.28 -0.26 0.00 0.00 0.00 178.15 178.59 1rf6 h PHE 29 N -0.42 0.88 -0.84 1.37 -1.00 -1.06 -1.34 116.94 114.53 1rf6 h PHE 29 Ca -0.01 -0.05 0.06 0.00 2.81 0.00 0.00 57.97 60.79 1rf6 h PHE 29 Cb 0.39 -0.27 -0.05 0.00 3.61 0.00 0.00 35.95 39.62 1rf6 h PHE 29 CO 0.05 0.68 0.55 0.78 -1.61 0.00 0.00 178.31 178.76 1rf6 h GLY 30 N 0.83 1.18 0.97 -1.45 0.00 -1.27 -0.86 103.07 102.47 1rf6 h GLY 30 Ca 0.21 -0.38 -0.17 0.00 0.00 0.00 0.00 47.33 46.99 1rf6 h GLY 30 CO -0.02 0.28 -0.59 1.76 0.00 0.00 0.00 176.54 177.97 1rf6 h SER 31 N 0.94 0.73 1.52 0.19 0.02 -0.83 -3.25 113.55 112.87 1rf6 h SER 31 Ca 0.36 -0.64 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1rf6 h SER 31 Cb 0.19 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1rf6 h SER 31 CO -0.13 1.25 0.00 -0.07 -1.14 0.00 0.00 176.83 176.74 1rf6 h LEU 32 N 0.26 0.00-10.69 5.07 3.38 -0.99 0.59 115.31 112.92 1rf6 h LEU 32 Ca -0.04 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.47 1rf6 h LEU 32 Cb 1.23 0.00 0.13 0.00 0.09 0.00 0.00 40.66 42.11 1rf6 h LEU 32 CO 0.12 0.00 0.40 0.00 0.09 0.00 0.00 178.44 179.06 1rf6 s ALA 33 N -3.29 2.40 -0.10 1.53 0.00 -0.35 -1.78 121.76 120.17 1rf6 s ALA 33 Ca 0.06 -0.86 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 1rf6 s ALA 33 Cb 0.08 -2.89 -0.03 0.00 0.00 0.00 0.00 23.12 20.28 1rf6 s ALA 33 CO 0.59 -2.04 -0.02 -1.21 0.00 0.00 0.00 175.76 173.08 1rf6 s GLU 34 N -5.68 3.07 0.03 0.00 2.02 -0.04 -1.46 118.70 116.65 1rf6 s GLU 34 Ca 0.67 -0.46 0.00 0.00 0.02 0.00 0.00 54.97 55.20 1rf6 s GLU 34 Cb -0.08 -2.78 0.00 0.00 0.10 0.00 0.00 34.13 31.37 1rf6 s GLU 34 CO 0.51 0.61 0.00 0.41 0.02 0.00 0.00 175.26 176.80 1rf6 n GLY 35 N 2.43 -3.62 3.83 -1.39 0.00 -1.26 -0.68 105.19 104.50 1rf6 n GLY 35 Ca -0.18 -1.99 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 1rf6 n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rf6 s GLU 36 N -0.83 4.12 -0.04 1.61 2.12 -1.26 -1.51 118.70 122.90 1rf6 s GLU 36 Ca 0.00 0.65 0.05 0.00 0.36 0.00 0.00 54.97 56.03 1rf6 s GLU 36 Cb 0.00 -3.06 -0.01 0.00 0.26 0.00 0.00 34.13 31.33 1rf6 s GLU 36 CO 0.00 0.54 -0.18 0.99 -0.54 0.00 0.00 175.26 176.06 1rf6 s THR 37 N -1.32 1.51 -0.10 -1.70 2.01 0.15 -3.29 115.64 112.90 1rf6 s THR 37 Ca 0.35 -0.77 0.03 0.00 0.31 0.00 0.00 61.69 61.61 1rf6 s THR 37 Cb -0.17 -1.29 0.00 0.00 0.01 0.00 0.00 72.50 71.05 1rf6 s THR 37 CO 0.19 0.43 -0.22 -0.54 -0.69 0.00 0.00 174.62 173.80 1rf6 s LYS 38 N -0.08 2.79 -0.17 4.92 1.02 -0.35 0.71 119.74 128.59 1rf6 s LYS 38 Ca -0.02 -0.79 -0.02 0.00 0.02 0.00 0.00 55.97 55.16 1rf6 s LYS 38 Cb -0.11 -2.15 -0.01 0.00 -0.52 0.00 0.00 37.83 35.04 1rf6 s LYS 38 CO 0.02 0.13 -0.08 0.08 -0.92 0.00 0.00 175.35 174.57 1rf6 s VAL 39 N 0.46 3.31 -0.03 3.17 1.01 0.13 0.06 120.40 128.52 1rf6 s VAL 39 Ca -0.17 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.27 1rf6 s VAL 39 Cb -0.17 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 1rf6 s VAL 39 CO 0.07 0.48 -0.02 -0.31 0.00 0.00 0.00 175.10 175.32 1rf6 s TYR 40 N 0.75 3.05 -1.49 5.22 1.51 0.73 -1.93 117.35 125.18 1rf6 s TYR 40 Ca -0.04 0.08 -0.06 0.00 -1.01 0.00 0.00 57.07 56.05 1rf6 s TYR 40 Cb -0.15 -1.70 0.02 0.00 -0.11 0.00 0.00 41.96 40.03 1rf6 s TYR 40 CO 0.02 0.43 0.59 -0.25 -1.11 0.00 0.00 175.55 175.22 1rf6 n ASP 41 N 1.74 -5.53 -4.76 2.29 8.00 -1.26 -1.73 116.55 115.30 1rf6 n ASP 41 Ca -0.16 -0.31 -0.34 0.00 0.71 0.00 0.00 54.79 54.69 1rf6 n ASP 41 Cb 0.53 -4.49 0.04 0.00 -0.02 0.00 0.00 41.12 37.19 1rf6 n ASP 41 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1rf6 s ILE 42 N -3.12 3.06 -0.05 0.53 2.07 -1.26 -4.02 121.20 118.41 1rf6 s ILE 42 Ca 0.33 0.54 -0.30 0.00 -1.41 0.00 0.00 60.65 59.81 1rf6 s ILE 42 Cb -0.15 -3.09 -0.03 0.00 0.13 0.00 0.00 42.46 39.32 1rf6 s ILE 42 CO 0.41 -0.26 1.06 -0.22 -1.91 0.00 0.00 174.94 174.02 1rf6 s LEU 43 N -4.63 4.30 -0.17 8.50 1.98 -1.26 -4.59 118.68 122.80 1rf6 s LEU 43 Ca 0.70 1.67 0.17 0.00 -2.89 0.00 0.00 54.13 53.78 1rf6 s LEU 43 Cb -0.23 -3.56 0.78 0.00 0.66 0.00 0.00 46.19 43.83 1rf6 s LEU 43 CO 0.38 -0.43 1.69 -1.14 -1.89 0.00 0.00 176.35 174.96 1rf6 n ARG 44 N 4.68 4.26 -1.56 1.98 0.63 -1.26 -4.71 116.66 120.68 1rf6 n ARG 44 Ca 0.09 -3.02 -0.34 0.00 -0.92 0.00 0.00 57.85 53.65 1rf6 n ARG 44 Cb 0.48 -2.07 0.08 0.00 0.45 0.00 0.00 32.46 31.41 1rf6 n ARG 44 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1rf6 s GLY 45 N -0.84 2.39 0.38 5.14 0.00 -1.26 -4.70 107.32 108.43 1rf6 s GLY 45 Ca 0.53 0.87 0.17 0.00 0.00 0.00 0.00 44.72 46.29 1rf6 s GLY 45 CO 0.21 1.27 1.76 0.83 0.00 0.00 0.00 173.10 177.17 1rf6 h GLU 46 N -0.08 0.41 -0.65 2.90 5.08 -1.14 -1.22 114.58 119.89 1rf6 h GLU 46 Ca -0.48 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1rf6 h GLU 46 Cb 1.29 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1rf6 h GLU 46 CO 0.51 0.27 0.39 -0.44 -1.00 0.00 0.00 179.01 178.74 1rf6 h ASP 47 N 0.42 0.78 -0.22 1.42 3.45 -1.74 0.51 116.42 121.05 1rf6 h ASP 47 Ca 0.61 -0.07 -0.15 0.00 0.43 0.00 0.00 57.03 57.86 1rf6 h ASP 47 Cb 1.48 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 40.05 1rf6 h ASP 47 CO -0.34 0.62 -0.40 0.58 -1.57 0.00 0.00 179.24 178.13 1rf6 h VAL 48 N 0.88 1.29 -0.66 -1.35 2.07 -1.48 -2.43 116.25 114.56 1rf6 h VAL 48 Ca 0.23 -1.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1rf6 h VAL 48 Cb -0.02 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1rf6 h VAL 48 CO -0.04 0.51 0.37 -0.07 0.02 0.00 0.00 177.57 178.36 1rf6 h LEU 49 N 0.62 0.81 -0.10 2.57 4.07 -1.04 -1.17 115.31 121.07 1rf6 h LEU 49 Ca 0.05 -0.06 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 1rf6 h LEU 49 Cb 0.96 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 42.49 1rf6 h LEU 49 CO 0.09 0.65 0.05 0.28 -1.08 0.00 0.00 178.44 178.43 1rf6 h SER 50 N 0.92 0.13 -0.82 -0.43 0.02 -0.54 -1.09 113.55 111.75 1rf6 h SER 50 Ca 0.24 -0.11 0.06 0.00 -0.84 0.00 0.00 61.79 61.14 1rf6 h SER 50 Cb 0.02 -0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.46 1rf6 h SER 50 CO -0.04 0.20 0.50 0.74 -1.14 0.00 0.00 176.83 177.09 1rf6 h THR 51 N 0.05 1.04 -0.14 -2.27 2.02 -0.95 -1.41 112.91 111.23 1rf6 h THR 51 Ca 0.03 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 1rf6 h THR 51 Cb 0.10 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.54 1rf6 h THR 51 CO -0.00 0.17 0.06 0.24 0.37 0.00 0.00 175.52 176.35 1rf6 h MET 52 N 0.92 0.22 -0.06 6.66 2.07 -0.94 -2.75 114.93 121.06 1rf6 h MET 52 Ca 0.35 -0.04 -0.04 0.00 -2.07 0.00 0.00 59.70 57.91 1rf6 h MET 52 Cb 0.16 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 29.85 1rf6 h MET 52 CO -0.17 0.31 -0.13 0.37 1.07 0.00 0.00 176.91 178.36 1rf6 h GLN 53 N 0.07 0.09 -0.06 1.72 5.75 -0.87 -2.29 115.11 119.52 1rf6 h GLN 53 Ca 0.05 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1rf6 h GLN 53 Cb 0.18 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.71 1rf6 h GLN 53 CO -0.00 0.23 0.03 0.28 -2.65 0.00 0.00 178.83 176.71 1rf6 h VAL 54 N 0.08 1.11 0.00 2.39 2.07 -1.00 -1.09 116.25 119.81 1rf6 h VAL 54 Ca 0.02 -0.32 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 1rf6 h VAL 54 Cb 0.29 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1rf6 h VAL 54 CO 0.02 0.09 -0.33 -0.26 0.02 0.00 0.00 177.57 177.11 1rf6 h PHE 55 N -0.03 0.00 -0.44 1.57 -1.00 -1.21 -1.74 116.94 114.09 1rf6 h PHE 55 Ca 0.02 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.67 1rf6 h PHE 55 Cb 0.12 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 1rf6 h PHE 55 CO -0.03 0.33 -0.25 0.00 -1.61 0.00 0.00 178.31 176.75 1rf6 h ARG 56 N 0.00 0.92 0.00 1.51 3.08 -1.18 0.70 114.38 119.41 1rf6 h ARG 56 Ca -0.00 -0.40 -0.02 0.00 0.07 0.00 0.00 59.98 59.63 1rf6 h ARG 56 Cb 0.64 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 1rf6 h ARG 56 CO 0.04 1.06 -0.08 -0.44 -1.07 0.00 0.00 179.97 179.49 1rf6 h ASP 57 N 0.78 0.00 -0.43 7.04 3.32 -0.53 0.25 116.42 126.85 1rf6 h ASP 57 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1rf6 h ASP 57 Cb 0.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.36 1rf6 h ASP 57 CO 0.07 0.08 0.00 0.18 -1.72 0.00 0.00 179.24 177.84 1rf6 n LEU 58 N -3.42 2.42 0.00 1.55 4.77 -0.72 -3.97 117.00 117.63 1rf6 n LEU 58 Ca -0.02 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.75 1rf6 n LEU 58 Cb 0.22 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1rf6 n LEU 58 CO 0.28 0.58 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 1rf6 n GLY 59 N 1.14 0.76 3.71 -0.72 0.00 0.08 -1.50 105.19 108.66 1rf6 n GLY 59 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1rf6 n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf6 s VAL 60 N -2.30 5.09 -0.29 1.61 1.01 0.16 -4.98 120.40 120.71 1rf6 s VAL 60 Ca 0.00 1.25 -0.29 0.00 0.00 0.00 0.00 61.98 62.94 1rf6 s VAL 60 Cb 0.00 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1rf6 s VAL 60 CO 0.00 0.26 1.24 -1.61 0.00 0.00 0.00 175.10 175.00 1rf6 s GLU 61 N 0.86 3.99 -0.23 2.72 2.02 -1.26 -3.91 118.70 122.89 1rf6 s GLU 61 Ca 0.33 1.26 -0.01 0.00 0.02 0.00 0.00 54.97 56.56 1rf6 s GLU 61 Cb -0.17 -3.83 0.07 0.00 0.10 0.00 0.00 34.13 30.30 1rf6 s GLU 61 CO 0.15 -1.02 0.03 0.42 0.02 0.00 0.00 175.26 174.86 1rf6 s ILE 62 N 4.09 0.88 -0.16 -1.63 1.01 -1.26 -1.41 121.20 122.72 1rf6 s ILE 62 Ca 0.54 -0.93 -0.06 0.00 0.00 0.00 0.00 60.65 60.20 1rf6 s ILE 62 Cb -0.16 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1rf6 s ILE 62 CO 0.20 -0.28 0.04 -0.70 0.00 0.00 0.00 174.94 174.20 1rf6 s GLU 63 N 1.68 3.75 -0.38 2.79 2.12 -0.54 -4.94 118.70 123.18 1rf6 s GLU 63 Ca 0.00 -0.37 -0.06 0.00 0.36 0.00 0.00 54.97 54.91 1rf6 s GLU 63 Cb -0.18 -3.10 0.08 0.00 0.26 0.00 0.00 34.13 31.19 1rf6 s GLU 63 CO -0.11 0.36 0.17 0.34 -0.54 0.00 0.00 175.26 175.48 1rf6 s ASP 64 N 0.10 5.33 -0.04 -1.70 3.68 -1.26 -0.62 116.67 122.16 1rf6 s ASP 64 Ca 0.04 -1.55 -0.00 0.00 2.13 0.00 0.00 52.55 53.17 1rf6 s ASP 64 Cb -0.12 -1.87 0.03 0.00 -1.45 0.00 0.00 42.92 39.50 1rf6 s ASP 64 CO 0.01 -0.45 0.00 -0.75 0.13 0.00 0.00 175.17 174.11 1rf6 s LYS 65 N 1.31 0.41 -1.53 4.34 2.20 -0.27 -4.85 119.74 121.34 1rf6 s LYS 65 Ca 0.02 0.10 -0.11 0.00 -0.36 0.00 0.00 55.97 55.61 1rf6 s LYS 65 Cb -0.22 -0.66 0.08 0.00 -1.51 0.00 0.00 37.83 35.53 1rf6 s LYS 65 CO -0.00 -0.19 0.83 -0.25 -0.36 0.00 0.00 175.35 175.38 1rf6 n ASP 66 N 4.52 -3.43 0.00 1.43 8.00 -1.26 -1.35 116.55 124.45 1rf6 n ASP 66 Ca -0.19 -0.87 0.00 0.00 0.71 0.00 0.00 54.79 54.45 1rf6 n ASP 66 Cb 0.50 -3.55 0.00 0.00 -0.02 0.00 0.00 41.12 38.05 1rf6 n ASP 66 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rf6 n GLY 67 N -1.64 0.51 3.23 0.44 0.00 -1.26 -5.02 105.19 101.45 1rf6 n GLY 67 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 1rf6 n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf6 s VAL 68 N -2.18 1.91 -0.21 1.61 1.01 -0.46 -4.46 120.40 117.62 1rf6 s VAL 68 Ca 0.00 -0.98 -0.12 0.00 0.00 0.00 0.00 61.98 60.88 1rf6 s VAL 68 Cb 0.00 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.70 1rf6 s VAL 68 CO 0.00 0.53 0.22 -0.63 0.00 0.00 0.00 175.10 175.22 1rf6 s ILE 69 N -0.04 5.34 -0.17 2.22 -1.09 -0.81 -1.12 121.20 125.52 1rf6 s ILE 69 Ca -0.06 0.34 0.01 0.00 -2.23 0.00 0.00 60.65 58.71 1rf6 s ILE 69 Cb -0.14 -3.56 0.03 0.00 -1.58 0.00 0.00 42.46 37.21 1rf6 s ILE 69 CO 0.04 0.36 -0.16 -0.89 -1.23 0.00 0.00 174.94 173.07 1rf6 s THR 70 N 0.80 1.80 -0.16 2.92 2.01 0.21 0.22 115.64 123.44 1rf6 s THR 70 Ca 0.11 -0.85 -0.04 0.00 0.31 0.00 0.00 61.69 61.22 1rf6 s THR 70 Cb -0.13 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.66 1rf6 s THR 70 CO 0.03 0.43 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.68 1rf6 s VAL 71 N 1.38 4.00 -0.69 3.82 1.01 0.22 -1.47 120.40 128.67 1rf6 s VAL 71 Ca 0.04 -0.32 -0.19 0.00 0.00 0.00 0.00 61.98 61.51 1rf6 s VAL 71 Cb -0.14 -2.76 0.11 0.00 0.00 0.00 0.00 36.38 33.59 1rf6 s VAL 71 CO -0.11 0.48 0.84 -1.10 0.00 0.00 0.00 175.10 175.21 1rf6 s GLN 72 N 0.42 3.22 0.50 2.72 -1.52 -0.50 -0.67 119.66 123.82 1rf6 s GLN 72 Ca -0.03 -1.44 -0.22 0.00 -1.95 0.00 0.00 55.36 51.73 1rf6 s GLN 72 Cb -0.14 -4.40 -0.08 0.00 -0.22 0.00 0.00 33.01 28.17 1rf6 s GLN 72 CO 0.03 -1.61 0.96 0.41 -0.25 0.00 0.00 175.29 174.83 1rf6 n GLY 73 N 5.20 -0.33 0.47 3.09 0.00 -0.57 -4.31 105.19 108.74 1rf6 n GLY 73 Ca 0.00 0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.08 1rf6 n GLY 73 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1rf6 n VAL 74 N -1.04 0.48 0.00 1.61 0.24 0.19 -4.45 118.33 115.36 1rf6 n VAL 74 Ca 0.11 -0.74 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1rf6 n VAL 74 Cb 0.43 0.87 0.00 0.00 -1.47 0.00 0.00 33.84 33.67 1rf6 n VAL 74 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rf6 n GLY 75 N 0.47 -1.04 0.21 7.63 0.00 -0.53 -3.38 105.19 108.55 1rf6 n GLY 75 Ca 0.08 -1.64 0.15 0.00 0.00 0.00 0.00 46.02 44.61 1rf6 n GLY 75 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1rf6 h MET 76 N 0.00 0.00 -0.74 1.61 4.05 -1.64 -2.99 114.93 115.22 1rf6 h MET 76 Ca 0.00 0.00 -0.32 0.00 -0.28 0.00 0.00 59.70 59.10 1rf6 h MET 76 Cb 0.00 0.00 -0.40 0.00 -0.80 0.00 0.00 31.60 30.40 1rf6 h MET 76 CO 0.00 0.00 -1.12 0.00 0.23 0.00 0.00 176.91 176.02 1rf6 n ALA 77 N -1.89 3.19 0.07 0.39 0.00 -1.26 -4.88 120.51 116.13 1rf6 n ALA 77 Ca -0.01 -3.04 0.06 0.00 0.00 0.00 0.00 53.44 50.45 1rf6 n ALA 77 Cb 0.12 -0.86 0.12 0.00 0.00 0.00 0.00 19.45 18.83 1rf6 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rf6 n GLY 78 N -0.37 1.57 3.75 0.00 0.00 -1.13 -5.01 105.19 104.00 1rf6 n GLY 78 Ca 0.11 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.37 1rf6 n GLY 78 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rf6 s LEU 79 N -0.98 4.57 0.16 0.99 1.43 -1.26 -4.93 118.68 118.65 1rf6 s LEU 79 Ca 0.20 2.10 0.09 0.00 -1.03 0.00 0.00 54.13 55.49 1rf6 s LEU 79 Cb 0.11 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.68 1rf6 s LEU 79 CO 0.16 -0.04 -0.12 -0.54 0.23 0.00 0.00 176.35 176.03 1rf6 s LYS 80 N -1.10 1.98 0.25 1.70 -0.14 -0.56 -4.94 119.74 116.93 1rf6 s LYS 80 Ca 0.44 -1.23 -0.31 0.00 -1.36 0.00 0.00 55.97 53.51 1rf6 s LYS 80 Cb -0.29 -2.15 -0.14 0.00 -1.68 0.00 0.00 37.83 33.58 1rf6 s LYS 80 CO 0.36 0.45 1.33 0.00 -0.76 0.00 0.00 175.35 176.73 1rf6 n ALA 81 N 0.31 0.81 -2.02 5.17 0.00 -1.26 -4.42 120.51 119.10 1rf6 n ALA 81 Ca -0.12 0.41 -0.31 0.00 0.00 0.00 0.00 53.44 53.42 1rf6 n ALA 81 Cb 0.54 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 1rf6 n ALA 81 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rf6 s PRO 82 N -0.72 3.75 0.16 0.00 0.04 -1.25 -4.87 135.00 132.11 1rf6 s PRO 82 Ca 0.66 0.65 -0.13 0.00 0.04 0.00 0.00 61.00 62.22 1rf6 s PRO 82 Cb -0.66 -2.23 0.05 0.00 0.04 0.00 0.00 34.50 31.69 1rf6 s PRO 82 CO 0.53 -0.26 1.71 -0.56 0.04 0.00 0.00 177.00 178.45 1rf6 h GLN 83 N 0.62 0.83 -5.07 4.56 -0.00 -1.93 -3.46 115.11 110.66 1rf6 h GLN 83 Ca -0.46 -0.16 -0.60 0.00 -0.00 0.00 0.00 58.65 57.43 1rf6 h GLN 83 Cb 1.19 -0.13 -0.13 0.00 -0.00 0.00 0.00 27.48 28.41 1rf6 h GLN 83 CO 0.62 0.73 -0.50 -0.80 -0.00 0.00 0.00 178.83 178.88 1rf6 s ASN 84 N -6.07 3.22 0.70 0.06 0.01 -1.26 -5.13 114.94 106.48 1rf6 s ASN 84 Ca -0.13 -1.70 -0.16 0.00 -0.71 0.00 0.00 52.86 50.15 1rf6 s ASN 84 Cb 0.12 0.58 0.02 0.00 0.41 0.00 0.00 41.25 42.38 1rf6 s ASN 84 CO 0.79 -0.95 1.25 0.00 -1.51 0.00 0.00 177.10 176.69 1rf6 s ALA 85 N -3.10 2.21 -0.15 0.60 0.00 -1.26 -4.91 121.76 115.15 1rf6 s ALA 85 Ca 0.17 1.06 -0.26 0.00 0.00 0.00 0.00 51.96 52.94 1rf6 s ALA 85 Cb 0.02 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 1rf6 s ALA 85 CO 0.11 -1.79 0.85 -0.51 0.00 0.00 0.00 175.76 174.42 1rf6 s LEU 86 N -4.81 4.19 -0.59 0.00 1.43 0.35 -4.96 118.68 114.29 1rf6 s LEU 86 Ca 0.79 1.23 -0.22 0.00 -1.03 0.00 0.00 54.13 54.90 1rf6 s LEU 86 Cb -0.34 -3.28 0.06 0.00 0.03 0.00 0.00 46.19 42.67 1rf6 s LEU 86 CO 0.43 -0.39 0.86 0.21 0.23 0.00 0.00 176.35 177.69 1rf6 s ASN 87 N 1.13 6.24 0.00 2.29 3.84 -1.26 -1.75 114.94 125.43 1rf6 s ASN 87 Ca 0.40 -0.81 0.28 0.00 0.21 0.00 0.00 52.86 52.93 1rf6 s ASN 87 Cb -0.17 -2.39 1.00 0.00 -0.55 0.00 0.00 41.25 39.15 1rf6 s ASN 87 CO 0.13 -1.23 1.76 0.80 -2.79 0.00 0.00 177.10 175.77 1rf6 n MET 88 N 7.19 0.10 0.00 0.43 1.56 0.22 -4.82 117.12 121.80 1rf6 n MET 88 Ca -0.03 -0.03 0.00 0.00 -0.27 0.00 0.00 57.70 57.37 1rf6 n MET 88 Cb 0.46 -1.50 0.00 0.00 2.15 0.00 0.00 33.22 34.33 1rf6 n MET 88 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1rf6 n GLY 89 N 1.46 4.19 0.39 -5.12 0.00 -1.25 -1.97 105.19 102.90 1rf6 n GLY 89 Ca 0.08 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.33 1rf6 n GLY 89 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rf6 n ASN 90 N 8.18 1.70 -4.56 1.61 2.85 -1.26 -0.31 115.26 123.47 1rf6 n ASN 90 Ca 0.00 -1.35 -0.42 0.00 -0.11 0.00 0.00 54.58 52.70 1rf6 n ASN 90 Cb 0.00 0.45 -0.03 0.00 1.24 0.00 0.00 39.78 41.44 1rf6 n ASN 90 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1rf6 s SER 91 N -1.94 6.37 0.17 1.20 0.15 -0.83 -4.73 113.70 114.08 1rf6 s SER 91 Ca 0.14 -0.13 -0.03 0.00 0.70 0.00 0.00 55.95 56.63 1rf6 s SER 91 Cb 0.14 -2.52 0.04 0.00 -1.71 0.00 0.00 66.02 61.96 1rf6 s SER 91 CO 0.41 -1.46 1.43 1.23 1.20 0.00 0.00 173.24 176.05 1rf6 h GLY 92 N 11.79 0.54 0.69 9.45 0.00 -1.93 -2.92 103.07 120.68 1rf6 h GLY 92 Ca -0.26 -0.74 0.06 0.00 0.00 0.00 0.00 47.33 46.39 1rf6 h GLY 92 CO 1.17 0.66 0.36 -0.84 0.00 0.00 0.00 176.54 177.89 1rf6 h THR 93 N 0.34 0.97 0.80 4.70 2.02 -1.97 -1.05 112.91 118.72 1rf6 h THR 93 Ca -0.03 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 1rf6 h THR 93 Cb 1.28 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1rf6 h THR 93 CO 0.13 0.12 -0.48 0.28 0.37 0.00 0.00 175.52 175.94 1rf6 h SER 94 N 0.67 -1.21 -0.72 4.18 0.02 -1.89 -0.98 113.55 113.61 1rf6 h SER 94 Ca 0.29 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.27 1rf6 h SER 94 Cb 0.18 0.35 -0.03 0.00 0.14 0.00 0.00 62.40 63.03 1rf6 h SER 94 CO -0.18 -0.75 0.31 -0.29 -1.14 0.00 0.00 176.83 174.78 1rf6 h ILE 95 N -1.20 1.24 -0.06 3.27 2.10 -1.37 0.61 117.51 122.10 1rf6 h ILE 95 Ca -0.11 -0.74 -0.09 0.00 1.08 0.00 0.00 64.86 65.00 1rf6 h ILE 95 Cb 0.96 0.35 0.00 0.00 -1.09 0.00 0.00 36.82 37.04 1rf6 h ILE 95 CO 0.11 0.31 -0.31 0.03 -1.08 0.00 0.00 178.15 177.21 1rf6 h ARG 96 N 1.06 0.31 -0.22 2.19 3.08 -1.20 -2.35 114.38 117.25 1rf6 h ARG 96 Ca 0.25 -0.26 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 1rf6 h ARG 96 Cb 0.18 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 1rf6 h ARG 96 CO -0.02 0.90 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.56 1rf6 h LEU 97 N -0.20 0.52 -2.18 3.04 3.38 -1.15 -2.93 115.31 115.78 1rf6 h LEU 97 Ca -0.02 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 1rf6 h LEU 97 Cb 0.96 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1rf6 h LEU 97 CO 0.06 0.85 -0.03 0.40 0.09 0.00 0.00 178.44 179.81 1rf6 h ILE 98 N 0.20 0.14 -0.59 1.22 2.04 -0.96 -1.29 117.51 118.27 1rf6 h ILE 98 Ca 0.04 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.53 1rf6 h ILE 98 Cb 0.67 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 38.00 1rf6 h ILE 98 CO 0.04 0.03 0.11 0.28 0.00 0.00 0.00 178.15 178.61 1rf6 h SER 99 N 0.00 0.89 0.47 1.72 0.02 -1.22 -0.74 113.55 114.68 1rf6 h SER 99 Ca -0.00 -0.19 -0.20 0.00 -0.84 0.00 0.00 61.79 60.56 1rf6 h SER 99 Cb 0.26 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1rf6 h SER 99 CO 0.00 0.89 -0.87 1.23 -1.14 0.00 0.00 176.83 176.94 1rf6 h GLY 100 N 1.02 0.31 1.13 -3.77 0.00 -1.29 -3.12 103.07 97.35 1rf6 h GLY 100 Ca 0.19 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 1rf6 h GLY 100 CO 0.01 0.47 0.50 -2.08 0.00 0.00 0.00 176.54 175.43 1rf6 h VAL 101 N 0.16 1.24 -0.17 4.60 2.07 -0.92 -2.30 116.25 120.92 1rf6 h VAL 101 Ca -0.05 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1rf6 h VAL 101 Cb 1.48 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1rf6 h VAL 101 CO 0.14 0.25 0.00 0.18 0.02 0.00 0.00 177.57 178.16 1rf6 n LEU 102 N -4.36 1.14 -0.15 2.57 4.32 -0.32 -4.27 117.00 115.92 1rf6 n LEU 102 Ca 0.09 -0.53 0.16 0.00 -0.02 0.00 0.00 56.01 55.70 1rf6 n LEU 102 Cb 0.07 -0.11 0.52 0.00 -1.62 0.00 0.00 43.42 42.27 1rf6 n LEU 102 CO 0.38 0.27 1.21 0.00 -1.22 0.00 0.00 177.39 178.02 1rf6 h ALA 103 N 3.61 2.14 -0.41 -1.18 0.00 -1.35 -1.58 119.26 120.48 1rf6 h ALA 103 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rf6 h ALA 103 Cb 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1rf6 h ALA 103 CO 0.00 -0.33 0.00 0.41 0.00 0.00 0.00 179.25 179.33 1rf6 n GLY 104 N -1.53 1.42 3.70 0.00 0.00 -1.26 -1.89 105.19 105.63 1rf6 n GLY 104 Ca 0.14 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 1rf6 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf6 s ALA 105 N -1.46 3.56 -0.81 4.61 0.00 -0.60 -4.40 121.76 122.66 1rf6 s ALA 105 Ca 0.38 0.99 -0.04 0.00 0.00 0.00 0.00 51.96 53.28 1rf6 s ALA 105 Cb 0.21 -3.55 0.09 0.00 0.00 0.00 0.00 23.12 19.87 1rf6 s ALA 105 CO 0.29 -0.71 2.60 -3.47 0.00 0.00 0.00 175.76 174.47 1rf6 n ASP 106 N 4.51 7.11 -3.73 0.00 4.64 -1.26 -1.61 116.55 126.21 1rf6 n ASP 106 Ca 0.12 -3.20 -0.04 0.00 -1.38 0.00 0.00 54.79 50.29 1rf6 n ASP 106 Cb 0.43 -1.28 -0.01 0.00 -1.04 0.00 0.00 41.12 39.22 1rf6 n ASP 106 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1rf6 s PHE 107 N -1.57 -0.15 -0.12 -0.67 -0.12 -1.26 -5.02 117.98 109.08 1rf6 s PHE 107 Ca 0.57 -0.14 0.00 0.00 -0.05 0.00 0.00 56.93 57.30 1rf6 s PHE 107 Cb 0.30 0.63 -0.02 0.00 -0.63 0.00 0.00 43.02 43.30 1rf6 s PHE 107 CO -0.17 -0.81 -0.12 -2.00 -0.05 0.00 0.00 175.22 172.08 1rf6 s GLU 108 N -3.27 3.24 0.12 1.99 2.12 -1.26 -3.31 118.70 118.32 1rf6 s GLU 108 Ca 0.12 -0.66 0.04 0.00 0.36 0.00 0.00 54.97 54.84 1rf6 s GLU 108 Cb -0.01 -2.63 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 1rf6 s GLU 108 CO 0.01 0.32 -0.11 0.14 -0.54 0.00 0.00 175.26 175.08 1rf6 s VAL 109 N 0.10 1.10 -0.00 3.70 -7.23 0.59 -4.95 120.40 113.70 1rf6 s VAL 109 Ca -0.05 -1.77 -0.00 0.00 -1.81 0.00 0.00 61.98 58.35 1rf6 s VAL 109 Cb -0.14 -1.53 -0.04 0.00 0.56 0.00 0.00 36.38 35.23 1rf6 s VAL 109 CO 0.04 -0.58 0.08 -0.70 -0.31 0.00 0.00 175.10 173.63 1rf6 s GLU 110 N -3.02 3.04 -0.08 4.82 2.12 -1.26 -0.27 118.70 124.05 1rf6 s GLU 110 Ca 0.09 -0.50 -0.01 0.00 0.36 0.00 0.00 54.97 54.91 1rf6 s GLU 110 Cb -0.02 -2.84 0.03 0.00 0.26 0.00 0.00 34.13 31.55 1rf6 s GLU 110 CO 0.01 0.64 -0.02 -1.64 -0.54 0.00 0.00 175.26 173.71 1rf6 s MET 111 N -1.76 0.83 0.39 4.30 -1.94 0.37 -0.50 119.30 121.00 1rf6 s MET 111 Ca 0.23 0.01 0.05 0.00 -1.71 0.00 0.00 55.69 54.27 1rf6 s MET 111 Cb -0.12 -1.10 -0.07 0.00 2.01 0.00 0.00 34.83 35.55 1rf6 s MET 111 CO 0.14 -0.28 0.03 -0.59 -0.01 0.00 0.00 175.02 174.31 1rf6 s PHE 112 N 1.83 2.25 0.35 -0.03 -0.71 -0.72 -0.56 117.98 120.39 1rf6 s PHE 112 Ca 0.04 -0.81 -0.00 0.00 -1.04 0.00 0.00 56.93 55.11 1rf6 s PHE 112 Cb -0.12 -1.58 -0.00 0.00 -1.21 0.00 0.00 43.02 40.10 1rf6 s PHE 112 CO -0.05 0.26 0.45 0.20 -1.34 0.00 0.00 175.22 174.73 1rf6 s GLY 113 N -3.65 1.69 0.22 1.99 0.00 -1.26 -0.61 107.32 105.70 1rf6 s GLY 113 Ca 0.32 -1.65 -0.04 0.00 0.00 0.00 0.00 44.72 43.36 1rf6 s GLY 113 CO 0.16 -1.09 0.24 2.09 0.00 0.00 0.00 173.10 174.49 1rf6 n ASP 114 N -1.52 -0.61 -0.15 1.64 3.85 0.57 -4.62 116.55 115.72 1rf6 n ASP 114 Ca 0.02 -0.86 0.02 0.00 -0.71 0.00 0.00 54.79 53.27 1rf6 n ASP 114 Cb 0.62 -0.20 0.31 0.00 -1.35 0.00 0.00 41.12 40.50 1rf6 n ASP 114 CO 0.00 0.00 0.00 -2.24 -1.01 0.00 0.00 177.20 173.95 1rf6 h ASP 115 N -0.86 0.72 0.23 -1.12 -0.00 -1.99 -1.91 116.42 111.49 1rf6 h ASP 115 Ca -0.08 -0.02 -0.01 0.00 -0.00 0.00 0.00 57.03 56.92 1rf6 h ASP 115 Cb 0.24 -0.18 0.00 0.00 -0.00 0.00 0.00 39.33 39.40 1rf6 h ASP 115 CO 0.06 0.51 -0.11 -1.28 -0.00 0.00 0.00 179.24 178.42 1rf6 h SER 116 N 0.85 -0.26 -0.96 4.15 0.87 -1.88 -3.30 113.55 113.01 1rf6 h SER 116 Ca 0.25 -0.26 0.04 0.00 -1.23 0.00 0.00 61.79 60.58 1rf6 h SER 116 Cb -0.04 0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 61.93 1rf6 h SER 116 CO -0.06 0.19 0.63 0.25 -0.53 0.00 0.00 176.83 177.31 1rf6 h LEU 117 N -0.80 1.04 0.00 2.23 6.46 -1.79 -2.34 115.31 120.11 1rf6 h LEU 117 Ca -0.03 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 1rf6 h LEU 117 Cb 0.51 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1rf6 h LEU 117 CO 0.05 0.70 0.00 -1.20 -0.62 0.00 0.00 178.44 177.38 1rf6 n SER 118 N -4.45 0.00 -1.02 1.25 7.64 -0.73 -1.36 113.62 114.96 1rf6 n SER 118 Ca 0.13 0.48 0.11 0.00 1.01 0.00 0.00 58.87 60.60 1rf6 n SER 118 Cb 0.11 -0.49 0.18 0.00 -1.01 0.00 0.00 64.21 63.01 1rf6 n SER 118 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1rf6 n LYS 119 N -1.49 2.32 -4.03 1.43 5.02 -0.88 -4.13 118.16 116.40 1rf6 n LYS 119 Ca 0.01 -2.12 -0.35 0.00 -2.02 0.00 0.00 58.31 53.83 1rf6 n LYS 119 Cb 0.05 -1.46 -0.09 0.00 -0.02 0.00 0.00 35.03 33.51 1rf6 n LYS 119 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1rf6 s ARG 120 N -1.42 3.81 0.25 1.97 0.52 -0.46 -5.05 118.95 118.55 1rf6 s ARG 120 Ca 0.34 -0.33 -0.30 0.00 -0.52 0.00 0.00 55.73 54.92 1rf6 s ARG 120 Cb 0.20 -3.16 -0.11 0.00 0.52 0.00 0.00 34.95 32.40 1rf6 s ARG 120 CO 0.28 0.38 1.54 -1.25 0.02 0.00 0.00 175.30 176.27 1rf6 s PRO 121 N 0.06 4.19 0.00 3.54 0.04 -1.26 -4.26 135.00 137.32 1rf6 s PRO 121 Ca 0.06 2.44 0.06 0.00 0.04 0.00 0.00 61.00 63.59 1rf6 s PRO 121 Cb -0.12 -3.08 0.03 0.00 0.04 0.00 0.00 34.50 31.37 1rf6 s PRO 121 CO 0.01 -0.55 0.62 -1.33 0.04 0.00 0.00 177.00 175.78 1rf6 n MET 122 N 2.64 0.56 -0.02 4.56 2.81 -0.68 -4.62 117.12 122.37 1rf6 n MET 122 Ca 0.09 -0.73 0.16 0.00 -1.81 0.00 0.00 57.70 55.41 1rf6 n MET 122 Cb 0.38 -1.06 0.61 0.00 -0.71 0.00 0.00 33.22 32.45 1rf6 n MET 122 CO 0.00 0.00 0.00 0.38 1.51 0.00 0.00 175.97 177.86 1rf6 h ASP 123 N 0.98 0.15 0.07 7.83 3.04 -1.58 0.11 116.42 127.02 1rf6 h ASP 123 Ca 0.00 0.01 -0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1rf6 h ASP 123 Cb 0.22 -0.03 -0.00 0.00 -1.04 0.00 0.00 39.33 38.49 1rf6 h ASP 123 CO 0.00 0.08 -0.01 0.08 -2.04 0.00 0.00 179.24 177.35 1rf6 h ARG 124 N 0.16 0.00 0.00 4.15 0.11 -1.87 -1.37 114.38 115.56 1rf6 h ARG 124 Ca 0.25 0.00 -0.24 0.00 0.10 0.00 0.00 59.98 60.09 1rf6 h ARG 124 Cb 0.77 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.81 1rf6 h ARG 124 CO -0.04 0.01 -1.91 1.55 0.10 0.00 0.00 179.97 179.68 1rf6 n VAL 125 N -3.47 0.91 -0.05 0.08 3.14 0.24 -4.56 118.33 114.63 1rf6 n VAL 125 Ca -0.03 -0.47 -0.06 0.00 -2.96 0.00 0.00 64.34 60.82 1rf6 n VAL 125 Cb 0.10 -0.84 0.13 0.00 -1.06 0.00 0.00 33.84 32.17 1rf6 n VAL 125 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 1rf6 h THR 126 N 0.00 1.27 0.34 1.55 1.35 -0.97 -2.34 112.91 114.11 1rf6 h THR 126 Ca -0.36 -1.31 -0.00 0.00 -0.55 0.00 0.00 66.41 64.19 1rf6 h THR 126 Cb 1.70 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 69.37 1rf6 h THR 126 CO -0.01 0.43 -0.33 0.25 -0.25 0.00 0.00 175.52 175.61 1rf6 h LEU 127 N 0.57 -0.89 -0.62 3.87 6.46 -1.50 -0.75 115.31 122.45 1rf6 h LEU 127 Ca 0.08 0.08 -0.13 0.00 -0.12 0.00 0.00 57.88 57.79 1rf6 h LEU 127 Cb 0.71 0.30 -0.01 0.00 -0.73 0.00 0.00 40.66 40.93 1rf6 h LEU 127 CO 0.05 -0.47 -0.27 1.55 -0.62 0.00 0.00 178.44 178.69 1rf6 h PRO 128 N -0.69 0.80 -0.59 5.25 0.13 -1.80 -3.07 132.00 132.03 1rf6 h PRO 128 Ca -0.02 -0.35 -0.01 0.00 -0.87 0.00 0.00 66.00 64.75 1rf6 h PRO 128 Cb 0.63 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.70 1rf6 h PRO 128 CO -0.06 0.97 0.33 -0.07 -0.23 0.00 0.00 178.00 178.95 1rf6 h LEU 129 N 0.68 0.71 -1.50 1.56 4.07 -1.28 -1.69 115.31 117.87 1rf6 h LEU 129 Ca 0.08 -0.05 -0.05 0.00 0.08 0.00 0.00 57.88 57.94 1rf6 h LEU 129 Cb 0.80 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 1rf6 h LEU 129 CO 0.07 0.57 -0.26 0.11 -1.08 0.00 0.00 178.44 177.85 1rf6 h LYS 130 N 0.82 0.00 0.00 1.13 1.57 -1.04 -1.81 116.57 117.24 1rf6 h LYS 130 Ca 0.21 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 1rf6 h LYS 130 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1rf6 h LYS 130 CO -0.04 0.26 -0.15 0.87 -0.57 0.00 0.00 179.45 179.82 1rf6 h LYS 131 N 0.00 0.00 -0.00 3.15 1.57 -1.28 -2.05 116.57 117.96 1rf6 h LYS 131 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1rf6 h LYS 131 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1rf6 h LYS 131 CO 0.03 0.15 -0.26 -1.33 -0.57 0.00 0.00 179.45 177.47 1rf6 n MET 132 N -3.63 0.04 0.00 3.15 2.81 -0.70 -4.83 117.12 113.95 1rf6 n MET 132 Ca -0.01 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.86 1rf6 n MET 132 Cb 0.28 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 1rf6 n MET 132 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rf6 n GLY 133 N 1.49 0.91 3.76 3.03 0.00 -0.77 -0.97 105.19 112.64 1rf6 n GLY 133 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1rf6 n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf6 s VAL 134 N -2.00 4.34 -0.36 1.61 1.01 -1.05 -4.64 120.40 119.31 1rf6 s VAL 134 Ca 0.00 1.84 -0.12 0.00 0.00 0.00 0.00 61.98 63.71 1rf6 s VAL 134 Cb 0.00 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.18 1rf6 s VAL 134 CO 0.00 0.48 0.21 -0.44 0.00 0.00 0.00 175.10 175.35 1rf6 s SER 135 N -0.91 5.80 -0.03 3.32 0.01 -0.68 -3.90 113.70 117.31 1rf6 s SER 135 Ca 0.39 -0.75 -0.01 0.00 1.31 0.00 0.00 55.95 56.89 1rf6 s SER 135 Cb -0.24 -2.06 0.02 0.00 0.21 0.00 0.00 66.02 63.96 1rf6 s SER 135 CO 0.28 -0.32 0.06 -0.63 0.41 0.00 0.00 173.24 173.04 1rf6 s ILE 136 N 1.62 -0.03 0.02 1.44 1.01 -1.26 -0.74 121.20 123.25 1rf6 s ILE 136 Ca 0.04 0.12 -0.10 0.00 0.00 0.00 0.00 60.65 60.72 1rf6 s ILE 136 Cb -0.18 -0.11 0.01 0.00 0.01 0.00 0.00 42.46 42.18 1rf6 s ILE 136 CO 0.08 0.05 0.20 -0.44 0.00 0.00 0.00 174.94 174.83 1rf6 s SER 137 N 0.68 -0.01 0.00 3.58 0.01 -1.05 -4.98 113.70 111.93 1rf6 s SER 137 Ca -0.05 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 56.98 1rf6 s SER 137 Cb -0.08 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.42 1rf6 s SER 137 CO -0.02 -0.47 0.00 0.61 0.41 0.00 0.00 173.24 173.76 1rf6 n GLY 138 N 1.05 5.01 3.72 3.44 0.00 -1.26 -1.98 105.19 115.17 1rf6 n GLY 138 Ca -0.21 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1rf6 n GLY 138 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rf6 s GLN 139 N -0.13 4.51 0.35 1.61 -1.52 0.12 -4.67 119.66 119.93 1rf6 s GLN 139 Ca 0.00 1.15 0.00 0.00 -1.95 0.00 0.00 55.36 54.56 1rf6 s GLN 139 Cb 0.00 -3.43 0.00 0.00 -0.22 0.00 0.00 33.01 29.36 1rf6 s GLN 139 CO 0.00 0.09 0.00 0.25 -0.25 0.00 0.00 175.29 175.38 1rf6 n THR 140 N 3.50 0.00 0.30 -0.19 -2.24 -1.26 -0.82 114.28 113.56 1rf6 n THR 140 Ca 0.01 0.29 0.13 0.00 -2.27 0.00 0.00 64.05 62.21 1rf6 n THR 140 Cb 0.51 -0.66 0.61 0.00 -2.10 0.00 0.00 70.33 68.69 1rf6 n THR 140 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1rf6 h GLU 141 N -1.05 0.00 -0.00 -0.78 -0.00 -2.01 -0.34 114.58 110.40 1rf6 h GLU 141 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.31 1rf6 h GLU 141 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.78 1rf6 h GLU 141 CO 0.03 0.00 -0.04 0.54 -0.00 0.00 0.00 179.01 179.54 1rf6 n ARG 142 N -2.41 0.77 -3.67 1.06 1.74 -1.26 -4.78 116.66 108.10 1rf6 n ARG 142 Ca 0.00 -0.15 -0.27 0.00 -0.77 0.00 0.00 57.85 56.66 1rf6 n ARG 142 Cb 0.16 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.14 1rf6 n ARG 142 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1rf6 n ASP 143 N -0.98 -4.02 -4.80 0.55 8.00 -0.14 -1.69 116.55 113.47 1rf6 n ASP 143 Ca 0.17 -0.95 -0.34 0.00 0.71 0.00 0.00 54.79 54.39 1rf6 n ASP 143 Cb 0.23 -3.66 -0.02 0.00 -0.02 0.00 0.00 41.12 37.65 1rf6 n ASP 143 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rf6 s LEU 144 N -6.46 3.73 0.91 0.64 1.43 -0.00 -2.55 118.68 116.38 1rf6 s LEU 144 Ca 0.32 1.90 -0.11 0.00 -1.03 0.00 0.00 54.13 55.22 1rf6 s LEU 144 Cb -0.10 -4.55 0.14 0.00 0.03 0.00 0.00 46.19 41.70 1rf6 s LEU 144 CO 0.84 -0.92 1.10 -2.84 0.23 0.00 0.00 176.35 174.76 1rf6 s PRO 145 N -3.50 1.10 0.49 1.29 0.02 -1.26 0.12 135.00 133.27 1rf6 s PRO 145 Ca 0.66 1.16 -0.21 0.00 0.02 0.00 0.00 61.00 62.64 1rf6 s PRO 145 Cb -0.17 -1.76 -0.07 0.00 0.02 0.00 0.00 34.50 32.52 1rf6 s PRO 145 CO 0.26 -2.45 1.10 -1.25 -0.33 0.00 0.00 177.00 174.33 1rf6 s PRO 146 N -4.76 3.64 0.23 5.54 0.04 -1.26 -4.62 135.00 133.81 1rf6 s PRO 146 Ca 0.65 1.57 0.08 0.00 0.04 0.00 0.00 61.00 63.34 1rf6 s PRO 146 Cb -0.20 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 1rf6 s PRO 146 CO 0.58 -0.60 0.02 -0.51 0.04 0.00 0.00 177.00 176.53 1rf6 s LEU 147 N -3.43 3.32 -0.09 -3.56 1.43 0.27 -4.15 118.68 112.47 1rf6 s LEU 147 Ca 0.68 -0.50 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 1rf6 s LEU 147 Cb -0.23 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.12 1rf6 s LEU 147 CO 0.27 0.03 -0.09 -0.13 0.23 0.00 0.00 176.35 176.66 1rf6 s ARG 148 N -3.42 1.55 -0.04 1.70 0.52 -0.84 -0.48 118.95 117.95 1rf6 s ARG 148 Ca 0.30 -0.30 0.05 0.00 -0.52 0.00 0.00 55.73 55.27 1rf6 s ARG 148 Cb -0.08 -1.49 -0.01 0.00 0.52 0.00 0.00 34.95 33.89 1rf6 s ARG 148 CO 0.20 -0.16 -0.21 -1.17 0.02 0.00 0.00 175.30 173.99 1rf6 s LEU 149 N 1.32 2.00 -0.21 2.53 0.20 0.62 -2.54 118.68 122.60 1rf6 s LEU 149 Ca -0.02 -0.40 -0.01 0.00 0.69 0.00 0.00 54.13 54.38 1rf6 s LEU 149 Cb -0.14 -1.11 0.06 0.00 -0.43 0.00 0.00 46.19 44.57 1rf6 s LEU 149 CO -0.04 0.21 -0.00 -0.75 -0.29 0.00 0.00 176.35 175.48 1rf6 s LYS 150 N -0.19 1.06 0.21 1.98 2.20 0.08 -0.30 119.74 124.77 1rf6 s LYS 150 Ca 0.00 -0.64 -0.04 0.00 -0.36 0.00 0.00 55.97 54.94 1rf6 s LYS 150 Cb -0.11 -2.28 0.05 0.00 -1.51 0.00 0.00 37.83 33.98 1rf6 s LYS 150 CO 0.02 -0.61 0.28 0.41 -0.36 0.00 0.00 175.35 175.08 1rf6 n GLY 151 N 4.90 -1.28 3.15 5.54 0.00 -0.63 -1.68 105.19 115.18 1rf6 n GLY 151 Ca -0.10 -1.67 -0.11 0.00 0.00 0.00 0.00 46.02 44.14 1rf6 n GLY 151 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rf6 s THR 152 N -1.60 0.09 -1.88 2.61 -4.23 -0.79 -4.60 115.64 105.23 1rf6 s THR 152 Ca 0.16 -0.73 0.30 0.00 -1.18 0.00 0.00 61.69 60.23 1rf6 s THR 152 Cb -0.00 -0.61 0.62 0.00 1.34 0.00 0.00 72.50 73.85 1rf6 s THR 152 CO 0.11 -0.40 1.97 0.29 -0.54 0.00 0.00 174.62 176.05 1rf6 n LYS 153 N 1.19 0.93 -3.12 3.99 5.02 -1.26 -4.02 118.16 120.89 1rf6 n LYS 153 Ca -0.21 -0.27 -0.28 0.00 -2.02 0.00 0.00 58.31 55.53 1rf6 n LYS 153 Cb 0.57 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.03 1rf6 n LYS 153 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1rf6 n ASN 154 N -0.80 4.34 -4.73 4.39 3.02 -1.26 -5.05 115.26 115.17 1rf6 n ASN 154 Ca 0.18 -3.59 -0.41 0.00 -0.03 0.00 0.00 54.58 50.73 1rf6 n ASN 154 Cb 0.24 -0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.74 1rf6 n ASN 154 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1rf6 s LEU 155 N -3.11 4.43 -0.06 3.41 1.43 -1.26 -4.84 118.68 118.67 1rf6 s LEU 155 Ca 0.45 2.16 -0.12 0.00 -1.03 0.00 0.00 54.13 55.59 1rf6 s LEU 155 Cb 0.22 -3.60 -0.05 0.00 0.03 0.00 0.00 46.19 42.80 1rf6 s LEU 155 CO -0.08 -0.40 0.30 -0.13 0.23 0.00 0.00 176.35 176.26 1rf6 s ARG 156 N 0.20 3.80 0.85 1.70 0.52 -0.14 -3.56 118.95 122.32 1rf6 s ARG 156 Ca 0.55 0.18 -0.13 0.00 -0.52 0.00 0.00 55.73 55.81 1rf6 s ARG 156 Cb -0.32 -3.24 0.06 0.00 0.52 0.00 0.00 34.95 31.97 1rf6 s ARG 156 CO 0.34 0.66 0.84 -0.35 0.02 0.00 0.00 175.30 176.81 1rf6 n PRO 157 N 2.12 -0.04 -4.58 3.54 -0.04 -1.26 -4.51 135.00 130.23 1rf6 n PRO 157 Ca -0.16 0.05 -0.34 0.00 -0.04 0.00 0.00 63.50 63.02 1rf6 n PRO 157 Cb 0.53 -2.15 -0.12 0.00 -0.04 0.00 0.00 33.50 31.73 1rf6 n PRO 157 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rf6 s ILE 158 N -2.24 3.67 -0.28 0.52 1.10 -1.26 -4.81 121.20 117.89 1rf6 s ILE 158 Ca 0.66 -0.47 0.02 0.00 -0.51 0.00 0.00 60.65 60.36 1rf6 s ILE 158 Cb -0.27 -2.54 0.07 0.00 0.15 0.00 0.00 42.46 39.88 1rf6 s ILE 158 CO 0.58 0.56 -0.03 -1.00 -2.11 0.00 0.00 174.94 172.94 1rf6 s HIS 159 N -0.30 2.99 -0.11 3.50 3.76 -1.26 -0.04 115.29 123.84 1rf6 s HIS 159 Ca 0.04 -2.28 -0.07 0.00 -0.15 0.00 0.00 55.06 52.59 1rf6 s HIS 159 Cb -0.13 -2.08 0.04 0.00 1.11 0.00 0.00 32.58 31.52 1rf6 s HIS 159 CO 0.02 -0.87 0.28 -0.47 -0.85 0.00 0.00 174.74 172.85 1rf6 s TYR 160 N 1.18 -0.35 -0.36 1.40 6.14 -0.62 -4.99 117.35 119.75 1rf6 s TYR 160 Ca -0.01 0.82 -0.12 0.00 0.64 0.00 0.00 57.07 58.41 1rf6 s TYR 160 Cb -0.19 0.10 0.01 0.00 0.42 0.00 0.00 41.96 42.29 1rf6 s TYR 160 CO -0.08 -0.21 0.22 -1.21 0.64 0.00 0.00 175.55 174.91 1rf6 s GLU 161 N 0.82 3.08 0.23 4.97 2.02 -1.26 -1.72 118.70 126.84 1rf6 s GLU 161 Ca -0.06 -0.91 -0.31 0.00 0.02 0.00 0.00 54.97 53.71 1rf6 s GLU 161 Cb -0.07 -3.75 -0.11 0.00 0.10 0.00 0.00 34.13 30.30 1rf6 s GLU 161 CO -0.05 -0.60 1.65 -0.51 0.02 0.00 0.00 175.26 175.76 1rf6 s LEU 162 N 1.62 4.36 0.07 1.80 1.02 -0.63 -4.90 118.68 122.01 1rf6 s LEU 162 Ca 0.04 2.86 0.26 0.00 0.02 0.00 0.00 54.13 57.31 1rf6 s LEU 162 Cb -0.18 -3.61 0.78 0.00 0.02 0.00 0.00 46.19 43.19 1rf6 s LEU 162 CO 0.08 -0.92 1.64 -0.81 0.02 0.00 0.00 176.35 176.36 1rf6 n PRO 163 N 3.29 0.11 -4.23 1.29 -0.04 -1.26 -4.10 135.00 130.07 1rf6 n PRO 163 Ca 0.13 0.06 -0.13 0.00 -0.04 0.00 0.00 63.50 63.52 1rf6 n PRO 163 Cb 0.37 -1.60 -0.10 0.00 -0.04 0.00 0.00 33.50 32.13 1rf6 n PRO 163 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1rf6 s ILE 164 N -3.05 0.88 -1.47 0.52 -0.00 -1.26 -5.02 121.20 111.79 1rf6 s ILE 164 Ca 0.11 -2.00 -0.09 0.00 -0.00 0.00 0.00 60.65 58.67 1rf6 s ILE 164 Cb 0.16 -1.90 0.03 0.00 -0.00 0.00 0.00 42.46 40.75 1rf6 s ILE 164 CO 0.63 -0.69 2.52 0.00 -0.00 0.00 0.00 174.94 177.40 1rf6 n ALA 165 N -0.17 6.68 -2.86 2.27 0.00 -1.26 -4.45 120.51 120.71 1rf6 n ALA 165 Ca -0.10 -3.86 -0.36 0.00 0.00 0.00 0.00 53.44 49.13 1rf6 n ALA 165 Cb 0.62 -3.19 -0.11 0.00 0.00 0.00 0.00 19.45 16.77 1rf6 n ALA 165 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rf6 s SER 166 N 1.69 5.50 0.21 0.00 0.15 -1.26 -4.90 113.70 115.10 1rf6 s SER 166 Ca 0.57 -0.03 0.11 0.00 0.70 0.00 0.00 55.95 57.30 1rf6 s SER 166 Cb 0.16 -1.97 -0.00 0.00 -1.71 0.00 0.00 66.02 62.50 1rf6 s SER 166 CO -0.07 0.08 1.40 0.00 1.20 0.00 0.00 173.24 175.85 1rf6 h ALA 167 N 7.42 0.56 -0.12 5.45 0.00 -1.91 -3.14 119.26 127.51 1rf6 h ALA 167 Ca -0.37 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 53.85 1rf6 h ALA 167 Cb 1.17 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1rf6 h ALA 167 CO 0.64 0.92 -0.01 1.96 0.00 0.00 0.00 179.25 182.76 1rf6 h GLN 168 N 0.00 0.22 -0.56 0.00 4.20 -1.93 0.01 115.11 117.04 1rf6 h GLN 168 Ca -0.01 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1rf6 h GLN 168 Cb 1.52 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.25 1rf6 h GLN 168 CO 0.10 0.48 0.29 0.28 -0.67 0.00 0.00 178.83 179.31 1rf6 h VAL 169 N -0.07 1.19 -0.46 -0.54 2.07 -1.92 0.43 116.25 116.95 1rf6 h VAL 169 Ca 0.03 -0.51 0.04 0.00 0.82 0.00 0.00 66.70 67.09 1rf6 h VAL 169 Cb 0.39 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1rf6 h VAL 169 CO 0.01 0.21 0.22 0.50 0.02 0.00 0.00 177.57 178.53 1rf6 h LYS 170 N 0.75 0.42 -0.39 1.57 3.64 -1.48 -1.20 116.57 119.88 1rf6 h LYS 170 Ca 0.20 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 1rf6 h LYS 170 Cb 0.07 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1rf6 h LYS 170 CO -0.03 0.28 0.07 0.77 -2.27 0.00 0.00 179.45 178.27 1rf6 h SER 171 N 0.43 0.61 -0.78 4.20 0.02 -0.57 -0.82 113.55 116.63 1rf6 h SER 171 Ca 0.20 -0.25 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1rf6 h SER 171 Cb 0.13 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.46 1rf6 h SER 171 CO -0.16 0.70 0.50 0.00 -1.14 0.00 0.00 176.83 176.73 1rf6 h ALA 172 N 0.92 1.03 -0.40 3.77 0.00 -0.64 -0.74 119.26 123.21 1rf6 h ALA 172 Ca 0.12 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1rf6 h ALA 172 Cb 0.35 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1rf6 h ALA 172 CO 0.01 0.29 -0.20 -0.07 0.00 0.00 0.00 179.25 179.28 1rf6 h LEU 173 N 0.96 0.78 -0.66 0.00 4.07 -0.97 -2.19 115.31 117.30 1rf6 h LEU 173 Ca 0.32 -0.27 -0.06 0.00 0.08 0.00 0.00 57.88 57.95 1rf6 h LEU 173 Cb 0.03 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 41.53 1rf6 h LEU 173 CO -0.12 0.96 0.19 0.24 -1.08 0.00 0.00 178.44 178.63 1rf6 h MET 174 N 0.68 1.04 -0.29 1.13 2.86 -0.36 0.70 114.93 120.68 1rf6 h MET 174 Ca 0.10 -0.23 -0.09 0.00 -2.06 0.00 0.00 59.70 57.42 1rf6 h MET 174 Cb 0.70 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1rf6 h MET 174 CO 0.05 0.92 -0.20 0.74 1.06 0.00 0.00 176.91 179.48 1rf6 h PHE 175 N 0.97 0.58 -0.22 -0.22 0.05 -0.98 -2.06 116.94 115.05 1rf6 h PHE 175 Ca 0.21 -0.11 -0.20 0.00 3.82 0.00 0.00 57.97 61.69 1rf6 h PHE 175 Cb 0.33 -0.15 0.01 0.00 2.00 0.00 0.00 35.95 38.13 1rf6 h PHE 175 CO 0.02 0.69 -0.64 0.00 -0.18 0.00 0.00 178.31 178.20 1rf6 h ALA 176 N 1.32 0.38 -0.23 2.45 0.00 -1.08 -3.09 119.26 119.01 1rf6 h ALA 176 Ca 0.08 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 1rf6 h ALA 176 Cb 0.61 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1rf6 h ALA 176 CO 0.04 0.66 0.13 0.00 0.00 0.00 0.00 179.25 180.09 1rf6 h ALA 177 N 0.61 1.79 0.00 0.00 0.00 -0.56 -0.64 119.26 120.47 1rf6 h ALA 177 Ca -0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1rf6 h ALA 177 Cb 1.26 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1rf6 h ALA 177 CO 0.14 0.18 -0.06 -0.07 0.00 0.00 0.00 179.25 179.44 1rf6 h LEU 178 N 0.32 0.00 0.00 0.00 4.07 -1.29 -2.88 115.31 115.53 1rf6 h LEU 178 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1rf6 h LEU 178 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1rf6 h LEU 178 CO -0.02 0.06 -1.56 0.00 -1.08 0.00 0.00 178.44 175.84 1rf6 n GLN 179 N -3.36 0.38 -2.83 1.13 6.02 -0.29 -1.36 117.38 117.07 1rf6 n GLN 179 Ca -0.02 -0.11 -0.29 0.00 -0.01 0.00 0.00 57.00 56.57 1rf6 n GLN 179 Cb 0.21 -1.51 -0.02 0.00 1.02 0.00 0.00 30.24 29.93 1rf6 n GLN 179 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rf6 s ALA 180 N -3.29 3.38 -0.41 -1.58 0.00 -0.93 -4.74 121.76 114.19 1rf6 s ALA 180 Ca -0.01 -0.31 -0.20 0.00 0.00 0.00 0.00 51.96 51.44 1rf6 s ALA 180 Cb 0.15 -2.64 0.02 0.00 0.00 0.00 0.00 23.12 20.64 1rf6 s ALA 180 CO 0.89 -0.08 0.60 0.15 0.00 0.00 0.00 175.76 177.31 1rf6 s LYS 181 N -4.07 3.37 0.00 0.00 -0.14 -1.23 -2.01 119.74 115.66 1rf6 s LYS 181 Ca 0.50 -0.33 0.00 0.00 -1.36 0.00 0.00 55.97 54.78 1rf6 s LYS 181 Cb -0.10 -3.91 0.00 0.00 -1.68 0.00 0.00 37.83 32.14 1rf6 s LYS 181 CO 0.35 -0.90 0.00 0.41 -0.76 0.00 0.00 175.35 174.45 1rf6 n GLY 182 N 4.96 0.58 3.61 -3.33 0.00 -0.03 -4.40 105.19 106.58 1rf6 n GLY 182 Ca -0.03 -2.16 -0.38 0.00 0.00 0.00 0.00 46.02 43.45 1rf6 n GLY 182 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rf6 s GLU 183 N -0.79 4.01 -0.01 1.61 2.12 -1.26 -0.53 118.70 123.84 1rf6 s GLU 183 Ca 0.00 -0.12 -0.02 0.00 0.36 0.00 0.00 54.97 55.19 1rf6 s GLU 183 Cb 0.00 -3.64 -0.04 0.00 0.26 0.00 0.00 34.13 30.71 1rf6 s GLU 183 CO 0.00 -0.19 0.15 -1.12 -0.54 0.00 0.00 175.26 173.56 1rf6 s SER 184 N 1.58 6.13 -0.14 -1.70 0.01 -0.35 -4.58 113.70 114.65 1rf6 s SER 184 Ca 0.11 0.28 -0.01 0.00 1.31 0.00 0.00 55.95 57.64 1rf6 s SER 184 Cb -0.16 -1.87 0.03 0.00 0.21 0.00 0.00 66.02 64.24 1rf6 s SER 184 CO 0.10 0.27 -0.05 -0.69 0.41 0.00 0.00 173.24 173.28 1rf6 s VAL 185 N -1.28 0.94 -0.20 3.43 1.01 0.95 -1.48 120.40 123.77 1rf6 s VAL 185 Ca 0.26 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1rf6 s VAL 185 Cb -0.12 -1.08 0.03 0.00 0.00 0.00 0.00 36.38 35.21 1rf6 s VAL 185 CO 0.17 0.21 -0.18 -0.63 0.00 0.00 0.00 175.10 174.67 1rf6 s ILE 186 N 1.72 2.09 -0.18 2.22 1.01 0.73 -1.59 121.20 127.20 1rf6 s ILE 186 Ca 0.03 -1.09 -0.04 0.00 0.00 0.00 0.00 60.65 59.55 1rf6 s ILE 186 Cb -0.14 -1.95 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1rf6 s ILE 186 CO -0.08 0.42 -0.03 -0.63 0.00 0.00 0.00 174.94 174.63 1rf6 s ILE 187 N 1.25 3.81 0.39 2.92 1.01 -0.70 0.28 121.20 130.17 1rf6 s ILE 187 Ca 0.02 -0.37 -0.23 0.00 0.00 0.00 0.00 60.65 60.07 1rf6 s ILE 187 Cb -0.15 -2.70 -0.10 0.00 0.01 0.00 0.00 42.46 39.52 1rf6 s ILE 187 CO -0.11 0.46 0.95 -1.61 0.00 0.00 0.00 174.94 174.63 1rf6 s GLU 188 N 0.78 4.34 -0.01 2.79 2.02 0.07 -1.61 118.70 127.09 1rf6 s GLU 188 Ca -0.01 1.21 -0.22 0.00 0.02 0.00 0.00 54.97 55.97 1rf6 s GLU 188 Cb -0.14 -2.40 -0.22 0.00 0.10 0.00 0.00 34.13 31.46 1rf6 s GLU 188 CO 0.02 0.07 1.11 -0.22 0.02 0.00 0.00 175.26 176.26 1rf6 h LYS 189 N 2.36 0.31 -3.76 1.61 1.63 -1.78 -3.46 116.57 113.47 1rf6 h LYS 189 Ca -0.48 -0.29 -0.14 0.00 -0.85 0.00 0.00 60.65 58.89 1rf6 h LYS 189 Cb 1.19 0.07 -0.19 0.00 -0.60 0.00 0.00 32.23 32.70 1rf6 h LYS 189 CO 0.62 0.97 -0.55 -1.21 -3.45 0.00 0.00 179.45 175.84 1rf6 s GLU 190 N -3.37 0.52 0.11 1.90 0.41 -1.26 -5.02 118.70 111.99 1rf6 s GLU 190 Ca -0.14 -0.65 -0.31 0.00 -0.41 0.00 0.00 54.97 53.46 1rf6 s GLU 190 Cb 0.03 0.20 -0.10 0.00 -1.78 0.00 0.00 34.13 32.49 1rf6 s GLU 190 CO 0.78 -0.12 1.70 0.71 -0.49 0.00 0.00 175.26 177.83 1rf6 s TYR 191 N -2.13 2.49 0.48 1.61 1.51 -1.26 -4.87 117.35 115.18 1rf6 s TYR 191 Ca -0.09 0.27 0.04 0.00 -1.01 0.00 0.00 57.07 56.28 1rf6 s TYR 191 Cb -0.04 -4.04 -0.03 0.00 -0.11 0.00 0.00 41.96 37.75 1rf6 s TYR 191 CO -0.02 -4.13 0.08 0.95 -1.11 0.00 0.00 175.55 171.31 1rf6 s THR 192 N 2.28 1.56 0.07 -0.71 -4.23 -1.26 -4.68 115.64 108.67 1rf6 s THR 192 Ca 0.75 -1.89 -0.36 0.00 -1.18 0.00 0.00 61.69 59.01 1rf6 s THR 192 Cb -0.43 -2.45 -0.16 0.00 1.34 0.00 0.00 72.50 70.80 1rf6 s THR 192 CO 0.33 0.00 1.47 -2.11 -0.54 0.00 0.00 174.62 173.77 1rf6 n ARG 193 N -1.26 1.50 -1.25 3.99 1.85 -1.26 -4.87 116.66 115.35 1rf6 n ARG 193 Ca -0.11 0.54 -0.25 0.00 -1.00 0.00 0.00 57.85 57.03 1rf6 n ARG 193 Cb 0.66 -2.23 0.14 0.00 -1.05 0.00 0.00 32.46 29.98 1rf6 n ARG 193 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 177.63 177.89 1rf6 n ASN 194 N 3.20 4.91 0.00 2.89 6.94 -1.26 -4.67 115.26 127.27 1rf6 n ASN 194 Ca 0.19 -3.71 -0.01 0.00 -0.02 0.00 0.00 54.58 51.03 1rf6 n ASN 194 Cb 0.22 -0.83 0.26 0.00 -2.36 0.00 0.00 39.78 37.07 1rf6 n ASN 194 CO 0.00 0.00 0.00 0.45 -1.03 0.00 0.00 177.26 176.68 1rf6 h HIS 195 N 1.39 0.55 -0.25 -2.53 3.86 -1.99 -2.29 115.15 113.89 1rf6 h HIS 195 Ca 0.55 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.67 1rf6 h HIS 195 Cb 1.95 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 30.26 1rf6 h HIS 195 CO 1.42 0.60 0.11 1.15 0.86 0.00 0.00 177.93 182.08 1rf6 h THR 196 N 0.49 1.16 -0.27 2.45 2.02 -1.97 -0.53 112.91 116.25 1rf6 h THR 196 Ca 0.09 -0.47 0.01 0.00 0.77 0.00 0.00 66.41 66.81 1rf6 h THR 196 Cb 0.45 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1rf6 h THR 196 CO 0.02 0.16 0.16 -0.33 0.37 0.00 0.00 175.52 175.91 1rf6 h GLU 197 N 0.27 0.33 0.28 6.66 3.07 -1.88 0.17 114.58 123.48 1rf6 h GLU 197 Ca 0.09 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.91 1rf6 h GLU 197 Cb 0.15 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 27.99 1rf6 h GLU 197 CO -0.01 0.22 -0.13 -0.44 -1.40 0.00 0.00 179.01 177.25 1rf6 h ASP 198 N 0.34 -0.32 0.38 1.42 3.45 -1.28 -2.98 116.42 117.43 1rf6 h ASP 198 Ca 0.11 0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.51 1rf6 h ASP 198 Cb -0.01 0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.83 1rf6 h ASP 198 CO -0.04 -0.22 -0.31 0.24 -1.57 0.00 0.00 179.24 177.33 1rf6 h MET 199 N -0.38 0.00 -0.47 3.56 2.86 -0.99 -1.72 114.93 117.79 1rf6 h MET 199 Ca -0.04 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1rf6 h MET 199 Cb 0.29 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1rf6 h MET 199 CO 0.06 0.31 0.23 1.25 1.06 0.00 0.00 176.91 179.83 1rf6 h LEU 200 N 0.00 0.61 -0.86 1.22 5.85 -0.86 -0.45 115.31 120.82 1rf6 h LEU 200 Ca -0.00 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 1rf6 h LEU 200 Cb 0.59 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1rf6 h LEU 200 CO 0.04 0.56 0.00 1.56 -0.34 0.00 0.00 178.44 180.26 1rf6 h GLN 201 N 0.62 0.85 -0.35 1.25 4.20 -1.31 0.26 115.11 120.63 1rf6 h GLN 201 Ca 0.16 -0.24 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1rf6 h GLN 201 Cb 0.10 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1rf6 h GLN 201 CO -0.02 0.85 0.03 0.37 -0.67 0.00 0.00 178.83 179.39 1rf6 h GLN 202 N 0.79 0.54 -0.80 1.46 4.15 -0.66 -2.14 115.11 118.45 1rf6 h GLN 202 Ca 0.15 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1rf6 h GLN 202 Cb 0.47 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.08 1rf6 h GLN 202 CO 0.02 0.54 0.00 1.19 -1.93 0.00 0.00 178.83 178.65 1rf6 n PHE 203 N -4.30 0.93 -0.99 3.99 3.01 -0.24 -4.86 117.46 114.99 1rf6 n PHE 203 Ca 0.02 -0.32 0.00 0.00 1.01 0.00 0.00 57.45 58.16 1rf6 n PHE 203 Cb 0.23 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.42 1rf6 n PHE 203 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1rf6 n GLY 204 N 0.29 0.48 3.96 1.37 0.00 -0.80 -1.45 105.19 109.05 1rf6 n GLY 204 Ca 0.12 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1rf6 n GLY 204 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rf6 s GLY 205 N -2.18 1.76 0.03 -0.02 0.00 0.87 -4.90 107.32 102.87 1rf6 s GLY 205 Ca 0.00 -1.44 0.02 0.00 0.00 0.00 0.00 44.72 43.29 1rf6 s GLY 205 CO 0.00 -0.85 -0.06 0.30 0.00 0.00 0.00 173.10 172.49 1rf6 s HIS 206 N -3.36 0.52 0.16 1.90 3.76 -1.26 -4.21 115.29 112.80 1rf6 s HIS 206 Ca 0.67 -0.44 -0.23 0.00 -0.15 0.00 0.00 55.06 54.91 1rf6 s HIS 206 Cb -0.06 -0.32 0.06 0.00 1.11 0.00 0.00 32.58 33.37 1rf6 s HIS 206 CO 0.47 -0.10 0.69 -0.48 -0.85 0.00 0.00 174.74 174.47 1rf6 s LEU 207 N -1.31 -0.44 -0.11 0.89 2.34 -1.26 -4.54 118.68 114.24 1rf6 s LEU 207 Ca -0.10 -0.17 0.03 0.00 0.06 0.00 0.00 54.13 53.96 1rf6 s LEU 207 Cb -0.09 2.52 0.01 0.00 -0.56 0.00 0.00 46.19 48.07 1rf6 s LEU 207 CO -0.00 -1.00 -0.22 -0.44 -1.06 0.00 0.00 176.35 173.63 1rf6 s SER 208 N -2.76 2.92 -0.20 1.48 0.01 -0.10 -4.98 113.70 110.06 1rf6 s SER 208 Ca 0.05 -0.54 -0.01 0.00 1.31 0.00 0.00 55.95 56.76 1rf6 s SER 208 Cb -0.02 -1.34 0.01 0.00 0.21 0.00 0.00 66.02 64.88 1rf6 s SER 208 CO -0.07 0.11 -0.12 -0.69 0.41 0.00 0.00 173.24 172.88 1rf6 s VAL 209 N 0.56 2.69 -0.38 3.43 1.01 -1.26 -0.47 120.40 125.98 1rf6 s VAL 209 Ca -0.14 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1rf6 s VAL 209 Cb -0.17 -2.20 0.12 0.00 0.00 0.00 0.00 36.38 34.13 1rf6 s VAL 209 CO 0.05 0.46 0.15 -0.62 0.00 0.00 0.00 175.10 175.14 1rf6 s ASP 210 N 1.37 4.07 1.72 3.32 3.68 0.06 -5.01 116.67 125.88 1rf6 s ASP 210 Ca 0.05 -2.22 0.00 0.00 2.13 0.00 0.00 52.55 52.51 1rf6 s ASP 210 Cb -0.14 -1.15 0.00 0.00 -1.45 0.00 0.00 42.92 40.18 1rf6 s ASP 210 CO -0.08 -0.34 0.00 0.61 0.13 0.00 0.00 175.17 175.49 1rf6 n GLY 211 N 4.11 2.70 0.20 2.66 0.00 -1.26 -1.12 105.19 112.48 1rf6 n GLY 211 Ca 0.04 -0.26 0.14 0.00 0.00 0.00 0.00 46.02 45.93 1rf6 n GLY 211 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rf6 n LYS 212 N 13.44 0.93 -3.03 1.61 5.02 -1.26 -4.83 118.16 130.03 1rf6 n LYS 212 Ca 0.00 -0.40 -0.41 0.00 -2.02 0.00 0.00 58.31 55.48 1rf6 n LYS 212 Cb 0.00 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.46 1rf6 n LYS 212 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1rf6 s LYS 213 N -2.35 4.20 -0.22 1.97 2.20 -0.27 -0.75 119.74 124.51 1rf6 s LYS 213 Ca 0.31 0.73 -0.02 0.00 -0.36 0.00 0.00 55.97 56.63 1rf6 s LYS 213 Cb 0.20 -3.61 0.01 0.00 -1.51 0.00 0.00 37.83 32.92 1rf6 s LYS 213 CO 0.45 -0.35 -0.08 0.42 -0.36 0.00 0.00 175.35 175.44 1rf6 s ILE 214 N 2.26 2.99 -0.15 5.43 1.01 0.14 -0.76 121.20 132.12 1rf6 s ILE 214 Ca 0.31 -0.73 -0.04 0.00 0.00 0.00 0.00 60.65 60.19 1rf6 s ILE 214 Cb -0.16 -2.39 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 1rf6 s ILE 214 CO 0.10 0.38 -0.02 -0.89 0.00 0.00 0.00 174.94 174.51 1rf6 s THR 215 N 1.40 4.06 -0.05 2.92 2.01 0.39 -0.19 115.64 126.17 1rf6 s THR 215 Ca 0.04 -0.30 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 1rf6 s THR 215 Cb -0.15 -2.78 0.03 0.00 0.01 0.00 0.00 72.50 69.61 1rf6 s THR 215 CO -0.05 0.50 0.01 0.54 -0.69 0.00 0.00 174.62 174.93 1rf6 s VAL 216 N 0.24 0.22 0.26 3.82 0.11 -0.55 -0.93 120.40 123.57 1rf6 s VAL 216 Ca -0.01 0.18 -0.18 0.00 -2.93 0.00 0.00 61.98 59.03 1rf6 s VAL 216 Cb -0.14 -0.38 -0.08 0.00 -1.53 0.00 0.00 36.38 34.25 1rf6 s VAL 216 CO 0.02 0.21 0.73 -1.10 -3.33 0.00 0.00 175.10 171.63 1rf6 s GLN 217 N 1.75 4.16 0.07 1.54 -1.52 -1.26 -1.21 119.66 123.18 1rf6 s GLN 217 Ca 0.01 0.79 0.02 0.00 -1.95 0.00 0.00 55.36 54.23 1rf6 s GLN 217 Cb -0.13 -2.72 -0.03 0.00 -0.22 0.00 0.00 33.01 29.91 1rf6 s GLN 217 CO -0.04 0.31 -0.08 0.20 -0.25 0.00 0.00 175.29 175.44 1rf6 s GLY 218 N -1.87 0.67 0.55 3.09 0.00 0.31 -4.54 107.32 105.52 1rf6 s GLY 218 Ca 0.47 -1.05 -0.07 0.00 0.00 0.00 0.00 44.72 44.07 1rf6 s GLY 218 CO 0.20 -1.12 0.87 2.56 0.00 0.00 0.00 173.10 175.61 1rf6 s PRO 219 N -2.59 3.32 0.16 2.90 0.04 -0.85 -0.85 135.00 137.14 1rf6 s PRO 219 Ca 0.01 0.23 0.06 0.00 0.04 0.00 0.00 61.00 61.33 1rf6 s PRO 219 Cb -0.03 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 1rf6 s PRO 219 CO -0.01 -0.46 -0.12 -0.65 0.04 0.00 0.00 177.00 175.80 1rf6 s GLN 220 N -4.92 1.16 -0.05 4.56 -0.21 -0.46 -5.01 119.66 114.72 1rf6 s GLN 220 Ca 0.51 -1.47 0.05 0.00 0.02 0.00 0.00 55.36 54.47 1rf6 s GLN 220 Cb -0.10 -0.85 -0.01 0.00 1.00 0.00 0.00 33.01 33.04 1rf6 s GLN 220 CO 0.47 0.13 -0.20 0.15 -2.12 0.00 0.00 175.29 173.72 1rf6 s LYS 221 N -3.54 2.07 0.34 2.91 -0.14 -1.26 -4.78 119.74 115.35 1rf6 s LYS 221 Ca 0.18 -0.72 0.08 0.00 -1.36 0.00 0.00 55.97 54.15 1rf6 s LYS 221 Cb 0.00 -1.78 -0.04 0.00 -1.68 0.00 0.00 37.83 34.33 1rf6 s LYS 221 CO 0.03 0.29 0.12 -0.51 -0.76 0.00 0.00 175.35 174.52 1rf6 s LEU 222 N -0.03 3.20 -0.02 3.17 1.43 -1.26 -4.71 118.68 120.46 1rf6 s LEU 222 Ca -0.04 -0.82 0.07 0.00 -1.03 0.00 0.00 54.13 52.31 1rf6 s LEU 222 Cb -0.12 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1rf6 s LEU 222 CO 0.03 -0.29 -0.23 -0.89 0.23 0.00 0.00 176.35 175.20 1rf6 s THR 223 N -2.44 1.80 0.63 5.49 2.01 -0.53 -0.86 115.64 121.74 1rf6 s THR 223 Ca 0.37 -0.97 -0.18 0.00 0.31 0.00 0.00 61.69 61.22 1rf6 s THR 223 Cb -0.02 -1.50 -0.04 0.00 0.01 0.00 0.00 72.50 70.95 1rf6 s THR 223 CO 0.22 0.51 0.87 0.61 -0.69 0.00 0.00 174.62 176.14 1rf6 n GLY 224 N 2.56 -0.60 3.28 4.40 0.00 0.14 -4.68 105.19 110.30 1rf6 n GLY 224 Ca -0.16 -0.20 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 1rf6 n GLY 224 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rf6 s GLN 225 N -2.77 1.36 -0.27 1.61 -1.52 -1.21 -4.88 119.66 111.98 1rf6 s GLN 225 Ca 0.74 -1.63 -0.11 0.00 -1.95 0.00 0.00 55.36 52.42 1rf6 s GLN 225 Cb -0.40 0.32 -0.05 0.00 -0.22 0.00 0.00 33.01 32.65 1rf6 s GLN 225 CO 0.49 -0.48 0.19 0.21 -0.25 0.00 0.00 175.29 175.45 1rf6 s LYS 226 N -4.00 3.99 -0.18 2.91 2.20 -1.26 -1.21 119.74 122.19 1rf6 s LYS 226 Ca 0.36 -0.29 -0.02 0.00 -0.36 0.00 0.00 55.97 55.67 1rf6 s LYS 226 Cb 0.05 -3.62 -0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1rf6 s LYS 226 CO 0.14 -0.11 -0.11 0.08 -0.36 0.00 0.00 175.35 174.99 1rf6 s VAL 227 N 1.56 2.94 -0.38 4.02 1.01 0.11 -4.96 120.40 124.71 1rf6 s VAL 227 Ca 0.08 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.32 1rf6 s VAL 227 Cb -0.15 -2.29 0.05 0.00 0.00 0.00 0.00 36.38 33.99 1rf6 s VAL 227 CO 0.09 0.48 0.18 -0.69 0.00 0.00 0.00 175.10 175.17 1rf6 s VAL 228 N 1.12 4.11 -0.21 2.92 1.01 -1.26 -0.19 120.40 127.89 1rf6 s VAL 228 Ca 0.01 -1.19 -0.29 0.00 0.00 0.00 0.00 61.98 60.51 1rf6 s VAL 228 Cb -0.14 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.85 1rf6 s VAL 228 CO -0.03 -0.32 1.04 -0.69 0.00 0.00 0.00 175.10 175.10 1rf6 s VAL 229 N 1.44 4.68 0.67 2.92 1.01 -0.71 -4.99 120.40 125.42 1rf6 s VAL 229 Ca 0.01 2.02 -0.11 0.00 0.00 0.00 0.00 61.98 63.90 1rf6 s VAL 229 Cb -0.21 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 31.86 1rf6 s VAL 229 CO 0.03 -0.15 1.05 -2.16 0.00 0.00 0.00 175.10 173.87 1rf6 s PRO 230 N 3.05 3.19 0.62 2.72 0.04 -1.26 -4.75 135.00 138.61 1rf6 s PRO 230 Ca 0.45 0.78 -0.19 0.00 0.04 0.00 0.00 61.00 62.08 1rf6 s PRO 230 Cb -0.16 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 1rf6 s PRO 230 CO 0.08 -0.87 1.28 0.20 0.04 0.00 0.00 177.00 177.73 1rf6 s GLY 231 N -4.05 2.84 -0.20 0.56 0.00 0.70 -1.02 107.32 106.15 1rf6 s GLY 231 Ca 0.57 1.18 -0.27 0.00 0.00 0.00 0.00 44.72 46.20 1rf6 s GLY 231 CO 0.54 1.62 0.93 -0.35 0.00 0.00 0.00 173.10 175.84 1rf6 s ASP 232 N -1.38 7.01 0.49 1.64 3.68 -0.62 -0.77 116.67 126.72 1rf6 s ASP 232 Ca 0.80 1.26 0.26 0.00 2.13 0.00 0.00 52.55 57.00 1rf6 s ASP 232 Cb -0.36 -2.49 1.22 0.00 -1.45 0.00 0.00 42.92 39.84 1rf6 s ASP 232 CO 0.39 -0.54 1.97 -0.29 0.13 0.00 0.00 175.17 176.83 1rf6 h ILE 233 N 5.34 0.58 0.00 4.11 2.10 -1.92 -1.45 117.51 126.27 1rf6 h ILE 233 Ca -0.24 -0.80 -0.05 0.00 1.08 0.00 0.00 64.86 64.85 1rf6 h ILE 233 Cb 1.10 1.53 -0.01 0.00 -1.09 0.00 0.00 36.82 38.35 1rf6 h ILE 233 CO 0.90 0.17 -0.25 0.28 -1.08 0.00 0.00 178.15 178.17 1rf6 h SER 234 N 0.00 0.00 0.40 2.19 0.02 -1.92 0.13 113.55 114.37 1rf6 h SER 234 Ca -0.00 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.63 1rf6 h SER 234 Cb 0.51 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1rf6 h SER 234 CO 0.02 0.25 -1.60 0.28 -1.14 0.00 0.00 176.83 174.65 1rf6 h SER 235 N 0.00 0.40 0.36 3.07 0.02 -1.69 -3.30 113.55 112.41 1rf6 h SER 235 Ca -0.00 -0.58 -0.08 0.00 -0.84 0.00 0.00 61.79 60.29 1rf6 h SER 235 Cb 0.61 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1rf6 h SER 235 CO 0.03 1.49 -0.37 0.00 -1.14 0.00 0.00 176.83 176.85 1rf6 h ALA 236 N 0.45 1.38 -0.91 3.77 0.00 -0.87 -3.10 119.26 119.98 1rf6 h ALA 236 Ca -0.27 -0.34 0.22 0.00 0.00 0.00 0.00 54.91 54.52 1rf6 h ALA 236 Cb 2.03 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.69 1rf6 h ALA 236 CO 0.15 0.47 0.61 0.00 0.00 0.00 0.00 179.25 180.48 1rf6 h ALA 237 N 1.62 2.29 -0.19 0.00 0.00 -0.84 0.24 119.26 122.38 1rf6 h ALA 237 Ca -0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1rf6 h ALA 237 Cb 0.66 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1rf6 h ALA 237 CO 0.05 -0.58 -0.15 0.74 0.00 0.00 0.00 179.25 179.31 1rf6 h PHE 238 N 0.36 0.33 0.11 0.00 -1.00 -1.73 -1.64 116.94 113.37 1rf6 h PHE 238 Ca 0.48 -0.04 -0.30 0.00 2.81 0.00 0.00 57.97 60.91 1rf6 h PHE 238 Cb 1.27 -0.09 -0.01 0.00 3.61 0.00 0.00 35.95 40.73 1rf6 h PHE 238 CO -0.00 0.45 -1.50 -1.49 -1.61 0.00 0.00 178.31 174.17 1rf6 h TRP 239 N 0.29 0.42 -0.44 -0.55 -0.00 -1.21 -1.96 115.95 112.51 1rf6 h TRP 239 Ca 0.06 -0.30 0.03 0.00 -0.00 0.00 0.00 58.89 58.68 1rf6 h TRP 239 Cb 0.44 -0.02 -0.04 0.00 -0.00 0.00 0.00 29.16 29.55 1rf6 h TRP 239 CO 0.01 1.34 0.23 -0.07 -0.00 0.00 0.00 178.44 179.95 1rf6 h LEU 240 N 0.06 0.33 -0.26 -4.49 3.38 -0.94 0.13 115.31 113.53 1rf6 h LEU 240 Ca -0.23 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.63 1rf6 h LEU 240 Cb 2.00 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.70 1rf6 h LEU 240 CO 0.16 0.24 -0.35 0.58 0.09 0.00 0.00 178.44 179.16 1rf6 h VAL 241 N 0.45 1.31 -0.65 1.22 2.07 -1.37 -2.87 116.25 116.40 1rf6 h VAL 241 Ca 0.19 -1.54 0.02 0.00 0.82 0.00 0.00 66.70 66.19 1rf6 h VAL 241 Cb 0.08 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 1rf6 h VAL 241 CO -0.12 0.49 0.41 0.00 0.02 0.00 0.00 177.57 178.36 1rf6 h ALA 242 N 0.67 0.84 -0.10 1.67 0.00 -1.02 0.13 119.26 121.44 1rf6 h ALA 242 Ca 0.03 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1rf6 h ALA 242 Cb 0.94 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1rf6 h ALA 242 CO 0.08 0.18 -0.23 0.78 0.00 0.00 0.00 179.25 180.06 1rf6 h GLY 243 N 0.81 0.19 1.54 0.00 0.00 -0.75 0.25 103.07 105.11 1rf6 h GLY 243 Ca 0.26 -0.13 -0.28 0.00 0.00 0.00 0.00 47.33 47.17 1rf6 h GLY 243 CO -0.09 0.12 -1.26 1.41 0.00 0.00 0.00 176.54 176.72 1rf6 h LEU 244 N 0.16 0.53 0.14 3.11 3.38 -1.19 -2.08 115.31 119.37 1rf6 h LEU 244 Ca 0.03 -0.55 -0.33 0.00 0.09 0.00 0.00 57.88 57.12 1rf6 h LEU 244 Cb 0.50 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1rf6 h LEU 244 CO 0.03 1.42 -1.68 0.40 0.09 0.00 0.00 178.44 178.70 1rf6 h ILE 245 N 0.11 0.99 -4.18 1.22 5.03 -0.79 -1.46 117.51 118.44 1rf6 h ILE 245 Ca -0.15 -2.62 -0.49 0.00 -0.12 0.00 0.00 64.86 61.48 1rf6 h ILE 245 Cb 1.97 2.72 0.05 0.00 -3.03 0.00 0.00 36.82 38.53 1rf6 h ILE 245 CO 0.22 0.83 0.38 0.00 -0.68 0.00 0.00 178.15 178.89 1rf6 s ALA 246 N -2.59 2.81 0.55 1.87 0.00 0.86 -4.95 121.76 120.31 1rf6 s ALA 246 Ca -0.13 0.38 -0.14 0.00 0.00 0.00 0.00 51.96 52.07 1rf6 s ALA 246 Cb 0.06 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.91 1rf6 s ALA 246 CO 0.84 -0.65 0.99 -1.25 0.00 0.00 0.00 175.76 175.69 1rf6 s PRO 247 N -3.98 3.78 -1.28 0.00 0.04 -1.26 -4.20 135.00 128.10 1rf6 s PRO 247 Ca 0.63 0.82 -0.26 0.00 0.04 0.00 0.00 61.00 62.23 1rf6 s PRO 247 Cb -0.15 -2.13 0.03 0.00 0.04 0.00 0.00 34.50 32.29 1rf6 s PRO 247 CO 0.34 -0.38 0.55 0.09 0.04 0.00 0.00 177.00 177.64 1rf6 n ASN 248 N -2.07 -3.08 -4.20 6.66 4.13 -1.26 -3.85 115.26 111.59 1rf6 n ASN 248 Ca 0.06 -1.27 -0.19 0.00 1.68 0.00 0.00 54.58 54.86 1rf6 n ASN 248 Cb 0.54 -1.79 -0.12 0.00 -1.54 0.00 0.00 39.78 36.87 1rf6 n ASN 248 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1rf6 s SER 249 N -3.72 1.84 -0.28 6.41 0.01 -1.26 -3.22 113.70 113.47 1rf6 s SER 249 Ca 0.38 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.94 1rf6 s SER 249 Cb -0.21 -0.06 0.17 0.00 0.21 0.00 0.00 66.02 66.13 1rf6 s SER 249 CO 0.97 -0.08 0.55 -0.60 0.41 0.00 0.00 173.24 174.49 1rf6 s ARG 250 N -2.01 0.52 -0.04 12.44 3.52 -0.35 -1.78 118.95 131.26 1rf6 s ARG 250 Ca 0.02 0.98 0.05 0.00 -0.13 0.00 0.00 55.73 56.65 1rf6 s ARG 250 Cb -0.09 0.39 -0.02 0.00 -1.56 0.00 0.00 34.95 33.67 1rf6 s ARG 250 CO 0.03 -0.55 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.27 1rf6 s LEU 251 N 2.79 2.50 -0.25 -0.88 1.02 -0.32 -3.28 118.68 120.26 1rf6 s LEU 251 Ca 0.15 -0.30 -0.02 0.00 0.02 0.00 0.00 54.13 53.98 1rf6 s LEU 251 Cb -0.15 -1.48 0.03 0.00 0.02 0.00 0.00 46.19 44.61 1rf6 s LEU 251 CO -0.19 0.33 -0.06 -0.69 0.02 0.00 0.00 176.35 175.76 1rf6 s VAL 252 N -0.70 2.90 -0.39 -1.59 1.01 -0.60 -1.84 120.40 119.18 1rf6 s VAL 252 Ca 0.11 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 61.03 1rf6 s VAL 252 Cb -0.10 -2.47 0.09 0.00 0.00 0.00 0.00 36.38 33.89 1rf6 s VAL 252 CO 0.00 0.19 0.18 -0.76 0.00 0.00 0.00 175.10 174.72 1rf6 s LEU 253 N 1.33 4.99 0.39 3.92 1.43 0.60 -0.60 118.68 130.73 1rf6 s LEU 253 Ca 0.00 -1.77 -0.05 0.00 -1.03 0.00 0.00 54.13 51.29 1rf6 s LEU 253 Cb -0.17 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1rf6 s LEU 253 CO -0.04 -0.49 0.67 -1.10 0.23 0.00 0.00 176.35 175.61 1rf6 s GLN 254 N 1.23 3.59 -1.33 1.70 -0.21 -0.93 -0.23 119.66 123.47 1rf6 s GLN 254 Ca 0.04 0.07 -0.05 0.00 0.02 0.00 0.00 55.36 55.44 1rf6 s GLN 254 Cb -0.22 -2.51 0.02 0.00 1.00 0.00 0.00 33.01 31.29 1rf6 s GLN 254 CO -0.02 0.01 1.01 -1.71 -2.12 0.00 0.00 175.29 172.46 1rf6 n ASN 255 N -1.67 -3.88 -4.73 5.90 4.05 -1.16 -4.36 115.26 109.42 1rf6 n ASN 255 Ca -0.01 -0.65 -0.35 0.00 0.45 0.00 0.00 54.58 54.02 1rf6 n ASN 255 Cb 0.55 -4.71 -0.08 0.00 1.23 0.00 0.00 39.78 36.77 1rf6 n ASN 255 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1rf6 s VAL 256 N -3.39 5.39 0.28 3.44 1.01 -0.58 -0.21 120.40 126.34 1rf6 s VAL 256 Ca 0.32 0.26 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 1rf6 s VAL 256 Cb -0.15 -3.50 -0.11 0.00 0.00 0.00 0.00 36.38 32.62 1rf6 s VAL 256 CO 0.76 0.43 1.58 -0.83 0.00 0.00 0.00 175.10 177.03 1rf6 s GLY 257 N 0.39 2.08 -0.21 4.51 0.00 0.05 -1.30 107.32 112.85 1rf6 s GLY 257 Ca 0.10 1.53 0.11 0.00 0.00 0.00 0.00 44.72 46.46 1rf6 s GLY 257 CO -0.01 2.53 1.22 4.51 0.00 0.00 0.00 173.10 181.35 1rf6 n ILE 258 N 2.34 2.16 -1.74 0.90 3.06 -0.20 -4.48 119.36 121.39 1rf6 n ILE 258 Ca 0.08 -3.23 -0.42 0.00 -2.50 0.00 0.00 62.75 56.69 1rf6 n ILE 258 Cb 0.38 -0.24 -0.03 0.00 0.54 0.00 0.00 39.64 40.29 1rf6 n ILE 258 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 1rf6 s ASN 259 N -3.22 6.40 0.43 9.51 3.04 -1.26 -4.83 114.94 125.01 1rf6 s ASN 259 Ca 0.38 2.83 0.22 0.00 0.04 0.00 0.00 52.86 56.33 1rf6 s ASN 259 Cb 0.37 -2.59 1.18 0.00 -1.54 0.00 0.00 41.25 38.67 1rf6 s ASN 259 CO -0.07 -0.97 1.79 -0.33 -3.04 0.00 0.00 177.10 174.48 1rf6 h GLU 260 N 7.21 0.31 -0.03 0.43 3.07 -1.97 0.18 114.58 123.78 1rf6 h GLU 260 Ca -0.44 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1rf6 h GLU 260 Cb 1.20 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.04 1rf6 h GLU 260 CO 0.95 0.21 0.00 0.25 -1.40 0.00 0.00 179.01 179.02 1rf6 n THR 261 N -4.53 0.04 -0.11 1.13 -2.24 -1.26 -3.46 114.28 103.84 1rf6 n THR 261 Ca 0.24 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1rf6 n THR 261 Cb 0.91 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 1rf6 n THR 261 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1rf6 n ARG 262 N -0.52 2.89 -0.64 -0.78 5.12 0.60 -4.22 116.66 119.10 1rf6 n ARG 262 Ca 0.07 -0.08 -0.09 0.00 -1.93 0.00 0.00 57.85 55.82 1rf6 n ARG 262 Cb 0.06 -0.42 0.13 0.00 -1.16 0.00 0.00 32.46 31.07 1rf6 n ARG 262 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1rf6 n THR 263 N -0.43 2.07 -0.11 0.55 -2.24 -1.02 -4.53 114.28 108.56 1rf6 n THR 263 Ca 0.00 -1.01 0.06 0.00 -2.27 0.00 0.00 64.05 60.84 1rf6 n THR 263 Cb 0.03 -0.62 0.39 0.00 -2.10 0.00 0.00 70.33 68.03 1rf6 n THR 263 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1rf6 h GLY 264 N 2.84 0.78 2.00 3.38 0.00 -1.67 -1.05 103.07 109.35 1rf6 h GLY 264 Ca 0.27 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.32 1rf6 h GLY 264 CO 0.54 0.21 -0.12 1.19 0.00 0.00 0.00 176.54 178.36 1rf6 h ILE 265 N 0.65 0.45 -0.07 2.60 2.10 -1.80 -2.21 117.51 119.23 1rf6 h ILE 265 Ca 0.25 -0.60 -0.01 0.00 1.08 0.00 0.00 64.86 65.58 1rf6 h ILE 265 Cb 0.18 1.42 -0.00 0.00 -1.09 0.00 0.00 36.82 37.32 1rf6 h ILE 265 CO -0.07 0.11 -0.00 0.40 -1.08 0.00 0.00 178.15 177.51 1rf6 h ILE 266 N 0.00 1.26 -0.84 2.19 1.08 -1.54 -0.31 117.51 119.34 1rf6 h ILE 266 Ca -0.00 -0.80 0.03 0.00 -0.39 0.00 0.00 64.86 63.70 1rf6 h ILE 266 Cb 0.41 1.67 -0.05 0.00 -3.07 0.00 0.00 36.82 35.77 1rf6 h ILE 266 CO 0.01 0.22 0.54 0.44 -0.69 0.00 0.00 178.15 178.68 1rf6 h ASP 267 N -0.18 0.90 -0.27 1.72 3.45 -1.41 -1.15 116.42 119.48 1rf6 h ASP 267 Ca 0.02 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.45 1rf6 h ASP 267 Cb 0.35 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.91 1rf6 h ASP 267 CO 0.00 0.62 0.08 0.58 -1.57 0.00 0.00 179.24 178.95 1rf6 h VAL 268 N 1.05 1.20 -0.89 -1.35 2.07 -1.26 0.06 116.25 117.14 1rf6 h VAL 268 Ca 0.34 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 67.21 1rf6 h VAL 268 Cb 0.01 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1rf6 h VAL 268 CO -0.12 0.22 0.58 0.40 0.02 0.00 0.00 177.57 178.67 1rf6 h ILE 269 N 0.27 1.23 -0.37 4.57 2.04 -0.69 -0.39 117.51 124.17 1rf6 h ILE 269 Ca 0.09 -0.44 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 1rf6 h ILE 269 Cb 0.26 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 1rf6 h ILE 269 CO -0.00 0.23 0.10 0.03 0.00 0.00 0.00 178.15 178.50 1rf6 h ARG 270 N 1.21 0.58 -0.92 2.37 -0.00 -1.00 -0.53 114.38 116.08 1rf6 h ARG 270 Ca 0.32 -0.14 -0.01 0.00 -0.50 0.00 0.00 59.98 59.66 1rf6 h ARG 270 Cb -0.12 -0.08 -0.04 0.00 0.00 0.00 0.00 29.97 29.72 1rf6 h ARG 270 CO -0.07 0.62 0.55 0.00 0.00 0.00 0.00 179.97 181.06 1rf6 h ALA 271 N 0.94 1.18 0.00 0.04 0.00 -0.42 -2.15 119.26 118.84 1rf6 h ALA 271 Ca 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1rf6 h ALA 271 Cb 0.29 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1rf6 h ALA 271 CO -0.00 0.64 0.00 -1.33 0.00 0.00 0.00 179.25 178.56 1rf6 n MET 272 N -4.37 0.51 -1.12 0.00 2.81 -0.21 -4.89 117.12 109.85 1rf6 n MET 272 Ca 0.10 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 1rf6 n MET 272 Cb 0.06 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.07 1rf6 n MET 272 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rf6 n GLY 273 N 1.05 0.51 3.81 3.03 0.00 -0.81 -1.84 105.19 110.93 1rf6 n GLY 273 Ca 0.15 -0.89 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 1rf6 n GLY 273 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rf6 s GLY 274 N -2.86 2.37 -0.70 -0.02 0.00 -0.25 -4.74 107.32 101.12 1rf6 s GLY 274 Ca 0.00 0.49 -0.26 0.00 0.00 0.00 0.00 44.72 44.95 1rf6 s GLY 274 CO 0.00 0.80 1.21 0.54 0.00 0.00 0.00 173.10 175.65 1rf6 s LYS 275 N -3.49 3.22 -0.11 2.90 1.02 -1.26 -4.72 119.74 117.29 1rf6 s LYS 275 Ca 0.65 -0.28 0.01 0.00 0.02 0.00 0.00 55.97 56.38 1rf6 s LYS 275 Cb -0.15 -4.17 0.02 0.00 -0.52 0.00 0.00 37.83 33.02 1rf6 s LYS 275 CO 0.24 -2.03 -0.14 -1.17 -0.92 0.00 0.00 175.35 171.33 1rf6 s LEU 276 N 5.35 1.64 -0.12 3.17 1.98 -1.26 -2.73 118.68 126.71 1rf6 s LEU 276 Ca 0.34 -0.41 0.01 0.00 -2.89 0.00 0.00 54.13 51.18 1rf6 s LEU 276 Cb -0.09 -1.05 -0.01 0.00 0.66 0.00 0.00 46.19 45.70 1rf6 s LEU 276 CO 0.16 -0.01 -0.16 -0.70 -1.89 0.00 0.00 176.35 173.74 1rf6 s GLU 277 N 1.15 3.26 -0.24 1.98 2.12 0.42 -4.97 118.70 122.42 1rf6 s GLU 277 Ca -0.04 -0.74 -0.04 0.00 0.36 0.00 0.00 54.97 54.51 1rf6 s GLU 277 Cb -0.14 -2.52 -0.00 0.00 0.26 0.00 0.00 34.13 31.72 1rf6 s GLU 277 CO -0.04 0.22 -0.01 0.42 -0.54 0.00 0.00 175.26 175.31 1rf6 s ILE 278 N 0.31 3.50 0.37 -3.70 1.01 -1.26 -0.38 121.20 121.04 1rf6 s ILE 278 Ca -0.13 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.00 1rf6 s ILE 278 Cb -0.16 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 1rf6 s ILE 278 CO 0.06 0.33 0.14 0.28 0.00 0.00 0.00 174.94 175.75 1rf6 s THR 279 N 1.48 0.57 -1.41 2.92 -1.32 -0.07 -4.89 115.64 112.93 1rf6 s THR 279 Ca 0.05 -2.00 -0.04 0.00 -1.21 0.00 0.00 61.69 58.48 1rf6 s THR 279 Cb -0.15 -2.45 0.00 0.00 -1.51 0.00 0.00 72.50 68.39 1rf6 s THR 279 CO -0.02 0.00 0.36 -0.62 -2.21 0.00 0.00 174.62 172.13 1rf6 n GLU 280 N -0.79 -2.30 -2.20 7.08 1.02 -1.26 -0.20 120.64 121.99 1rf6 n GLU 280 Ca -0.03 0.31 -0.43 0.00 -0.02 0.00 0.00 57.16 56.99 1rf6 n GLU 280 Cb 0.65 -4.11 -0.02 0.00 -0.02 0.00 0.00 31.44 27.93 1rf6 n GLU 280 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1rf6 s ILE 281 N -4.00 3.82 -0.72 -3.67 1.01 -1.26 -4.21 121.20 112.17 1rf6 s ILE 281 Ca 0.08 0.93 -0.17 0.00 0.00 0.00 0.00 60.65 61.49 1rf6 s ILE 281 Cb -0.03 -3.81 0.15 0.00 0.01 0.00 0.00 42.46 38.77 1rf6 s ILE 281 CO 0.92 -0.32 0.78 -0.62 0.00 0.00 0.00 174.94 175.70 1rf6 s ASP 282 N 3.74 6.44 0.54 3.58 -1.08 -0.09 -4.92 116.67 124.89 1rf6 s ASP 282 Ca 0.67 -1.97 0.26 0.00 -0.52 0.00 0.00 52.55 50.99 1rf6 s ASP 282 Cb -0.23 -2.28 1.43 0.00 -1.46 0.00 0.00 42.92 40.37 1rf6 s ASP 282 CO 0.27 -0.91 1.78 1.55 0.52 0.00 0.00 175.17 178.37 1rf6 h PRO 283 N 8.66 0.00 0.00 4.34 0.13 -1.93 -0.75 132.00 142.46 1rf6 h PRO 283 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1rf6 h PRO 283 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1rf6 h PRO 283 CO 0.99 0.00 0.00 0.28 -0.23 0.00 0.00 178.00 179.04 1rf6 n VAL 284 N -2.62 0.00 0.33 1.56 0.31 -1.26 -4.16 118.33 112.50 1rf6 n VAL 284 Ca -0.02 0.13 0.02 0.00 -0.01 0.00 0.00 64.34 64.47 1rf6 n VAL 284 Cb 0.29 -0.35 0.14 0.00 -0.91 0.00 0.00 33.84 33.01 1rf6 n VAL 284 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rf6 n ALA 285 N -2.47 1.69 -3.41 3.52 0.00 -1.24 -4.84 120.51 113.77 1rf6 n ALA 285 Ca 0.00 -0.03 -0.16 0.00 0.00 0.00 0.00 53.44 53.25 1rf6 n ALA 285 Cb 0.00 -1.08 0.02 0.00 0.00 0.00 0.00 19.45 18.39 1rf6 n ALA 285 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1rf6 n LYS 286 N -0.95 -1.46 -4.25 0.00 4.01 -0.30 -4.82 118.16 110.39 1rf6 n LYS 286 Ca 0.04 0.97 -0.14 0.00 -0.51 0.00 0.00 58.31 58.66 1rf6 n LYS 286 Cb 0.02 -4.62 -0.10 0.00 -0.51 0.00 0.00 35.03 29.82 1rf6 n LYS 286 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1rf6 s SER 287 N -3.18 0.65 0.17 4.39 1.04 -1.12 -1.04 113.70 114.60 1rf6 s SER 287 Ca 0.20 -1.43 -0.24 0.00 0.48 0.00 0.00 55.95 54.97 1rf6 s SER 287 Cb -0.06 0.33 0.07 0.00 0.10 0.00 0.00 66.02 66.46 1rf6 s SER 287 CO 0.81 -0.83 0.99 0.00 0.98 0.00 0.00 173.24 175.19 1rf6 s ALA 288 N -3.96 -1.62 -0.19 5.32 0.00 -0.42 -0.91 121.76 119.98 1rf6 s ALA 288 Ca 0.38 -0.03 -0.08 0.00 0.00 0.00 0.00 51.96 52.24 1rf6 s ALA 288 Cb 0.07 0.67 -0.04 0.00 0.00 0.00 0.00 23.12 23.81 1rf6 s ALA 288 CO 0.14 -1.05 0.07 0.99 0.00 0.00 0.00 175.76 175.91 1rf6 s THR 289 N -2.87 4.86 -0.17 0.00 2.01 0.71 -1.52 115.64 118.66 1rf6 s THR 289 Ca 0.15 -0.01 -0.05 0.00 0.31 0.00 0.00 61.69 62.10 1rf6 s THR 289 Cb -0.02 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.27 1rf6 s THR 289 CO 0.03 0.45 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.64 1rf6 s LEU 290 N 0.45 3.36 -0.13 4.42 1.02 0.67 -0.89 118.68 127.58 1rf6 s LEU 290 Ca 0.04 -0.10 0.02 0.00 0.02 0.00 0.00 54.13 54.11 1rf6 s LEU 290 Cb -0.12 -1.82 0.01 0.00 0.02 0.00 0.00 46.19 44.28 1rf6 s LEU 290 CO 0.00 0.15 -0.17 -0.63 0.02 0.00 0.00 176.35 175.72 1rf6 s ILE 291 N 0.46 1.70 0.11 -0.59 1.01 0.49 -0.29 121.20 124.09 1rf6 s ILE 291 Ca -0.02 -0.76 0.10 0.00 0.00 0.00 0.00 60.65 59.98 1rf6 s ILE 291 Cb -0.14 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 1rf6 s ILE 291 CO 0.02 0.48 -0.26 0.54 0.00 0.00 0.00 174.94 175.72 1rf6 s VAL 292 N 1.02 2.16 0.06 2.92 0.11 -0.77 -0.44 120.40 125.47 1rf6 s VAL 292 Ca -0.04 -1.67 0.02 0.00 -2.93 0.00 0.00 61.98 57.35 1rf6 s VAL 292 Cb -0.15 -1.91 -0.03 0.00 -1.53 0.00 0.00 36.38 32.76 1rf6 s VAL 292 CO -0.04 0.11 -0.07 -1.61 -3.33 0.00 0.00 175.10 170.17 1rf6 s GLU 293 N -1.90 0.62 0.09 1.54 2.02 -1.11 -1.17 118.70 118.79 1rf6 s GLU 293 Ca 0.13 -0.97 -0.36 0.00 0.02 0.00 0.00 54.97 53.79 1rf6 s GLU 293 Cb -0.10 -0.20 -0.17 0.00 0.10 0.00 0.00 34.13 33.76 1rf6 s GLU 293 CO 0.05 0.01 1.27 0.43 0.02 0.00 0.00 175.26 177.04 1rf6 n SER 294 N 0.89 1.38 -3.97 -0.19 7.64 -0.73 -4.24 113.62 114.40 1rf6 n SER 294 Ca -0.19 1.13 -0.08 0.00 1.01 0.00 0.00 58.87 60.74 1rf6 n SER 294 Cb 0.57 -1.16 -0.09 0.00 -1.01 0.00 0.00 64.21 62.52 1rf6 n SER 294 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1rf6 s SER 295 N 0.32 0.28 -0.25 6.43 0.01 -0.55 -4.85 113.70 115.10 1rf6 s SER 295 Ca 0.83 -0.74 -0.11 0.00 1.31 0.00 0.00 55.95 57.24 1rf6 s SER 295 Cb -0.97 0.24 -0.05 0.00 0.21 0.00 0.00 66.02 65.45 1rf6 s SER 295 CO 0.49 -0.59 0.18 -1.81 0.41 0.00 0.00 173.24 171.92 1rf6 s ASP 296 N -2.58 6.10 0.35 2.44 1.01 -1.26 -4.78 116.67 117.94 1rf6 s ASP 296 Ca 0.02 0.09 0.08 0.00 0.71 0.00 0.00 52.55 53.44 1rf6 s ASP 296 Cb 0.03 -2.11 -0.03 0.00 1.01 0.00 0.00 42.92 41.82 1rf6 s ASP 296 CO -0.08 0.02 0.24 -0.76 0.21 0.00 0.00 175.17 174.80 1rf6 s LEU 297 N 1.30 3.43 0.06 1.23 1.43 -1.26 -4.73 118.68 120.14 1rf6 s LEU 297 Ca 0.08 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.57 1rf6 s LEU 297 Cb -0.14 -1.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.06 1rf6 s LEU 297 CO 0.07 -0.36 -0.12 -1.59 0.23 0.00 0.00 176.35 174.58 1rf6 s LYS 298 N -3.94 0.71 1.01 1.70 -2.85 -0.77 -1.19 119.74 114.40 1rf6 s LYS 298 Ca 0.40 -0.87 -0.11 0.00 -1.00 0.00 0.00 55.97 54.39 1rf6 s LYS 298 Cb -0.04 -0.62 0.20 0.00 -2.06 0.00 0.00 37.83 35.31 1rf6 s LYS 298 CO 0.25 0.13 1.10 0.20 0.10 0.00 0.00 175.35 177.13 1rf6 s GLY 299 N -1.67 1.63 0.29 0.59 0.00 -0.58 -4.39 107.32 103.20 1rf6 s GLY 299 Ca -0.05 0.30 -0.14 0.00 0.00 0.00 0.00 44.72 44.83 1rf6 s GLY 299 CO 0.02 0.83 0.59 -1.08 0.00 0.00 0.00 173.10 173.45 1rf6 s THR 300 N -2.59 0.00 -0.17 0.90 -1.32 -1.20 -4.84 115.64 106.42 1rf6 s THR 300 Ca 0.67 -1.27 -0.06 0.00 -1.21 0.00 0.00 61.69 59.83 1rf6 s THR 300 Cb -0.23 -2.32 -0.03 0.00 -1.51 0.00 0.00 72.50 68.40 1rf6 s THR 300 CO 0.60 0.00 0.02 -0.70 -2.21 0.00 0.00 174.62 172.33 1rf6 s GLU 301 N -3.58 3.84 -0.28 7.08 2.12 -1.26 -1.65 118.70 124.97 1rf6 s GLU 301 Ca 0.20 -0.42 0.03 0.00 0.36 0.00 0.00 54.97 55.13 1rf6 s GLU 301 Cb -0.03 -3.08 0.07 0.00 0.26 0.00 0.00 34.13 31.35 1rf6 s GLU 301 CO 0.10 0.26 -0.06 0.42 -0.54 0.00 0.00 175.26 175.45 1rf6 s ILE 302 N 0.35 2.11 0.18 -3.70 1.01 0.89 -4.97 121.20 117.07 1rf6 s ILE 302 Ca -0.00 -1.75 -0.04 0.00 0.00 0.00 0.00 60.65 58.85 1rf6 s ILE 302 Cb -0.13 -2.31 0.02 0.00 0.01 0.00 0.00 42.46 40.04 1rf6 s ILE 302 CO 0.01 -0.18 0.32 0.00 0.00 0.00 0.00 174.94 175.09 1rf6 n GLY 304 N -0.27 2.59 0.25 0.00 0.00 -1.26 -2.52 105.19 103.98 1rf6 n GLY 304 Ca -0.02 -0.29 0.17 0.00 0.00 0.00 0.00 46.02 45.88 1rf6 n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf6 h ALA 305 N -0.67 1.02 0.00 4.61 0.00 -1.98 -1.98 119.26 120.25 1rf6 h ALA 305 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1rf6 h ALA 305 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1rf6 h ALA 305 CO 0.00 -0.02 -0.29 1.25 0.00 0.00 0.00 179.25 180.19 1rf6 h LEU 306 N 0.00 0.00 0.02 0.00 5.85 -1.90 -3.33 115.31 115.94 1rf6 h LEU 306 Ca 0.00 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1rf6 h LEU 306 Cb 0.04 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1rf6 h LEU 306 CO 0.00 0.29 -0.27 0.40 -0.34 0.00 0.00 178.44 178.52 1rf6 h ILE 307 N 0.00 0.39 0.00 4.05 1.08 -1.49 -2.35 117.51 119.19 1rf6 h ILE 307 Ca -0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1rf6 h ILE 307 Cb 0.75 0.39 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1rf6 h ILE 307 CO 0.04 0.00 -0.01 -0.65 -0.69 0.00 0.00 178.15 176.84 1rf6 h PRO 308 N -0.42 0.00 0.00 2.37 0.11 -1.80 0.30 132.00 132.56 1rf6 h PRO 308 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1rf6 h PRO 308 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.61 1rf6 h PRO 308 CO -0.23 0.01 0.00 0.54 -0.21 0.00 0.00 178.00 178.11 1rf6 n ARG 309 N -3.89 0.03 -0.48 1.05 1.74 -0.89 -3.99 116.66 110.23 1rf6 n ARG 309 Ca -0.03 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 1rf6 n ARG 309 Cb 0.09 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.00 1rf6 n ARG 309 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1rf6 n LEU 310 N -1.58 0.00 -0.33 0.55 -0.00 -0.70 -2.02 117.00 112.92 1rf6 n LEU 310 Ca 0.06 -0.96 0.18 0.00 -0.00 0.00 0.00 56.01 55.30 1rf6 n LEU 310 Cb 0.33 0.00 0.39 0.00 -0.00 0.00 0.00 43.42 44.14 1rf6 n LEU 310 CO 0.26 0.53 1.09 -0.29 -0.00 0.00 0.00 177.39 178.98 1rf6 h ILE 311 N 6.06 0.41 0.00 1.47 6.09 -0.58 0.17 117.51 131.14 1rf6 h ILE 311 Ca 0.00 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 63.35 1rf6 h ILE 311 Cb 1.23 -0.03 0.00 0.00 0.47 0.00 0.00 36.82 38.49 1rf6 h ILE 311 CO 0.00 0.07 -0.23 0.47 -3.07 0.00 0.00 178.15 175.39 1rf6 n ASP 312 N -5.02 0.29 -0.54 2.19 8.00 -1.26 -3.52 116.55 116.68 1rf6 n ASP 312 Ca 0.27 0.20 0.13 0.00 0.71 0.00 0.00 54.79 56.10 1rf6 n ASP 312 Cb 0.80 -0.19 0.42 0.00 -0.02 0.00 0.00 41.12 42.13 1rf6 n ASP 312 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1rf6 n GLU 313 N -1.59 1.68 0.04 -1.24 4.71 0.58 -4.33 120.64 120.49 1rf6 n GLU 313 Ca 0.06 -1.08 0.03 0.00 -0.01 0.00 0.00 57.16 56.16 1rf6 n GLU 313 Cb 0.35 -1.48 0.40 0.00 -1.01 0.00 0.00 31.44 29.70 1rf6 n GLU 313 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1rf6 h LEU 314 N 2.65 0.40 -0.35 -4.62 3.38 -1.56 0.29 115.31 115.50 1rf6 h LEU 314 Ca 0.00 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1rf6 h LEU 314 Cb 0.60 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1rf6 h LEU 314 CO 0.00 0.38 0.05 -0.65 0.09 0.00 0.00 178.44 178.31 1rf6 h PRO 315 N 0.44 0.58 -0.00 1.13 0.11 -1.86 -1.21 132.00 131.19 1rf6 h PRO 315 Ca 0.11 -0.16 -0.16 0.00 0.11 0.00 0.00 66.00 65.90 1rf6 h PRO 315 Cb 0.12 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.15 1rf6 h PRO 315 CO -0.01 0.66 -0.75 -0.84 -0.21 0.00 0.00 178.00 176.85 1rf6 h ILE 316 N 0.41 1.51 -0.03 4.15 -0.00 -1.79 -2.74 117.51 119.02 1rf6 h ILE 316 Ca 0.10 -2.50 -0.08 0.00 -0.00 0.00 0.00 64.86 62.39 1rf6 h ILE 316 Cb 0.36 2.35 -0.01 0.00 -0.00 0.00 0.00 36.82 39.52 1rf6 h ILE 316 CO 0.01 0.72 -0.34 0.40 -0.00 0.00 0.00 178.15 178.93 1rf6 h ILE 317 N 0.03 1.26 -0.74 0.16 2.04 -0.87 -1.11 117.51 118.27 1rf6 h ILE 317 Ca -0.01 -1.22 -0.05 0.00 1.00 0.00 0.00 64.86 64.58 1rf6 h ILE 317 Cb 1.32 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.98 1rf6 h ILE 317 CO 0.10 0.35 0.27 0.00 0.00 0.00 0.00 178.15 178.88 1rf6 h ALA 318 N 1.60 0.96 -0.58 1.87 0.00 -0.91 0.36 119.26 122.56 1rf6 h ALA 318 Ca 0.01 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1rf6 h ALA 318 Cb 0.63 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1rf6 h ALA 318 CO 0.05 0.61 0.01 1.25 0.00 0.00 0.00 179.25 181.16 1rf6 h LEU 319 N 1.07 1.00 0.32 0.00 6.46 -1.32 -1.56 115.31 121.28 1rf6 h LEU 319 Ca 0.24 -0.30 -0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1rf6 h LEU 319 Cb 0.25 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.89 1rf6 h LEU 319 CO -0.02 1.06 -0.30 0.25 -0.62 0.00 0.00 178.44 178.81 1rf6 h LEU 320 N 0.91 -0.81 -1.09 2.25 6.46 -0.19 -2.47 115.31 120.37 1rf6 h LEU 320 Ca 0.17 0.07 0.09 0.00 -0.12 0.00 0.00 57.88 58.09 1rf6 h LEU 320 Cb 0.54 0.27 -0.07 0.00 -0.73 0.00 0.00 40.66 40.67 1rf6 h LEU 320 CO 0.03 -0.44 0.61 0.00 -0.62 0.00 0.00 178.44 178.03 1rf6 h ALA 321 N -0.09 1.53 -0.93 1.25 0.00 -0.21 0.41 119.26 121.22 1rf6 h ALA 321 Ca -0.02 -0.00 0.26 0.00 0.00 0.00 0.00 54.91 55.14 1rf6 h ALA 321 Cb 0.59 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1rf6 h ALA 321 CO -0.05 0.28 0.65 1.15 0.00 0.00 0.00 179.25 181.28 1rf6 h THR 322 N 1.01 0.56 -0.01 0.00 2.02 -0.81 0.12 112.91 115.80 1rf6 h THR 322 Ca 0.44 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.58 1rf6 h THR 322 Cb 0.35 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1rf6 h THR 322 CO -0.20 0.02 -0.22 0.00 0.37 0.00 0.00 175.52 175.49 1rf6 n GLN 323 N -4.34 1.30 -3.43 6.66 1.13 0.12 -1.49 117.38 117.33 1rf6 n GLN 323 Ca 0.20 -0.90 -0.30 0.00 -1.94 0.00 0.00 57.00 54.06 1rf6 n GLN 323 Cb 0.93 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 29.75 1rf6 n GLN 323 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1rf6 s ALA 324 N -2.32 3.65 -0.02 -1.58 0.00 0.40 -4.57 121.76 117.32 1rf6 s ALA 324 Ca 0.27 -0.49 -0.30 0.00 0.00 0.00 0.00 51.96 51.43 1rf6 s ALA 324 Cb 0.19 -2.29 -0.03 0.00 0.00 0.00 0.00 23.12 20.99 1rf6 s ALA 324 CO 0.46 0.40 1.04 -0.65 0.00 0.00 0.00 175.76 177.01 1rf6 s GLN 325 N -3.18 4.49 0.10 0.00 -1.52 -0.33 -2.02 119.66 117.20 1rf6 s GLN 325 Ca 0.44 1.49 0.00 0.00 -1.95 0.00 0.00 55.36 55.35 1rf6 s GLN 325 Cb -0.11 -3.47 0.00 0.00 -0.22 0.00 0.00 33.01 29.21 1rf6 s GLN 325 CO 0.26 -0.17 0.00 0.41 -0.25 0.00 0.00 175.29 175.54 1rf6 n GLY 326 N 3.03 -2.42 3.83 3.09 0.00 -1.26 -1.52 105.19 109.94 1rf6 n GLY 326 Ca 0.07 -1.99 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 1rf6 n GLY 326 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf6 s VAL 327 N -0.29 4.89 -0.10 1.61 1.01 -1.26 0.07 120.40 126.34 1rf6 s VAL 327 Ca 0.00 0.93 0.03 0.00 0.00 0.00 0.00 61.98 62.94 1rf6 s VAL 327 Cb 0.00 -3.77 0.01 0.00 0.00 0.00 0.00 36.38 32.61 1rf6 s VAL 327 CO 0.00 0.45 -0.18 0.42 0.00 0.00 0.00 175.10 175.79 1rf6 s THR 328 N -1.23 1.64 -0.14 3.92 -4.23 0.18 -3.22 115.64 112.56 1rf6 s THR 328 Ca 0.30 -0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 60.05 1rf6 s THR 328 Cb -0.17 -1.46 -0.02 0.00 1.34 0.00 0.00 72.50 72.20 1rf6 s THR 328 CO 0.17 0.47 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.93 1rf6 s VAL 329 N 0.68 3.29 -0.16 2.29 1.01 -0.66 -0.91 120.40 125.93 1rf6 s VAL 329 Ca -0.13 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.29 1rf6 s VAL 329 Cb -0.16 -2.40 0.02 0.00 0.00 0.00 0.00 36.38 33.84 1rf6 s VAL 329 CO 0.03 0.51 -0.18 -0.63 0.00 0.00 0.00 175.10 174.83 1rf6 s ILE 330 N 0.37 1.91 0.21 2.22 1.01 -0.59 -0.08 121.20 126.25 1rf6 s ILE 330 Ca -0.09 -0.85 -0.05 0.00 0.00 0.00 0.00 60.65 59.66 1rf6 s ILE 330 Cb -0.15 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 1rf6 s ILE 330 CO 0.05 0.52 0.24 -1.59 0.00 0.00 0.00 174.94 174.15 1rf6 s LYS 331 N 1.27 1.30 -1.28 2.79 -2.85 -0.88 -1.40 119.74 118.69 1rf6 s LYS 331 Ca 0.03 -1.51 0.00 0.00 -1.00 0.00 0.00 55.97 53.49 1rf6 s LYS 331 Cb -0.13 0.33 0.00 0.00 -2.06 0.00 0.00 37.83 35.97 1rf6 s LYS 331 CO -0.11 -0.47 0.00 -0.25 0.10 0.00 0.00 175.35 174.63 1rf6 n ASP 332 N -0.30 -4.39 -1.59 0.03 10.43 -0.98 -4.38 116.55 115.37 1rf6 n ASP 332 Ca 0.01 0.23 -0.15 0.00 2.57 0.00 0.00 54.79 57.45 1rf6 n ASP 332 Cb 0.65 -3.16 0.10 0.00 1.84 0.00 0.00 41.12 40.55 1rf6 n ASP 332 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1rf6 n ALA 333 N 0.48 4.72 0.33 2.24 0.00 0.75 -4.74 120.51 124.30 1rf6 n ALA 333 Ca -0.13 -3.55 0.22 0.00 0.00 0.00 0.00 53.44 49.98 1rf6 n ALA 333 Cb 0.47 -0.53 1.14 0.00 0.00 0.00 0.00 19.45 20.53 1rf6 n ALA 333 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1rf6 h GLU 334 N 1.70 0.00 0.00 0.00 9.09 -1.80 -1.83 114.58 121.74 1rf6 h GLU 334 Ca 0.28 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.69 1rf6 h GLU 334 Cb 1.37 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.47 1rf6 h GLU 334 CO 0.60 0.00 -0.01 0.93 0.05 0.00 0.00 179.01 180.58 1rf6 h GLU 335 N 0.00 0.00 0.00 1.06 4.39 -1.92 -2.19 114.58 115.92 1rf6 h GLU 335 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1rf6 h GLU 335 Cb 0.08 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1rf6 h GLU 335 CO 0.00 0.01 -0.04 -0.07 -1.16 0.00 0.00 179.01 177.75 1rf6 h LEU 336 N 0.00 0.00 -1.97 1.33 3.38 -1.71 -2.03 115.31 114.31 1rf6 h LEU 336 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rf6 h LEU 336 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1rf6 h LEU 336 CO 0.00 0.04 0.00 0.11 0.09 0.00 0.00 178.44 178.68 1rf6 h LYS 337 N 0.00 0.00 -0.47 1.13 1.57 -1.61 -0.85 116.57 116.34 1rf6 h LYS 337 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1rf6 h LYS 337 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1rf6 h LYS 337 CO 0.01 0.00 0.00 1.55 -0.57 0.00 0.00 179.45 180.44 1rf6 n VAL 338 N -2.99 1.92 -0.94 0.50 3.14 -0.76 -4.14 118.33 115.05 1rf6 n VAL 338 Ca -0.01 -1.39 0.00 0.00 -2.96 0.00 0.00 64.34 59.98 1rf6 n VAL 338 Cb 0.20 0.04 0.00 0.00 -1.06 0.00 0.00 33.84 33.02 1rf6 n VAL 338 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1rf6 n LYS 339 N 0.46 1.08 -0.40 1.45 4.76 -1.16 -4.83 118.16 119.53 1rf6 n LYS 339 Ca 0.22 0.00 0.34 0.00 -2.87 0.00 0.00 58.31 56.00 1rf6 n LYS 339 Cb 0.84 0.00 0.66 0.00 -1.84 0.00 0.00 35.03 34.69 1rf6 n LYS 339 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1rf6 h GLU 340 N 0.00 0.14 -4.45 1.97 3.07 -1.92 -3.40 114.58 109.98 1rf6 h GLU 340 Ca 0.00 -0.01 -0.27 0.00 -0.50 0.00 0.00 59.36 58.59 1rf6 h GLU 340 Cb 0.00 -0.03 -0.13 0.00 -0.84 0.00 0.00 28.75 27.75 1rf6 h GLU 340 CO 0.00 0.09 -0.46 0.95 -1.40 0.00 0.00 179.01 178.19 1rf6 s THR 341 N -5.19 0.00 -0.93 1.13 -4.23 -1.26 -4.77 115.64 100.39 1rf6 s THR 341 Ca -0.07 -1.86 -0.24 0.00 -1.18 0.00 0.00 61.69 58.34 1rf6 s THR 341 Cb 0.26 -2.47 0.03 0.00 1.34 0.00 0.00 72.50 71.66 1rf6 s THR 341 CO 0.82 0.00 1.47 -0.62 -0.54 0.00 0.00 174.62 175.74 1rf6 s ASP 342 N -3.19 6.26 0.05 3.99 -1.08 -1.26 -4.50 116.67 116.94 1rf6 s ASP 342 Ca 0.36 -1.09 0.07 0.00 -0.52 0.00 0.00 52.55 51.36 1rf6 s ASP 342 Cb 0.04 -2.57 0.32 0.00 -1.46 0.00 0.00 42.92 39.25 1rf6 s ASP 342 CO 0.16 -1.72 1.21 0.54 0.52 0.00 0.00 175.17 175.88 1rf6 n ARG 343 N 9.01 0.03 -0.07 4.34 1.74 -0.34 -1.12 116.66 130.26 1rf6 n ARG 343 Ca 0.26 0.46 -0.08 0.00 -0.77 0.00 0.00 57.85 57.73 1rf6 n ARG 343 Cb 0.50 -1.57 -0.06 0.00 -1.02 0.00 0.00 32.46 30.31 1rf6 n ARG 343 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1rf6 h ILE 344 N 0.00 0.73 -0.00 0.55 2.04 -1.88 -3.17 117.51 115.77 1rf6 h ILE 344 Ca 0.00 -1.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.26 1rf6 h ILE 344 Cb 0.07 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1rf6 h ILE 344 CO 0.00 0.25 0.00 -0.61 0.00 0.00 0.00 178.15 177.79 1rf6 h GLN 345 N -1.00 0.00 -0.43 2.37 5.75 -1.84 -1.69 115.11 118.28 1rf6 h GLN 345 Ca -0.04 -0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.39 1rf6 h GLN 345 Cb 0.55 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.08 1rf6 h GLN 345 CO -0.02 0.23 -0.03 0.28 -2.65 0.00 0.00 178.83 176.64 1rf6 h VAL 346 N -0.22 1.24 -0.20 2.39 2.07 -1.33 -0.32 116.25 119.88 1rf6 h VAL 346 Ca 0.00 -0.99 -0.17 0.00 0.82 0.00 0.00 66.70 66.36 1rf6 h VAL 346 Cb 0.23 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1rf6 h VAL 346 CO 0.00 0.34 -0.54 0.58 0.02 0.00 0.00 177.57 177.98 1rf6 h VAL 347 N 0.66 1.31 -0.09 2.57 2.07 -1.56 0.11 116.25 121.33 1rf6 h VAL 347 Ca 0.13 -1.76 -0.00 0.00 0.82 0.00 0.00 66.70 65.89 1rf6 h VAL 347 Cb 0.45 1.89 -0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1rf6 h VAL 347 CO 0.02 0.55 0.05 0.00 0.02 0.00 0.00 177.57 178.22 1rf6 h ALA 348 N 0.59 0.12 -0.38 1.67 0.00 -1.16 -1.11 119.26 118.99 1rf6 h ALA 348 Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1rf6 h ALA 348 Cb 1.15 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1rf6 h ALA 348 CO 0.12 -0.35 0.16 -0.44 0.00 0.00 0.00 179.25 178.73 1rf6 h ASP 349 N 0.06 0.51 0.66 0.00 3.32 -1.04 0.90 116.42 120.83 1rf6 h ASP 349 Ca 0.03 -0.15 -0.03 0.00 0.02 0.00 0.00 57.03 56.89 1rf6 h ASP 349 Cb 0.06 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 39.49 1rf6 h ASP 349 CO -0.01 0.53 -0.32 0.00 -1.72 0.00 0.00 179.24 177.73 1rf6 h ALA 350 N 1.01 -0.88 -0.48 3.45 0.00 -0.88 -1.34 119.26 120.14 1rf6 h ALA 350 Ca 0.13 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1rf6 h ALA 350 Cb 0.17 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1rf6 h ALA 350 CO -0.01 -0.98 -0.06 -0.07 0.00 0.00 0.00 179.25 178.13 1rf6 h LEU 351 N -0.91 0.82 -0.90 0.00 3.38 -1.22 -2.77 115.31 113.71 1rf6 h LEU 351 Ca -0.09 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1rf6 h LEU 351 Cb 0.69 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1rf6 h LEU 351 CO 0.15 0.92 0.52 0.78 0.09 0.00 0.00 178.44 180.90 1rf6 h ASN 352 N 0.77 1.10 0.27 -0.43 2.35 -0.78 0.21 115.58 119.05 1rf6 h ASN 352 Ca 0.14 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1rf6 h ASN 352 Cb 0.54 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1rf6 h ASN 352 CO 0.03 0.86 0.00 -1.54 -1.65 0.00 0.00 177.43 175.13 1rf6 n SER 353 N -4.37 0.19 -0.85 5.81 3.41 -0.51 -0.88 113.62 116.42 1rf6 n SER 353 Ca 0.10 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.36 1rf6 n SER 353 Cb 0.07 -0.60 0.17 0.00 -0.26 0.00 0.00 64.21 63.59 1rf6 n SER 353 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1rf6 n MET 354 N -1.74 2.21 0.00 4.33 2.81 0.04 -4.66 117.12 120.11 1rf6 n MET 354 Ca 0.01 -2.00 0.00 0.00 -1.81 0.00 0.00 57.70 53.90 1rf6 n MET 354 Cb 0.10 -1.37 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 1rf6 n MET 354 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rf6 n GLY 355 N 1.00 -0.97 1.97 3.03 0.00 -0.89 0.61 105.19 109.95 1rf6 n GLY 355 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1rf6 n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf6 n ALA 356 N 0.00 0.00 -0.75 4.61 0.00 -0.06 -4.78 120.51 119.53 1rf6 n ALA 356 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1rf6 n ALA 356 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1rf6 n ALA 356 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1rf6 n ASP 357 N -1.13 -0.67 -4.00 0.00 -0.08 -1.26 -4.84 116.55 104.58 1rf6 n ASP 357 Ca 0.00 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.04 1rf6 n ASP 357 Cb 0.00 -0.17 -0.17 0.00 2.34 0.00 0.00 41.12 43.13 1rf6 n ASP 357 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1rf6 s ILE 358 N -1.98 1.05 -0.30 5.18 1.01 -1.26 -1.96 121.20 122.94 1rf6 s ILE 358 Ca 0.00 -0.42 -0.05 0.00 0.00 0.00 0.00 60.65 60.18 1rf6 s ILE 358 Cb 0.00 -0.98 0.03 0.00 0.01 0.00 0.00 42.46 41.52 1rf6 s ILE 358 CO 0.00 0.34 0.05 -0.89 0.00 0.00 0.00 174.94 174.44 1rf6 s THR 359 N 0.79 3.59 0.46 2.92 2.01 1.00 -4.93 115.64 121.49 1rf6 s THR 359 Ca -0.12 -0.98 -0.21 0.00 0.31 0.00 0.00 61.69 60.68 1rf6 s THR 359 Cb -0.15 -2.94 -0.08 0.00 0.01 0.00 0.00 72.50 69.34 1rf6 s THR 359 CO 0.02 -0.01 1.05 -2.16 -0.69 0.00 0.00 174.62 172.83 1rf6 s PRO 360 N 1.41 3.88 0.35 4.92 0.04 -1.26 0.12 135.00 144.45 1rf6 s PRO 360 Ca -0.00 1.44 0.03 0.00 0.04 0.00 0.00 61.00 62.51 1rf6 s PRO 360 Cb -0.18 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 1rf6 s PRO 360 CO 0.01 -0.38 0.11 0.95 0.04 0.00 0.00 177.00 177.73 1rf6 s THR 361 N -1.86 0.69 0.17 1.26 -4.23 -0.13 -4.90 115.64 106.65 1rf6 s THR 361 Ca 0.65 -2.00 0.34 0.00 -1.18 0.00 0.00 61.69 59.50 1rf6 s THR 361 Cb -0.19 -2.52 0.37 0.00 1.34 0.00 0.00 72.50 71.50 1rf6 s THR 361 CO 0.23 0.00 2.04 0.00 -0.54 0.00 0.00 174.62 176.35 1rf6 h ALA 362 N 2.01 1.00 0.00 3.99 0.00 -1.98 -3.15 119.26 121.13 1rf6 h ALA 362 Ca -0.37 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1rf6 h ALA 362 Cb 1.26 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 1rf6 h ALA 362 CO 0.59 0.00 -0.40 -0.40 0.00 0.00 0.00 179.25 179.05 1rf6 n ASP 363 N -2.86 0.78 0.00 0.00 3.85 -1.26 -4.54 116.55 112.52 1rf6 n ASP 363 Ca -0.01 -2.37 0.00 0.00 -0.71 0.00 0.00 54.79 51.71 1rf6 n ASP 363 Cb 0.18 -0.28 0.00 0.00 -1.35 0.00 0.00 41.12 39.67 1rf6 n ASP 363 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1rf6 n GLY 364 N -0.40 -0.57 3.48 6.12 0.00 -1.19 -0.18 105.19 112.44 1rf6 n GLY 364 Ca 0.06 -0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 1rf6 n GLY 364 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1rf6 s MET 365 N -1.29 1.02 -0.22 1.61 0.23 -0.50 -0.95 119.30 119.20 1rf6 s MET 365 Ca 0.00 -0.23 -0.03 0.00 -1.03 0.00 0.00 55.69 54.40 1rf6 s MET 365 Cb 0.00 0.47 0.00 0.00 -1.53 0.00 0.00 34.83 33.78 1rf6 s MET 365 CO 0.00 -0.42 -0.07 0.42 -2.03 0.00 0.00 175.02 172.93 1rf6 s ILE 366 N -2.85 3.11 -0.14 3.16 -1.09 0.12 -1.55 121.20 121.96 1rf6 s ILE 366 Ca 0.00 -0.65 -0.00 0.00 -2.23 0.00 0.00 60.65 57.77 1rf6 s ILE 366 Cb -0.01 -2.43 -0.01 0.00 -1.58 0.00 0.00 42.46 38.43 1rf6 s ILE 366 CO -0.06 0.40 -0.12 -0.63 -1.23 0.00 0.00 174.94 173.29 1rf6 s ILE 367 N 1.43 3.10 0.05 2.92 1.01 -0.09 -0.00 121.20 129.62 1rf6 s ILE 367 Ca 0.05 -0.64 0.07 0.00 0.00 0.00 0.00 60.65 60.13 1rf6 s ILE 367 Cb -0.14 -2.31 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1rf6 s ILE 367 CO -0.05 0.52 -0.17 -0.54 0.00 0.00 0.00 174.94 174.70 1rf6 s LYS 368 N 0.41 2.08 0.00 2.79 3.01 -0.83 0.48 119.74 127.68 1rf6 s LYS 368 Ca -0.10 -0.98 0.00 0.00 -1.01 0.00 0.00 55.97 53.88 1rf6 s LYS 368 Cb -0.16 -2.21 0.00 0.00 -1.01 0.00 0.00 37.83 34.45 1rf6 s LYS 368 CO 0.05 0.54 0.00 0.41 0.51 0.00 0.00 175.35 176.86 1rf6 n GLY 369 N 1.41 0.00 3.69 -3.33 0.00 0.11 -4.66 105.19 102.41 1rf6 n GLY 369 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1rf6 n GLY 369 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rf6 s LYS 370 N -0.67 4.37 -0.07 1.61 2.20 -0.86 -4.46 119.74 121.86 1rf6 s LYS 370 Ca 0.00 0.92 0.01 0.00 -0.36 0.00 0.00 55.97 56.55 1rf6 s LYS 370 Cb 0.00 -3.51 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 1rf6 s LYS 370 CO 0.00 -0.11 -0.10 -1.12 -0.36 0.00 0.00 175.35 173.66 1rf6 s SER 371 N 0.98 4.37 -0.22 1.43 0.01 -0.56 -5.02 113.70 114.69 1rf6 s SER 371 Ca 0.37 -0.12 -0.20 0.00 1.31 0.00 0.00 55.95 57.31 1rf6 s SER 371 Cb -0.17 -1.14 -0.02 0.00 0.21 0.00 0.00 66.02 64.90 1rf6 s SER 371 CO 0.16 0.32 0.62 0.00 0.41 0.00 0.00 173.24 174.75 1rf6 s ALA 372 N -0.58 3.58 0.28 1.44 0.00 -1.26 -4.82 121.76 120.39 1rf6 s ALA 372 Ca 0.09 -0.36 -0.11 0.00 0.00 0.00 0.00 51.96 51.58 1rf6 s ALA 372 Cb -0.12 -2.99 -0.08 0.00 0.00 0.00 0.00 23.12 19.94 1rf6 s ALA 372 CO 0.02 -0.67 0.63 -0.51 0.00 0.00 0.00 175.76 175.23 1rf6 s LEU 373 N 2.17 4.10 0.32 0.00 1.43 -1.26 -4.70 118.68 120.74 1rf6 s LEU 373 Ca 0.27 1.06 0.03 0.00 -1.03 0.00 0.00 54.13 54.46 1rf6 s LEU 373 Cb -0.16 -3.85 -0.05 0.00 0.03 0.00 0.00 46.19 42.16 1rf6 s LEU 373 CO 0.09 -0.15 0.09 -1.38 0.23 0.00 0.00 176.35 175.24 1rf6 s HIS 374 N -1.93 1.76 0.90 0.29 -3.43 0.20 -4.05 115.29 109.04 1rf6 s HIS 374 Ca 0.50 -1.13 -0.13 0.00 -0.80 0.00 0.00 55.06 53.50 1rf6 s HIS 374 Cb -0.11 -1.09 0.06 0.00 -1.43 0.00 0.00 32.58 30.01 1rf6 s HIS 374 CO 0.21 -0.21 0.66 0.41 -2.00 0.00 0.00 174.74 173.81 1rf6 n GLY 375 N -0.64 -1.40 3.57 -1.38 0.00 -1.26 -4.56 105.19 99.51 1rf6 n GLY 375 Ca -0.02 -0.68 0.03 0.00 0.00 0.00 0.00 46.02 45.35 1rf6 n GLY 375 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf6 s ALA 376 N -2.36 -2.45 -0.12 4.61 0.00 -0.21 -4.70 121.76 116.52 1rf6 s ALA 376 Ca 0.62 1.08 -0.00 0.00 0.00 0.00 0.00 51.96 53.66 1rf6 s ALA 376 Cb -0.24 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1rf6 s ALA 376 CO 0.63 -0.99 -0.13 1.03 0.00 0.00 0.00 175.76 176.30 1rf6 s ARG 377 N -2.06 3.33 -0.02 0.00 1.81 -1.26 -1.28 118.95 119.46 1rf6 s ARG 377 Ca 0.14 -0.68 0.04 0.00 -1.72 0.00 0.00 55.73 53.51 1rf6 s ARG 377 Cb 0.06 -2.63 -0.00 0.00 -0.45 0.00 0.00 34.95 31.93 1rf6 s ARG 377 CO -0.06 0.25 -0.13 0.08 -0.68 0.00 0.00 175.30 174.77 1rf6 s VAL 378 N 0.25 1.05 -0.14 3.52 1.01 0.12 -4.94 120.40 121.28 1rf6 s VAL 378 Ca -0.09 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 1rf6 s VAL 378 Cb -0.15 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.29 1rf6 s VAL 378 CO 0.05 0.31 -0.03 0.21 0.00 0.00 0.00 175.10 175.64 1rf6 s ASN 379 N -0.03 4.85 0.46 3.32 2.47 -1.26 -0.30 114.94 124.45 1rf6 s ASN 379 Ca -0.00 -0.08 0.25 0.00 0.42 0.00 0.00 52.86 53.45 1rf6 s ASN 379 Cb -0.08 -1.69 0.99 0.00 -1.45 0.00 0.00 41.25 39.02 1rf6 s ASN 379 CO 0.01 0.21 1.85 0.74 -3.72 0.00 0.00 177.10 176.19 1rf6 h THR 380 N 4.94 0.47 -2.95 -5.21 2.02 -1.68 -3.47 112.91 107.03 1rf6 h THR 380 Ca -0.35 -1.02 -0.34 0.00 0.77 0.00 0.00 66.41 65.48 1rf6 h THR 380 Cb 1.19 1.72 -0.04 0.00 -1.74 0.00 0.00 68.15 69.28 1rf6 h THR 380 CO 0.61 0.18 -0.41 0.49 0.37 0.00 0.00 175.52 176.77 1rf6 n PHE 381 N -3.35 -1.00 -0.95 3.16 0.99 -1.26 -1.46 117.46 113.58 1rf6 n PHE 381 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1rf6 n PHE 381 Cb 0.41 -3.31 0.00 0.00 -1.00 0.00 0.00 39.48 35.57 1rf6 n PHE 381 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1rf6 n GLY 382 N -0.79 0.42 3.11 1.37 0.00 -1.26 -4.83 105.19 103.20 1rf6 n GLY 382 Ca -0.19 -0.99 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 1rf6 n GLY 382 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rf6 s ASP 383 N -2.90 4.86 0.26 1.61 -1.08 -0.54 -4.93 116.67 113.95 1rf6 s ASP 383 Ca 0.00 -1.63 -0.03 0.00 -0.52 0.00 0.00 52.55 50.36 1rf6 s ASP 383 Cb 0.00 -1.69 0.54 0.00 -1.46 0.00 0.00 42.92 40.31 1rf6 s ASP 383 CO 0.00 -0.33 1.64 1.12 0.52 0.00 0.00 175.17 178.12 1rf6 h HIS 384 N 7.89 0.11 0.00 -5.34 2.07 -1.87 -1.49 115.15 116.52 1rf6 h HIS 384 Ca -0.16 0.05 -0.03 0.00 -2.85 0.00 0.00 60.37 57.39 1rf6 h HIS 384 Cb 1.05 0.08 -0.00 0.00 2.57 0.00 0.00 27.41 31.10 1rf6 h HIS 384 CO 0.58 -0.22 -0.13 0.00 -3.07 0.00 0.00 177.93 175.09 1rf6 h ARG 385 N 0.15 0.00 -0.39 5.12 3.08 -1.95 -1.43 114.38 118.97 1rf6 h ARG 385 Ca 0.47 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.38 1rf6 h ARG 385 Cb 0.87 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 1rf6 h ARG 385 CO -0.66 0.13 -0.32 0.82 -1.07 0.00 0.00 179.97 178.86 1rf6 h ILE 386 N 0.00 1.28 0.13 2.04 1.08 -1.60 0.35 117.51 120.79 1rf6 h ILE 386 Ca -0.00 -1.48 -0.01 0.00 -0.39 0.00 0.00 64.86 62.98 1rf6 h ILE 386 Cb 0.57 1.32 0.00 0.00 -3.07 0.00 0.00 36.82 35.64 1rf6 h ILE 386 CO 0.02 0.50 -0.06 1.23 -0.69 0.00 0.00 178.15 179.14 1rf6 h GLY 387 N 0.88 -0.18 1.86 5.37 0.00 -1.17 -1.77 103.07 108.06 1rf6 h GLY 387 Ca 0.08 0.07 -0.11 0.00 0.00 0.00 0.00 47.33 47.36 1rf6 h GLY 387 CO 0.08 -0.06 -0.45 -0.33 0.00 0.00 0.00 176.54 175.78 1rf6 h MET 388 N -0.44 0.16 -0.59 4.80 2.86 -1.29 -1.35 114.93 119.07 1rf6 h MET 388 Ca -0.02 -0.08 -0.06 0.00 -2.06 0.00 0.00 59.70 57.49 1rf6 h MET 388 Cb 0.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1rf6 h MET 388 CO 0.03 0.58 0.14 1.98 1.06 0.00 0.00 176.91 180.69 1rf6 h MET 389 N 0.13 0.95 -0.32 1.72 -1.53 -0.90 -2.27 114.93 112.72 1rf6 h MET 389 Ca 0.01 -0.23 -0.12 0.00 -3.44 0.00 0.00 59.70 55.92 1rf6 h MET 389 Cb 0.84 -0.12 -0.01 0.00 -0.55 0.00 0.00 31.60 31.76 1rf6 h MET 389 CO 0.06 0.88 -0.29 1.15 0.14 0.00 0.00 176.91 178.85 1rf6 h THR 390 N 0.86 1.28 -0.61 -0.77 2.02 -1.03 -2.04 112.91 112.62 1rf6 h THR 390 Ca 0.19 -1.41 -0.03 0.00 0.77 0.00 0.00 66.41 65.93 1rf6 h THR 390 Cb 0.36 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 1rf6 h THR 390 CO 0.00 0.46 0.28 0.00 0.37 0.00 0.00 175.52 176.63 1rf6 h ALA 391 N 1.11 0.79 -0.23 6.16 0.00 -0.96 0.12 119.26 126.25 1rf6 h ALA 391 Ca 0.07 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 1rf6 h ALA 391 Cb 0.79 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1rf6 h ALA 391 CO 0.06 0.37 -0.50 0.97 0.00 0.00 0.00 179.25 180.16 1rf6 h ILE 392 N 0.84 1.31 -0.90 0.00 2.10 -1.34 -2.98 117.51 116.53 1rf6 h ILE 392 Ca 0.21 -1.71 -0.02 0.00 1.08 0.00 0.00 64.86 64.42 1rf6 h ILE 392 Cb 0.14 1.66 -0.04 0.00 -1.09 0.00 0.00 36.82 37.49 1rf6 h ILE 392 CO -0.02 0.54 0.50 0.00 -1.08 0.00 0.00 178.15 178.09 1rf6 h ALA 393 N 0.95 1.19 -0.52 0.18 0.00 -0.97 -2.41 119.26 117.69 1rf6 h ALA 393 Ca 0.02 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1rf6 h ALA 393 Cb 1.04 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1rf6 h ALA 393 CO 0.10 0.66 0.35 0.00 0.00 0.00 0.00 179.25 180.36 1rf6 h ALA 394 N 1.29 1.83 -0.26 0.00 0.00 -0.83 -1.78 119.26 119.51 1rf6 h ALA 394 Ca 0.32 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.29 1rf6 h ALA 394 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1rf6 h ALA 394 CO -0.05 0.09 0.20 -0.07 0.00 0.00 0.00 179.25 179.42 1rf6 h LEU 395 N 0.52 0.00 -0.37 0.00 3.38 -1.38 -1.39 115.31 116.07 1rf6 h LEU 395 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1rf6 h LEU 395 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1rf6 h LEU 395 CO -0.06 0.00 -0.24 0.18 0.09 0.00 0.00 178.44 178.41 1rf6 n LEU 396 N -4.31 0.81 -4.60 1.67 4.32 -0.67 -0.28 117.00 113.94 1rf6 n LEU 396 Ca 0.03 -0.15 -0.43 0.00 -0.02 0.00 0.00 56.01 55.44 1rf6 n LEU 396 Cb 0.36 -0.16 -0.02 0.00 -1.62 0.00 0.00 43.42 41.98 1rf6 n LEU 396 CO 0.34 0.15 1.20 -0.69 -1.22 0.00 0.00 177.39 177.18 1rf6 s VAL 397 N -2.56 3.95 0.16 4.08 1.01 -0.52 -4.51 120.40 122.01 1rf6 s VAL 397 Ca 0.24 0.97 -0.04 0.00 0.00 0.00 0.00 61.98 63.15 1rf6 s VAL 397 Cb 0.19 -4.27 -0.13 0.00 0.00 0.00 0.00 36.38 32.17 1rf6 s VAL 397 CO 0.53 -0.81 1.39 0.00 0.00 0.00 0.00 175.10 176.21 1rf6 h ALA 398 N 10.47 0.51 -2.72 5.51 0.00 -1.88 0.14 119.26 131.30 1rf6 h ALA 398 Ca -0.27 -0.62 -0.43 0.00 0.00 0.00 0.00 54.91 53.59 1rf6 h ALA 398 Cb 1.10 -0.05 -0.38 0.00 0.00 0.00 0.00 17.79 18.46 1rf6 h ALA 398 CO 1.09 0.76 -0.71 0.34 0.00 0.00 0.00 179.25 180.73 1rf6 s ASP 399 N -7.01 2.37 0.00 0.00 3.68 -1.26 -4.74 116.67 109.71 1rf6 s ASP 399 Ca -0.06 -0.74 0.00 0.00 2.13 0.00 0.00 52.55 53.88 1rf6 s ASP 399 Cb 0.10 -0.02 0.00 0.00 -1.45 0.00 0.00 42.92 41.55 1rf6 s ASP 399 CO 0.85 -0.38 0.00 0.61 0.13 0.00 0.00 175.17 176.39 1rf6 n GLY 400 N 5.28 1.16 3.41 2.66 0.00 -1.26 -4.37 105.19 112.07 1rf6 n GLY 400 Ca -0.06 -1.67 -0.27 0.00 0.00 0.00 0.00 46.02 44.02 1rf6 n GLY 400 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rf6 s GLU 401 N -1.56 1.46 -0.15 1.61 8.01 -1.26 -4.77 118.70 122.05 1rf6 s GLU 401 Ca 0.00 -1.45 -0.00 0.00 0.01 0.00 0.00 54.97 53.53 1rf6 s GLU 401 Cb 0.00 -1.84 0.03 0.00 -4.31 0.00 0.00 34.13 28.01 1rf6 s GLU 401 CO 0.00 0.41 -0.08 0.54 0.01 0.00 0.00 175.26 176.14 1rf6 s VAL 402 N -1.46 1.22 -0.21 2.63 0.11 -1.26 -1.05 120.40 120.40 1rf6 s VAL 402 Ca 0.18 -0.54 -0.12 0.00 -2.93 0.00 0.00 61.98 58.57 1rf6 s VAL 402 Cb -0.09 -1.27 -0.05 0.00 -1.53 0.00 0.00 36.38 33.44 1rf6 s VAL 402 CO 0.08 0.29 0.22 -0.70 -3.33 0.00 0.00 175.10 171.66 1rf6 s GLU 403 N 1.61 4.16 -0.31 1.54 2.12 -0.41 -2.47 118.70 124.95 1rf6 s GLU 403 Ca 0.03 -0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.27 1rf6 s GLU 403 Cb -0.14 -3.48 0.07 0.00 0.26 0.00 0.00 34.13 30.84 1rf6 s GLU 403 CO -0.09 0.14 0.00 -1.17 -0.54 0.00 0.00 175.26 173.61 1rf6 s LEU 404 N 0.79 4.11 0.27 2.70 0.20 -0.25 0.12 118.68 126.62 1rf6 s LEU 404 Ca 0.12 -1.58 -0.11 0.00 0.69 0.00 0.00 54.13 53.24 1rf6 s LEU 404 Cb -0.13 -1.66 -0.08 0.00 -0.43 0.00 0.00 46.19 43.89 1rf6 s LEU 404 CO 0.03 -0.30 0.62 -1.81 -0.29 0.00 0.00 176.35 174.60 1rf6 s ASP 405 N 1.22 6.67 -1.34 3.68 1.01 0.59 0.18 116.67 128.68 1rf6 s ASP 405 Ca -0.02 1.05 -0.03 0.00 0.71 0.00 0.00 52.55 54.26 1rf6 s ASP 405 Cb -0.20 -2.28 0.02 0.00 1.01 0.00 0.00 42.92 41.47 1rf6 s ASP 405 CO -0.04 -0.13 0.85 -1.14 0.21 0.00 0.00 175.17 174.92 1rf6 n ARG 406 N -0.26 -5.63 0.24 8.23 0.63 -1.26 -2.28 116.66 116.35 1rf6 n ARG 406 Ca 0.02 0.68 0.13 0.00 -0.92 0.00 0.00 57.85 57.75 1rf6 n ARG 406 Cb 0.53 -5.43 0.55 0.00 0.45 0.00 0.00 32.46 28.56 1rf6 n ARG 406 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1rf6 h ALA 407 N 0.91 1.02 0.00 5.13 0.00 -1.96 -3.09 119.26 121.28 1rf6 h ALA 407 Ca -0.60 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1rf6 h ALA 407 Cb 1.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1rf6 h ALA 407 CO 0.57 0.16 0.00 -0.85 0.00 0.00 0.00 179.25 179.13 1rf6 n GLU 408 N -3.28 0.02 0.26 0.00 0.00 -1.26 -1.80 120.64 114.58 1rf6 n GLU 408 Ca 0.00 0.35 0.09 0.00 0.00 0.00 0.00 57.16 57.60 1rf6 n GLU 408 Cb 0.38 -1.50 0.67 0.00 0.00 0.00 0.00 31.44 30.98 1rf6 n GLU 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1rf6 h ALA 409 N 2.13 1.72 0.00 -1.84 0.00 -1.91 -1.74 119.26 117.61 1rf6 h ALA 409 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1rf6 h ALA 409 Cb 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1rf6 h ALA 409 CO 0.00 0.09 -0.01 0.82 0.00 0.00 0.00 179.25 180.14 1rf6 h ILE 410 N 0.00 0.66 0.00 0.00 2.04 -1.59 -2.45 117.51 116.17 1rf6 h ILE 410 Ca -0.00 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1rf6 h ILE 410 Cb 0.14 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1rf6 h ILE 410 CO 0.01 0.01 0.00 0.59 0.00 0.00 0.00 178.15 178.76 1rf6 n ASN 411 N -4.01 0.00 0.21 1.72 3.02 -0.65 -1.22 115.26 114.32 1rf6 n ASN 411 Ca -0.03 0.42 0.07 0.00 -0.03 0.00 0.00 54.58 55.01 1rf6 n ASN 411 Cb 0.10 -0.45 0.45 0.00 -0.61 0.00 0.00 39.78 39.27 1rf6 n ASN 411 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rf6 h THR 412 N 0.00 0.90 0.00 3.41 1.03 -1.64 -0.93 112.91 115.69 1rf6 h THR 412 Ca 0.00 -1.16 0.00 0.00 -0.01 0.00 0.00 66.41 65.24 1rf6 h THR 412 Cb 0.14 1.69 0.00 0.00 -1.07 0.00 0.00 68.15 68.91 1rf6 h THR 412 CO 0.00 0.29 -0.12 -1.54 -0.01 0.00 0.00 175.52 174.14 1rf6 n SER 413 N -3.73 0.62 -3.03 0.00 3.41 -1.04 -2.40 113.62 107.45 1rf6 n SER 413 Ca -0.01 -0.03 -0.18 0.00 -0.26 0.00 0.00 58.87 58.38 1rf6 n SER 413 Cb 0.40 0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 1rf6 n SER 413 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rf6 n TYR 414 N -0.25 -1.46 -0.17 7.33 -0.00 -0.36 -4.76 117.16 117.49 1rf6 n TYR 414 Ca 0.00 -2.90 0.15 0.00 -0.00 0.00 0.00 57.90 55.15 1rf6 n TYR 414 Cb 0.00 0.36 0.50 0.00 -0.00 0.00 0.00 39.34 40.19 1rf6 n TYR 414 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.86 175.51 1rf6 h PRO 415 N 3.98 0.42 -0.63 2.98 0.11 -1.74 -1.85 132.00 135.27 1rf6 h PRO 415 Ca -0.01 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1rf6 h PRO 415 Cb 0.94 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1rf6 h PRO 415 CO 0.41 0.28 0.00 -1.13 -0.21 0.00 0.00 178.00 177.35 1rf6 n SER 416 N -4.48 3.94 -0.09 -2.05 3.41 -1.26 -4.64 113.62 108.44 1rf6 n SER 416 Ca 0.14 -2.42 -0.09 0.00 -0.26 0.00 0.00 58.87 56.24 1rf6 n SER 416 Cb 0.52 -0.53 -0.04 0.00 -0.26 0.00 0.00 64.21 63.90 1rf6 n SER 416 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1rf6 h PHE 417 N 3.12 -1.08 -0.06 7.33 3.57 -1.71 -0.94 116.94 127.17 1rf6 h PHE 417 Ca 0.00 0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.49 1rf6 h PHE 417 Cb 1.27 0.52 -0.01 0.00 2.79 0.00 0.00 35.95 40.52 1rf6 h PHE 417 CO 0.64 -0.42 -0.28 0.74 -2.23 0.00 0.00 178.31 176.76 1rf6 h PHE 418 N -0.33 0.11 -0.62 0.41 0.04 -1.85 -0.91 116.94 113.79 1rf6 h PHE 418 Ca 0.14 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.80 1rf6 h PHE 418 Cb 0.57 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.67 1rf6 h PHE 418 CO -0.55 0.37 0.04 -0.44 -0.60 0.00 0.00 178.31 177.14 1rf6 h ASP 419 N 0.09 1.03 -0.34 2.17 3.32 -1.66 0.05 116.42 121.08 1rf6 h ASP 419 Ca 0.01 -0.29 -0.10 0.00 0.02 0.00 0.00 57.03 56.68 1rf6 h ASP 419 Cb 0.55 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 1rf6 h ASP 419 CO 0.04 1.06 -0.14 0.44 -1.72 0.00 0.00 179.24 178.93 1rf6 h ASP 420 N 0.97 0.79 -0.26 6.45 3.32 -0.62 -2.40 116.42 124.66 1rf6 h ASP 420 Ca 0.18 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1rf6 h ASP 420 Cb 0.51 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1rf6 h ASP 420 CO 0.02 0.94 0.08 0.25 -1.72 0.00 0.00 179.24 178.81 1rf6 h LEU 421 N 0.71 0.37 -0.79 1.55 5.85 -0.81 -2.93 115.31 119.26 1rf6 h LEU 421 Ca 0.11 -0.20 0.11 0.00 0.84 0.00 0.00 57.88 58.74 1rf6 h LEU 421 Cb 0.63 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.48 1rf6 h LEU 421 CO 0.04 0.48 0.41 -0.33 -0.34 0.00 0.00 178.44 178.70 1rf6 h GLU 422 N 0.25 0.64 0.00 1.25 4.39 -0.80 -1.05 114.58 119.26 1rf6 h GLU 422 Ca 0.08 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1rf6 h GLU 422 Cb 0.24 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1rf6 h GLU 422 CO -0.00 0.42 0.00 0.66 -1.16 0.00 0.00 179.01 178.93 1rf6 h SER 423 N 0.66 0.00 0.55 1.42 4.64 -1.25 -2.55 113.55 117.02 1rf6 h SER 423 Ca 0.40 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.64 1rf6 h SER 423 Cb 0.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1rf6 h SER 423 CO -0.29 0.00 -1.51 0.18 -0.87 0.00 0.00 176.83 174.33 1rf6 n LEU 424 N -2.72 0.55 0.25 5.97 4.77 -0.43 -2.54 117.00 122.86 1rf6 n LEU 424 Ca -0.00 0.23 0.17 0.00 -0.03 0.00 0.00 56.01 56.37 1rf6 n LEU 424 Cb 0.17 0.05 0.80 0.00 -2.33 0.00 0.00 43.42 42.10 1rf6 n LEU 424 CO 0.20 0.02 1.15 0.40 -1.33 0.00 0.00 177.39 177.83 1rf6 h ILE 425 N 0.00 0.15 0.00 -0.08 1.08 -1.15 -3.10 117.51 114.40 1rf6 h ILE 425 Ca -0.10 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 1rf6 h ILE 425 Cb 1.28 0.67 0.00 0.00 -3.07 0.00 0.00 36.82 35.71 1rf6 h ILE 425 CO 0.02 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.48 1rf6 n HIS 426 N -3.21 0.00 0.04 1.37 1.44 -1.26 -4.90 115.22 108.70 1rf6 n HIS 426 Ca 0.01 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.73 1rf6 n HIS 426 Cb 0.45 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.57 1rf6 n HIS 426 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94