#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rf5 s LYS 2 N 0.00 3.43 0.48 2.12 -0.14 -1.26 -0.55 119.74 123.81 1rf5 s LYS 2 Ca 0.00 -0.64 -0.16 0.00 -1.36 0.00 0.00 55.97 53.81 1rf5 s LYS 2 Cb 0.00 -3.83 -0.08 0.00 -1.68 0.00 0.00 37.83 32.24 1rf5 s LYS 2 CO 0.00 -0.52 0.92 -0.51 -0.76 0.00 0.00 175.35 174.49 1rf5 s LEU 3 N 1.80 3.71 0.05 3.17 1.43 -0.81 -5.02 118.68 123.02 1rf5 s LEU 3 Ca 0.07 1.47 -0.31 0.00 -1.03 0.00 0.00 54.13 54.34 1rf5 s LEU 3 Cb -0.17 -4.39 -0.06 0.00 0.03 0.00 0.00 46.19 41.60 1rf5 s LEU 3 CO 0.11 -0.51 1.26 -0.54 0.23 0.00 0.00 176.35 176.90 1rf5 s LYS 4 N -3.90 4.39 0.34 1.70 1.02 -1.26 -4.62 119.74 117.40 1rf5 s LYS 4 Ca 0.57 1.84 0.10 0.00 0.02 0.00 0.00 55.97 58.50 1rf5 s LYS 4 Cb -0.10 -3.38 -0.06 0.00 -0.52 0.00 0.00 37.83 33.77 1rf5 s LYS 4 CO 0.29 -0.35 -0.08 0.95 -0.92 0.00 0.00 175.35 175.24 1rf5 s THR 5 N 1.34 2.37 -1.22 2.17 -4.23 -1.26 -3.43 115.64 111.38 1rf5 s THR 5 Ca 0.60 -2.17 -0.02 0.00 -1.18 0.00 0.00 61.69 58.92 1rf5 s THR 5 Cb -0.31 -2.65 -0.01 0.00 1.34 0.00 0.00 72.50 70.88 1rf5 s THR 5 CO 0.28 -0.22 0.86 -3.20 -0.54 0.00 0.00 174.62 171.80 1rf5 n ASN 6 N -0.81 -2.49 -4.71 3.99 5.15 -0.06 -4.95 115.26 111.38 1rf5 n ASN 6 Ca -0.05 -0.73 -0.40 0.00 -0.60 0.00 0.00 54.58 52.80 1rf5 n ASN 6 Cb 0.63 -4.63 -0.04 0.00 -0.53 0.00 0.00 39.78 35.21 1rf5 n ASN 6 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1rf5 s ILE 7 N -3.49 5.01 -0.16 -1.44 -1.09 -0.80 -4.97 121.20 114.27 1rf5 s ILE 7 Ca 0.09 1.52 0.18 0.00 -2.23 0.00 0.00 60.65 60.21 1rf5 s ILE 7 Cb -0.02 -4.08 -0.26 0.00 -1.58 0.00 0.00 42.46 36.52 1rf5 s ILE 7 CO 0.77 0.21 0.45 -2.11 -1.23 0.00 0.00 174.94 173.03 1rf5 n ARG 8 N 3.99 0.67 -3.70 2.79 0.00 -1.26 -4.64 116.66 114.50 1rf5 n ARG 8 Ca 0.00 -0.14 -0.14 0.00 -0.00 0.00 0.00 57.85 57.57 1rf5 n ARG 8 Cb 0.51 -1.41 -0.08 0.00 -0.00 0.00 0.00 32.46 31.48 1rf5 n ARG 8 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1rf5 s HIS 9 N -3.14 -0.33 -0.12 2.89 -3.43 -1.25 -4.11 115.29 105.80 1rf5 s HIS 9 Ca -0.04 0.60 -0.04 0.00 -0.80 0.00 0.00 55.06 54.78 1rf5 s HIS 9 Cb 0.12 0.17 0.05 0.00 -1.43 0.00 0.00 32.58 31.49 1rf5 s HIS 9 CO 0.74 -0.41 0.09 -1.17 -2.00 0.00 0.00 174.74 171.98 1rf5 s LEU 10 N -1.04 0.23 -0.02 5.38 2.96 -1.21 -4.58 118.68 120.41 1rf5 s LEU 10 Ca -0.11 -0.29 -0.02 0.00 -0.22 0.00 0.00 54.13 53.50 1rf5 s LEU 10 Cb -0.04 -0.15 0.00 0.00 0.50 0.00 0.00 46.19 46.50 1rf5 s LEU 10 CO 0.05 -0.31 0.05 -1.00 -1.32 0.00 0.00 176.35 173.82 1rf5 s HIS 11 N 2.17 -0.04 0.00 5.38 3.76 -0.88 -1.38 115.29 124.30 1rf5 s HIS 11 Ca 0.03 0.11 0.00 0.00 -0.15 0.00 0.00 55.06 55.05 1rf5 s HIS 11 Cb -0.14 0.01 0.00 0.00 1.11 0.00 0.00 32.58 33.56 1rf5 s HIS 11 CO -0.07 -0.04 0.00 0.41 -0.85 0.00 0.00 174.74 174.19 1rf5 n GLY 12 N 2.94 2.12 3.38 -2.22 0.00 -1.23 -4.17 105.19 106.01 1rf5 n GLY 12 Ca -0.13 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.15 1rf5 n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rf5 s ILE 13 N -1.93 3.17 -0.03 -0.61 1.01 -1.26 -2.08 121.20 119.47 1rf5 s ILE 13 Ca 0.00 -0.61 0.04 0.00 0.00 0.00 0.00 60.65 60.08 1rf5 s ILE 13 Cb 0.00 -2.35 -0.00 0.00 0.01 0.00 0.00 42.46 40.12 1rf5 s ILE 13 CO 0.00 0.51 -0.16 -0.63 0.00 0.00 0.00 174.94 174.66 1rf5 s ILE 14 N 0.46 1.31 -0.36 2.92 1.01 -0.52 -5.01 121.20 121.00 1rf5 s ILE 14 Ca -0.08 -0.66 -0.08 0.00 0.00 0.00 0.00 60.65 59.82 1rf5 s ILE 14 Cb -0.16 -1.12 0.03 0.00 0.01 0.00 0.00 42.46 41.23 1rf5 s ILE 14 CO 0.04 0.38 0.15 -0.13 0.00 0.00 0.00 174.94 175.38 1rf5 s ARG 15 N -0.02 2.70 0.49 2.79 0.52 -1.26 -2.94 118.95 121.23 1rf5 s ARG 15 Ca -0.02 -1.14 -0.21 0.00 -0.52 0.00 0.00 55.73 53.84 1rf5 s ARG 15 Cb -0.10 -3.59 -0.08 0.00 0.52 0.00 0.00 34.95 31.70 1rf5 s ARG 15 CO 0.01 -0.69 1.07 0.14 0.02 0.00 0.00 175.30 175.85 1rf5 s VAL 16 N 1.47 3.62 0.54 3.52 -7.23 -1.26 -5.00 120.40 116.05 1rf5 s VAL 16 Ca -0.00 1.04 -0.21 0.00 -1.81 0.00 0.00 61.98 61.01 1rf5 s VAL 16 Cb -0.19 -3.44 -0.07 0.00 0.56 0.00 0.00 36.38 33.24 1rf5 s VAL 16 CO 0.05 -0.18 1.03 -2.65 -0.31 0.00 0.00 175.10 173.03 1rf5 n PRO 17 N -0.90 1.16 -0.94 4.82 -0.02 -1.26 -4.44 135.00 133.43 1rf5 n PRO 17 Ca 0.09 0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 61.68 1rf5 n PRO 17 Cb 0.52 -2.18 0.13 0.00 -0.02 0.00 0.00 33.50 31.95 1rf5 n PRO 17 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rf5 n GLY 18 N 1.19 -0.57 3.74 -1.23 0.00 -1.26 -0.37 105.19 106.68 1rf5 n GLY 18 Ca 0.12 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 1rf5 n GLY 18 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rf5 s ASP 19 N -2.20 7.13 0.15 1.61 2.15 -0.48 -4.30 116.67 120.73 1rf5 s ASP 19 Ca 0.68 2.25 -0.11 0.00 0.43 0.00 0.00 52.55 55.80 1rf5 s ASP 19 Cb -0.26 -2.61 0.02 0.00 -0.30 0.00 0.00 42.92 39.76 1rf5 s ASP 19 CO 0.56 -0.31 1.59 0.50 -0.17 0.00 0.00 175.17 177.34 1rf5 h LYS 20 N 4.79 0.94 -0.52 4.34 3.64 -1.92 -1.74 116.57 126.10 1rf5 h LYS 20 Ca -0.45 -0.33 -0.10 0.00 -1.27 0.00 0.00 60.65 58.50 1rf5 h LYS 20 Cb 1.21 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1rf5 h LYS 20 CO 0.72 0.99 -0.05 0.77 -2.27 0.00 0.00 179.45 179.61 1rf5 h SER 21 N 0.80 0.94 0.22 4.20 0.02 -2.00 -2.63 113.55 115.09 1rf5 h SER 21 Ca 0.14 -0.33 -0.21 0.00 -0.84 0.00 0.00 61.79 60.55 1rf5 h SER 21 Cb 0.61 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1rf5 h SER 21 CO 0.04 1.05 -0.81 0.40 -1.14 0.00 0.00 176.83 176.36 1rf5 h ILE 22 N 0.82 1.37 -0.76 3.27 2.04 -1.96 -2.81 117.51 119.47 1rf5 h ILE 22 Ca 0.14 -2.22 -0.01 0.00 1.00 0.00 0.00 64.86 63.77 1rf5 h ILE 22 Cb 0.59 2.20 -0.04 0.00 -0.74 0.00 0.00 36.82 38.83 1rf5 h ILE 22 CO 0.04 0.67 0.44 0.28 0.00 0.00 0.00 178.15 179.57 1rf5 h SER 23 N 0.30 0.93 -0.13 1.72 0.02 -1.24 0.33 113.55 115.49 1rf5 h SER 23 Ca -0.05 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 60.78 1rf5 h SER 23 Cb 1.42 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 1rf5 h SER 23 CO 0.14 0.74 -0.14 0.45 -1.14 0.00 0.00 176.83 176.88 1rf5 h HIS 24 N 1.06 0.39 0.00 3.45 3.86 -1.50 -3.30 115.15 119.12 1rf5 h HIS 24 Ca 0.27 -0.12 -0.07 0.00 -1.16 0.00 0.00 60.37 59.29 1rf5 h HIS 24 Cb -0.00 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 1rf5 h HIS 24 CO 0.01 0.74 -0.35 0.00 0.86 0.00 0.00 177.93 179.18 1rf5 h ARG 25 N -0.06 0.00 -0.07 2.45 3.08 -1.21 -2.75 114.38 115.82 1rf5 h ARG 25 Ca 0.02 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 1rf5 h ARG 25 Cb 0.67 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 1rf5 h ARG 25 CO 0.03 0.35 -0.21 0.66 -1.07 0.00 0.00 179.97 179.73 1rf5 h SER 26 N 0.00 0.10 0.19 7.04 4.64 -1.01 0.66 113.55 125.18 1rf5 h SER 26 Ca -0.00 -0.02 -0.30 0.00 -0.47 0.00 0.00 61.79 60.99 1rf5 h SER 26 Cb 0.64 -0.03 0.03 0.00 -0.31 0.00 0.00 62.40 62.73 1rf5 h SER 26 CO 0.05 0.33 -1.29 0.40 -0.87 0.00 0.00 176.83 175.45 1rf5 h ILE 27 N 0.10 1.32 -0.05 0.95 1.08 -1.58 -2.72 117.51 116.60 1rf5 h ILE 27 Ca 0.02 -2.58 -0.02 0.00 -0.39 0.00 0.00 64.86 61.89 1rf5 h ILE 27 Cb 0.44 2.95 -0.00 0.00 -3.07 0.00 0.00 36.82 37.14 1rf5 h ILE 27 CO 0.03 0.77 -0.03 0.40 -0.69 0.00 0.00 178.15 178.63 1rf5 h ILE 28 N 0.10 1.34 -0.09 -0.67 2.04 -1.29 -2.18 117.51 116.76 1rf5 h ILE 28 Ca -0.22 -1.08 -0.09 0.00 1.00 0.00 0.00 64.86 64.47 1rf5 h ILE 28 Cb 1.99 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 40.02 1rf5 h ILE 28 CO 0.24 0.29 -0.35 -0.26 0.00 0.00 0.00 178.15 178.08 1rf5 h PHE 29 N -0.30 0.21 0.00 1.37 -1.00 -1.03 -1.69 116.94 114.51 1rf5 h PHE 29 Ca 0.01 -0.05 -0.10 0.00 2.81 0.00 0.00 57.97 60.64 1rf5 h PHE 29 Cb 0.49 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.98 1rf5 h PHE 29 CO 0.08 0.52 -0.49 0.78 -1.61 0.00 0.00 178.31 177.59 1rf5 h GLY 30 N 1.12 0.00 1.24 -1.45 0.00 -1.47 -2.52 103.07 99.99 1rf5 h GLY 30 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.03 1rf5 h GLY 30 CO 0.05 0.00 -1.52 1.76 0.00 0.00 0.00 176.54 176.83 1rf5 h SER 31 N 0.00 0.51 0.94 0.19 0.02 -1.11 -3.35 113.55 110.75 1rf5 h SER 31 Ca -0.00 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 1rf5 h SER 31 Cb 0.94 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1rf5 h SER 31 CO 0.06 1.54 -0.14 0.18 -1.14 0.00 0.00 176.83 177.33 1rf5 n LEU 32 N -3.53 0.24 -4.93 5.07 4.77 -0.66 -2.28 117.00 115.68 1rf5 n LEU 32 Ca -0.17 0.39 -0.27 0.00 -0.03 0.00 0.00 56.01 55.93 1rf5 n LEU 32 Cb 1.06 -0.41 0.10 0.00 -2.33 0.00 0.00 43.42 41.84 1rf5 n LEU 32 CO 0.53 0.00 0.68 0.00 -1.33 0.00 0.00 177.39 177.27 1rf5 s ALA 33 N -3.02 2.97 -0.27 -1.18 0.00 -0.95 -3.06 121.76 116.25 1rf5 s ALA 33 Ca 0.13 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.97 1rf5 s ALA 33 Cb 0.18 -2.61 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 1rf5 s ALA 33 CO 0.58 -1.60 0.06 -2.00 0.00 0.00 0.00 175.76 172.81 1rf5 s GLU 34 N -5.41 3.32 0.00 0.00 2.12 -0.15 -2.80 118.70 115.78 1rf5 s GLU 34 Ca 0.64 -0.70 0.00 0.00 0.36 0.00 0.00 54.97 55.27 1rf5 s GLU 34 Cb -0.09 -3.32 0.00 0.00 0.26 0.00 0.00 34.13 30.99 1rf5 s GLU 34 CO 0.47 -0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.27 1rf5 n GLY 35 N 4.88 0.32 3.75 -1.50 0.00 -1.26 -2.44 105.19 108.94 1rf5 n GLY 35 Ca -0.16 -2.16 -0.36 0.00 0.00 0.00 0.00 46.02 43.35 1rf5 n GLY 35 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rf5 s GLU 36 N 0.00 3.35 -0.15 1.61 2.12 -1.26 -0.41 118.70 123.96 1rf5 s GLU 36 Ca 0.00 -0.29 0.01 0.00 0.36 0.00 0.00 54.97 55.05 1rf5 s GLU 36 Cb 0.00 -3.03 0.02 0.00 0.26 0.00 0.00 34.13 31.38 1rf5 s GLU 36 CO 0.00 0.64 -0.16 0.99 -0.54 0.00 0.00 175.26 176.20 1rf5 s THR 37 N -0.68 1.67 -0.25 -1.70 2.01 -0.22 -3.58 115.64 112.89 1rf5 s THR 37 Ca 0.12 -0.70 -0.06 0.00 0.31 0.00 0.00 61.69 61.35 1rf5 s THR 37 Cb -0.12 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 1rf5 s THR 37 CO 0.02 0.47 0.04 -0.54 -0.69 0.00 0.00 174.62 173.93 1rf5 s LYS 38 N 1.35 3.49 -0.18 4.92 1.02 -1.07 -0.62 119.74 128.65 1rf5 s LYS 38 Ca 0.03 -0.57 -0.05 0.00 0.02 0.00 0.00 55.97 55.39 1rf5 s LYS 38 Cb -0.13 -3.24 -0.03 0.00 -0.52 0.00 0.00 37.83 33.91 1rf5 s LYS 38 CO -0.09 -0.23 0.00 0.08 -0.92 0.00 0.00 175.35 174.19 1rf5 s VAL 39 N 1.56 4.13 0.09 3.17 1.01 0.18 -0.27 120.40 130.27 1rf5 s VAL 39 Ca 0.06 -0.26 0.09 0.00 0.00 0.00 0.00 61.98 61.86 1rf5 s VAL 39 Cb -0.15 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 1rf5 s VAL 39 CO 0.01 0.46 -0.22 -0.31 0.00 0.00 0.00 175.10 175.04 1rf5 s TYR 40 N 0.64 2.44 -1.38 5.22 1.51 0.87 -1.95 117.35 124.70 1rf5 s TYR 40 Ca -0.00 -0.32 -0.08 0.00 -1.01 0.00 0.00 57.07 55.66 1rf5 s TYR 40 Cb -0.14 -1.36 0.03 0.00 -0.11 0.00 0.00 41.96 40.39 1rf5 s TYR 40 CO 0.02 0.30 1.02 -0.25 -1.11 0.00 0.00 175.55 175.52 1rf5 n ASP 41 N 1.18 -4.39 -4.79 2.29 9.92 -1.26 -1.07 116.55 118.42 1rf5 n ASP 41 Ca -0.17 -0.67 -0.34 0.00 -0.53 0.00 0.00 54.79 53.08 1rf5 n ASP 41 Cb 0.52 -4.53 -0.03 0.00 -0.64 0.00 0.00 41.12 36.45 1rf5 n ASP 41 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1rf5 s ILE 42 N -3.38 3.74 -0.10 0.53 2.07 -1.26 -4.29 121.20 118.51 1rf5 s ILE 42 Ca 0.43 1.11 -0.30 0.00 -1.41 0.00 0.00 60.65 60.48 1rf5 s ILE 42 Cb -0.20 -3.46 -0.02 0.00 0.13 0.00 0.00 42.46 38.90 1rf5 s ILE 42 CO 0.78 -0.21 1.22 -0.22 -1.91 0.00 0.00 174.94 174.60 1rf5 s LEU 43 N -3.41 4.24 -0.44 8.50 2.96 -1.26 -4.66 118.68 124.60 1rf5 s LEU 43 Ca 0.67 1.76 -0.20 0.00 -0.22 0.00 0.00 54.13 56.14 1rf5 s LEU 43 Cb -0.17 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 42.99 1rf5 s LEU 43 CO 0.21 -0.65 0.59 -0.60 -1.32 0.00 0.00 176.35 174.58 1rf5 s ARG 44 N 2.72 3.22 0.26 1.98 3.52 -1.26 -4.80 118.95 124.58 1rf5 s ARG 44 Ca 0.55 -0.50 -0.17 0.00 -0.13 0.00 0.00 55.73 55.48 1rf5 s ARG 44 Cb -0.23 -3.97 0.01 0.00 -1.56 0.00 0.00 34.95 29.20 1rf5 s ARG 44 CO 0.19 -0.99 0.58 0.20 -0.81 0.00 0.00 175.30 174.47 1rf5 s GLY 45 N 2.00 0.23 0.42 8.12 0.00 -1.26 -5.05 107.32 111.79 1rf5 s GLY 45 Ca 0.20 -0.59 0.15 0.00 0.00 0.00 0.00 44.72 44.48 1rf5 s GLY 45 CO 0.17 -0.38 1.93 0.83 0.00 0.00 0.00 173.10 175.66 1rf5 h GLU 46 N 2.14 0.00 -0.15 2.90 4.39 -1.98 -1.58 114.58 120.31 1rf5 h GLU 46 Ca -0.23 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.30 1rf5 h GLU 46 Cb 1.25 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.91 1rf5 h GLU 46 CO 0.30 0.25 -0.57 -0.44 -1.16 0.00 0.00 179.01 177.40 1rf5 h ASP 47 N 0.00 0.75 0.11 1.42 5.19 -1.96 -2.50 116.42 119.43 1rf5 h ASP 47 Ca -0.00 -0.62 -0.18 0.00 -0.62 0.00 0.00 57.03 55.61 1rf5 h ASP 47 Cb 0.47 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 39.75 1rf5 h ASP 47 CO 0.03 1.24 -0.68 0.58 -3.12 0.00 0.00 179.24 177.30 1rf5 h VAL 48 N 0.31 1.34 0.00 -1.35 2.07 -1.83 -2.96 116.25 113.82 1rf5 h VAL 48 Ca -0.03 -2.00 -0.06 0.00 0.82 0.00 0.00 66.70 65.43 1rf5 h VAL 48 Cb 1.20 1.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 1rf5 h VAL 48 CO 0.12 0.61 -0.30 -0.07 0.02 0.00 0.00 177.57 177.95 1rf5 h LEU 49 N 0.37 0.00 -0.63 2.57 3.38 -1.36 -2.69 115.31 116.95 1rf5 h LEU 49 Ca -0.02 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.81 1rf5 h LEU 49 Cb 1.25 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1rf5 h LEU 49 CO 0.12 0.30 -0.42 0.28 0.09 0.00 0.00 178.44 178.82 1rf5 h SER 50 N 0.00 0.64 -0.50 -0.43 0.02 -1.31 -2.61 113.55 109.37 1rf5 h SER 50 Ca -0.00 -0.29 -0.11 0.00 -0.84 0.00 0.00 61.79 60.55 1rf5 h SER 50 Cb 0.66 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.00 1rf5 h SER 50 CO 0.04 0.98 -0.09 0.74 -1.14 0.00 0.00 176.83 177.36 1rf5 h THR 51 N 0.49 1.26 -0.37 -2.27 2.02 -1.33 -2.48 112.91 110.23 1rf5 h THR 51 Ca 0.04 -1.22 -0.12 0.00 0.77 0.00 0.00 66.41 65.88 1rf5 h THR 51 Cb 0.93 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 1rf5 h THR 51 CO 0.08 0.43 -0.26 0.24 0.37 0.00 0.00 175.52 176.38 1rf5 h MET 52 N 0.87 0.76 -0.05 6.66 2.07 -1.44 -3.06 114.93 120.74 1rf5 h MET 52 Ca 0.14 -0.32 -0.19 0.00 -2.07 0.00 0.00 59.70 57.26 1rf5 h MET 52 Cb 0.63 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 30.33 1rf5 h MET 52 CO 0.04 0.94 -0.77 0.37 1.07 0.00 0.00 176.91 178.56 1rf5 h GLN 53 N 0.65 0.33 -0.21 1.72 5.75 -1.42 -2.35 115.11 119.59 1rf5 h GLN 53 Ca 0.08 -0.29 -0.01 0.00 -0.15 0.00 0.00 58.65 58.28 1rf5 h GLN 53 Cb 0.78 0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.38 1rf5 h GLN 53 CO 0.06 0.95 0.10 0.28 -2.65 0.00 0.00 178.83 177.57 1rf5 h VAL 54 N 0.22 1.15 -0.01 2.39 2.07 -1.43 -1.05 116.25 119.58 1rf5 h VAL 54 Ca -0.04 -0.43 -0.10 0.00 0.82 0.00 0.00 66.70 66.96 1rf5 h VAL 54 Cb 1.35 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1rf5 h VAL 54 CO 0.13 0.14 -0.46 -0.26 0.02 0.00 0.00 177.57 177.14 1rf5 h PHE 55 N 0.20 0.03 -0.22 1.57 -1.00 -1.58 -2.07 116.94 113.88 1rf5 h PHE 55 Ca 0.07 -0.01 -0.09 0.00 2.81 0.00 0.00 57.97 60.76 1rf5 h PHE 55 Cb 0.14 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.68 1rf5 h PHE 55 CO -0.02 0.48 -0.24 0.00 -1.61 0.00 0.00 178.31 176.92 1rf5 h ARG 56 N 0.02 0.41 0.00 1.51 3.08 -1.15 -0.33 114.38 117.93 1rf5 h ARG 56 Ca -0.00 -0.15 -0.10 0.00 0.07 0.00 0.00 59.98 59.80 1rf5 h ARG 56 Cb 0.82 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1rf5 h ARG 56 CO 0.06 0.63 -0.47 -0.44 -1.07 0.00 0.00 179.97 178.69 1rf5 h ASP 57 N 0.37 0.00 1.28 7.04 3.45 -0.87 -3.17 116.42 124.53 1rf5 h ASP 57 Ca 0.06 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.52 1rf5 h ASP 57 Cb 0.63 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.40 1rf5 h ASP 57 CO 0.04 0.47 -0.04 0.18 -1.57 0.00 0.00 179.24 178.32 1rf5 n LEU 58 N -3.43 0.56 0.00 1.55 4.77 -0.81 -4.15 117.00 115.49 1rf5 n LEU 58 Ca 0.00 0.52 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 1rf5 n LEU 58 Cb 0.61 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1rf5 n LEU 58 CO 0.39 -0.11 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1rf5 n GLY 59 N 1.37 1.00 3.71 -0.72 0.00 -0.91 -0.67 105.19 108.98 1rf5 n GLY 59 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1rf5 n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf5 s VAL 60 N -2.00 4.95 -0.45 1.61 1.01 -0.18 -4.98 120.40 120.36 1rf5 s VAL 60 Ca 0.00 1.74 -0.27 0.00 0.00 0.00 0.00 61.98 63.45 1rf5 s VAL 60 Cb 0.00 -4.17 0.03 0.00 0.00 0.00 0.00 36.38 32.23 1rf5 s VAL 60 CO 0.00 0.18 1.01 -0.70 0.00 0.00 0.00 175.10 175.59 1rf5 s GLU 61 N 1.08 3.68 -0.13 2.72 2.12 -1.26 -3.92 118.70 122.99 1rf5 s GLU 61 Ca 0.44 0.42 0.02 0.00 0.36 0.00 0.00 54.97 56.21 1rf5 s GLU 61 Cb -0.19 -3.89 0.01 0.00 0.26 0.00 0.00 34.13 30.32 1rf5 s GLU 61 CO 0.21 -1.22 -0.19 0.42 -0.54 0.00 0.00 175.26 173.94 1rf5 s ILE 62 N 3.96 1.80 -0.25 -3.70 1.01 -1.26 -1.39 121.20 121.37 1rf5 s ILE 62 Ca 0.42 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 60.18 1rf5 s ILE 62 Cb -0.09 -1.61 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 1rf5 s ILE 62 CO 0.27 0.50 0.07 -0.70 0.00 0.00 0.00 174.94 175.07 1rf5 s GLU 63 N 0.93 3.59 -0.55 2.79 2.12 -0.20 -4.97 118.70 122.41 1rf5 s GLU 63 Ca -0.06 -0.52 -0.12 0.00 0.36 0.00 0.00 54.97 54.63 1rf5 s GLU 63 Cb -0.15 -3.32 0.14 0.00 0.26 0.00 0.00 34.13 31.06 1rf5 s GLU 63 CO -0.02 -0.22 0.46 0.34 -0.54 0.00 0.00 175.26 175.28 1rf5 s ASP 64 N 1.60 5.97 -0.06 -1.70 -1.08 -1.26 -1.99 116.67 118.15 1rf5 s ASP 64 Ca 0.06 -2.03 -0.01 0.00 -0.52 0.00 0.00 52.55 50.05 1rf5 s ASP 64 Cb -0.15 -2.09 0.03 0.00 -1.46 0.00 0.00 42.92 39.24 1rf5 s ASP 64 CO 0.03 -0.71 0.00 -0.75 0.52 0.00 0.00 175.17 174.26 1rf5 s LYS 65 N 1.20 0.53 -1.42 4.34 2.20 -1.00 -4.89 119.74 120.70 1rf5 s LYS 65 Ca 0.07 0.10 -0.10 0.00 -0.36 0.00 0.00 55.97 55.69 1rf5 s LYS 65 Cb -0.25 -0.85 0.06 0.00 -1.51 0.00 0.00 37.83 35.28 1rf5 s LYS 65 CO -0.01 -0.26 0.65 -0.25 -0.36 0.00 0.00 175.35 175.12 1rf5 n ASP 66 N 4.90 -4.54 0.00 1.43 10.43 -1.26 -1.06 116.55 126.44 1rf5 n ASP 66 Ca -0.11 -0.47 0.00 0.00 2.57 0.00 0.00 54.79 56.77 1rf5 n ASP 66 Cb 0.50 -3.70 0.00 0.00 1.84 0.00 0.00 41.12 39.77 1rf5 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1rf5 n GLY 67 N -1.39 0.57 3.37 0.44 0.00 -1.26 -5.02 105.19 101.90 1rf5 n GLY 67 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1rf5 n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf5 s VAL 68 N -2.33 3.15 -0.21 1.61 1.01 -0.23 -4.43 120.40 118.97 1rf5 s VAL 68 Ca 0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 61.98 61.26 1rf5 s VAL 68 Cb 0.00 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 1rf5 s VAL 68 CO 0.00 0.51 0.13 -0.63 0.00 0.00 0.00 175.10 175.11 1rf5 s ILE 69 N 0.51 5.27 -0.21 2.22 -1.09 -0.82 -2.38 121.20 124.70 1rf5 s ILE 69 Ca -0.08 0.14 0.02 0.00 -2.23 0.00 0.00 60.65 58.50 1rf5 s ILE 69 Cb -0.15 -3.42 0.04 0.00 -1.58 0.00 0.00 42.46 37.34 1rf5 s ILE 69 CO 0.04 0.40 -0.15 -0.89 -1.23 0.00 0.00 174.94 173.11 1rf5 s THR 70 N 0.66 2.01 -0.14 2.92 2.01 -0.84 -0.65 115.64 121.62 1rf5 s THR 70 Ca 0.07 -1.18 -0.01 0.00 0.31 0.00 0.00 61.69 60.88 1rf5 s THR 70 Cb -0.12 -1.97 -0.02 0.00 0.01 0.00 0.00 72.50 70.40 1rf5 s THR 70 CO 0.01 0.28 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.42 1rf5 s VAL 71 N 1.25 3.19 -0.37 3.82 1.01 0.21 -1.03 120.40 128.49 1rf5 s VAL 71 Ca -0.01 -0.61 -0.16 0.00 0.00 0.00 0.00 61.98 61.20 1rf5 s VAL 71 Cb -0.16 -2.36 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 1rf5 s VAL 71 CO -0.09 0.51 0.40 -1.10 0.00 0.00 0.00 175.10 174.82 1rf5 s GLN 72 N 0.44 3.44 0.24 2.72 -1.52 -0.48 -1.05 119.66 123.44 1rf5 s GLN 72 Ca -0.09 -0.48 -0.30 0.00 -1.95 0.00 0.00 55.36 52.55 1rf5 s GLN 72 Cb -0.15 -3.85 -0.09 0.00 -0.22 0.00 0.00 33.01 28.69 1rf5 s GLN 72 CO 0.04 -0.63 1.24 0.20 -0.25 0.00 0.00 175.29 175.89 1rf5 s GLY 73 N 1.76 2.74 -0.04 3.09 0.00 0.45 -4.14 107.32 111.19 1rf5 s GLY 73 Ca 0.13 1.06 0.20 0.00 0.00 0.00 0.00 44.72 46.11 1rf5 s GLY 73 CO 0.12 1.88 0.41 3.33 0.00 0.00 0.00 173.10 178.84 1rf5 n VAL 74 N 1.92 0.07 0.00 1.40 0.24 -0.96 -4.37 118.33 116.63 1rf5 n VAL 74 Ca 0.03 -0.47 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1rf5 n VAL 74 Cb 0.43 0.02 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 1rf5 n VAL 74 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rf5 n GLY 75 N 1.41 -0.86 0.12 7.63 0.00 -1.12 -3.81 105.19 108.56 1rf5 n GLY 75 Ca -0.05 -2.23 -0.02 0.00 0.00 0.00 0.00 46.02 43.72 1rf5 n GLY 75 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1rf5 h MET 76 N 5.45 0.00 0.00 1.61 4.05 -1.85 -3.32 114.93 120.87 1rf5 h MET 76 Ca 0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1rf5 h MET 76 Cb 0.00 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 1rf5 h MET 76 CO 0.00 0.68 -0.24 0.00 0.23 0.00 0.00 176.91 177.58 1rf5 n ALA 77 N -2.39 2.28 0.91 0.39 0.00 -1.26 -4.78 120.51 115.66 1rf5 n ALA 77 Ca -0.01 -2.14 0.10 0.00 0.00 0.00 0.00 53.44 51.39 1rf5 n ALA 77 Cb 0.68 -0.43 0.29 0.00 0.00 0.00 0.00 19.45 19.99 1rf5 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rf5 n GLY 78 N -0.88 0.73 3.71 0.00 0.00 -1.25 -4.90 105.19 102.60 1rf5 n GLY 78 Ca 0.11 -0.48 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 1rf5 n GLY 78 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1rf5 s LEU 79 N -1.39 4.32 0.41 0.99 2.34 -1.26 -4.84 118.68 119.25 1rf5 s LEU 79 Ca 0.32 1.31 0.08 0.00 0.06 0.00 0.00 54.13 55.90 1rf5 s LEU 79 Cb 0.18 -3.22 0.01 0.00 -0.56 0.00 0.00 46.19 42.59 1rf5 s LEU 79 CO 0.25 -0.17 0.55 -0.54 -1.06 0.00 0.00 176.35 175.38 1rf5 s LYS 80 N 0.95 2.86 0.07 1.48 1.02 0.15 -5.01 119.74 121.27 1rf5 s LYS 80 Ca 0.41 -1.21 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 1rf5 s LYS 80 Cb -0.18 -2.76 -0.05 0.00 -0.52 0.00 0.00 37.83 34.31 1rf5 s LYS 80 CO 0.20 -0.22 1.12 0.00 -0.92 0.00 0.00 175.35 175.53 1rf5 s ALA 81 N -2.33 3.33 0.94 5.17 0.00 -1.26 -4.62 121.76 122.99 1rf5 s ALA 81 Ca 0.54 0.76 -0.15 0.00 0.00 0.00 0.00 51.96 53.11 1rf5 s ALA 81 Cb -0.10 -3.40 0.19 0.00 0.00 0.00 0.00 23.12 19.81 1rf5 s ALA 81 CO 0.33 -0.34 1.30 -1.25 0.00 0.00 0.00 175.76 175.80 1rf5 s PRO 82 N 0.80 0.73 -0.09 0.00 0.04 -1.26 -4.93 135.00 130.29 1rf5 s PRO 82 Ca 0.55 -0.46 -0.03 0.00 0.04 0.00 0.00 61.00 61.11 1rf5 s PRO 82 Cb -0.27 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 1rf5 s PRO 82 CO 0.30 -2.34 -0.05 0.37 0.04 0.00 0.00 177.00 175.32 1rf5 h GLN 83 N -1.56 0.00 -2.08 4.56 5.75 -1.97 -3.47 115.11 116.35 1rf5 h GLN 83 Ca -0.44 0.00 -0.41 0.00 -0.15 0.00 0.00 58.65 57.66 1rf5 h GLN 83 Cb 1.24 0.00 -0.33 0.00 1.07 0.00 0.00 27.48 29.46 1rf5 h GLN 83 CO 0.38 0.00 -0.71 0.54 -2.65 0.00 0.00 178.83 176.39 1rf5 s ASN 84 N -4.98 1.53 0.46 -0.69 6.03 -1.26 -5.12 114.94 110.91 1rf5 s ASN 84 Ca -0.04 -1.65 0.00 0.00 -1.03 0.00 0.00 52.86 50.14 1rf5 s ASN 84 Cb 0.01 0.38 0.00 0.00 -3.03 0.00 0.00 41.25 38.60 1rf5 s ASN 84 CO 0.06 -0.28 0.00 0.00 -2.03 0.00 0.00 177.10 174.86 1rf5 n ALA 85 N 4.26 -1.90 -2.69 3.54 0.00 -1.26 -4.96 120.51 117.51 1rf5 n ALA 85 Ca 0.11 0.40 -0.36 0.00 0.00 0.00 0.00 53.44 53.58 1rf5 n ALA 85 Cb 0.44 -1.30 -0.09 0.00 0.00 0.00 0.00 19.45 18.50 1rf5 n ALA 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rf5 s LEU 86 N -3.26 4.12 -0.27 0.00 1.43 0.54 -5.00 118.68 116.25 1rf5 s LEU 86 Ca 0.00 0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 53.04 1rf5 s LEU 86 Cb 0.00 -2.09 -0.02 0.00 0.03 0.00 0.00 46.19 44.11 1rf5 s LEU 86 CO 0.00 0.10 0.64 0.21 0.23 0.00 0.00 176.35 177.53 1rf5 s ASN 87 N 0.84 6.56 -0.16 2.29 3.84 -1.26 -1.88 114.94 125.18 1rf5 s ASN 87 Ca 0.07 0.64 0.18 0.00 0.21 0.00 0.00 52.86 53.97 1rf5 s ASN 87 Cb -0.13 -2.34 -0.26 0.00 -0.55 0.00 0.00 41.25 37.98 1rf5 s ASN 87 CO 0.02 -0.40 0.18 0.23 -2.79 0.00 0.00 177.10 174.34 1rf5 n MET 88 N 5.77 0.68 0.00 0.43 2.81 -0.03 -4.73 117.12 122.05 1rf5 n MET 88 Ca -0.00 -0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1rf5 n MET 88 Cb 0.49 -1.54 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 1rf5 n MET 88 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rf5 n GLY 89 N 1.66 2.35 0.15 3.03 0.00 -1.25 -3.14 105.19 107.98 1rf5 n GLY 89 Ca -0.27 -0.40 0.09 0.00 0.00 0.00 0.00 46.02 45.44 1rf5 n GLY 89 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1rf5 n ASN 90 N 8.68 1.24 -4.63 1.61 5.15 -1.26 -1.81 115.26 124.24 1rf5 n ASN 90 Ca 0.00 -1.12 -0.43 0.00 -0.60 0.00 0.00 54.58 52.43 1rf5 n ASN 90 Cb 0.00 0.83 -0.02 0.00 -0.53 0.00 0.00 39.78 40.06 1rf5 n ASN 90 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1rf5 s SER 91 N -2.66 6.47 0.29 1.20 0.15 -1.19 -4.81 113.70 113.15 1rf5 s SER 91 Ca 0.10 1.43 0.15 0.00 0.70 0.00 0.00 55.95 58.33 1rf5 s SER 91 Cb 0.15 -2.54 0.12 0.00 -1.71 0.00 0.00 66.02 62.05 1rf5 s SER 91 CO 0.71 -1.21 1.47 1.23 1.20 0.00 0.00 173.24 176.64 1rf5 h GLY 92 N 11.46 0.00 1.29 9.45 0.00 -1.93 -3.26 103.07 120.09 1rf5 h GLY 92 Ca -0.31 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 46.81 1rf5 h GLY 92 CO 1.02 0.00 -0.74 -0.84 0.00 0.00 0.00 176.54 175.97 1rf5 h THR 93 N 0.00 1.30 -0.20 4.70 2.02 -1.98 -3.09 112.91 115.66 1rf5 h THR 93 Ca -0.00 -1.99 -0.03 0.00 0.77 0.00 0.00 66.41 65.16 1rf5 h THR 93 Cb 1.34 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 69.72 1rf5 h THR 93 CO 0.06 0.62 0.01 0.28 0.37 0.00 0.00 175.52 176.87 1rf5 h SER 94 N 0.49 0.34 0.66 4.18 0.02 -1.92 -0.87 113.55 116.44 1rf5 h SER 94 Ca -0.04 -0.29 -0.05 0.00 -0.84 0.00 0.00 61.79 60.56 1rf5 h SER 94 Cb 1.36 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 1rf5 h SER 94 CO 0.15 0.55 -0.26 -0.29 -1.14 0.00 0.00 176.83 175.84 1rf5 h ILE 95 N 0.12 0.75 0.09 3.27 2.10 -1.67 -2.77 117.51 119.39 1rf5 h ILE 95 Ca 0.06 -1.08 -0.32 0.00 1.08 0.00 0.00 64.86 64.60 1rf5 h ILE 95 Cb 0.37 1.67 -0.02 0.00 -1.09 0.00 0.00 36.82 37.75 1rf5 h ILE 95 CO 0.01 0.25 -1.71 0.03 -1.08 0.00 0.00 178.15 175.65 1rf5 h ARG 96 N 0.00 0.19 -0.01 2.19 3.08 -1.47 -3.32 114.38 115.04 1rf5 h ARG 96 Ca -0.00 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.70 1rf5 h ARG 96 Cb 0.65 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1rf5 h ARG 96 CO 0.03 1.16 -0.08 -0.07 -1.07 0.00 0.00 179.97 179.94 1rf5 h LEU 97 N -0.29 0.09 -1.85 3.04 3.38 -1.22 -3.23 115.31 115.23 1rf5 h LEU 97 Ca -0.39 -0.69 -0.03 0.00 0.09 0.00 0.00 57.88 56.86 1rf5 h LEU 97 Cb 1.79 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.51 1rf5 h LEU 97 CO 0.00 0.77 -0.14 0.40 0.09 0.00 0.00 178.44 179.56 1rf5 h ILE 98 N -0.58 0.70 -0.72 1.22 2.04 -1.70 -1.70 117.51 116.77 1rf5 h ILE 98 Ca -0.01 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.33 1rf5 h ILE 98 Cb 0.77 1.35 -0.05 0.00 -0.74 0.00 0.00 36.82 38.15 1rf5 h ILE 98 CO 0.02 0.13 0.44 0.28 0.00 0.00 0.00 178.15 179.03 1rf5 h SER 99 N 0.00 0.72 1.17 1.72 0.02 -1.65 -0.26 113.55 115.27 1rf5 h SER 99 Ca -0.00 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1rf5 h SER 99 Cb 0.34 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1rf5 h SER 99 CO 0.02 0.49 -0.34 1.23 -1.14 0.00 0.00 176.83 177.09 1rf5 h GLY 100 N 0.86 0.00 1.16 -3.77 0.00 -1.36 -3.23 103.07 96.73 1rf5 h GLY 100 Ca 0.30 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.42 1rf5 h GLY 100 CO -0.13 0.00 -0.70 -2.08 0.00 0.00 0.00 176.54 173.64 1rf5 h VAL 101 N 0.00 1.28 -0.12 4.60 2.07 -0.81 -3.02 116.25 120.24 1rf5 h VAL 101 Ca -0.00 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.63 1rf5 h VAL 101 Cb 1.01 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1rf5 h VAL 101 CO 0.04 0.60 0.00 0.18 0.02 0.00 0.00 177.57 178.42 1rf5 n LEU 102 N -3.97 1.57 0.03 2.57 4.77 -0.17 -4.11 117.00 117.69 1rf5 n LEU 102 Ca -0.06 -0.79 -0.06 0.00 -0.03 0.00 0.00 56.01 55.07 1rf5 n LEU 102 Cb 0.71 -0.41 0.13 0.00 -2.33 0.00 0.00 43.42 41.52 1rf5 n LEU 102 CO 0.52 0.28 0.59 0.00 -1.33 0.00 0.00 177.39 177.45 1rf5 h ALA 103 N 2.65 0.91 -0.52 -1.18 0.00 -1.62 -3.10 119.26 116.40 1rf5 h ALA 103 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1rf5 h ALA 103 Cb 0.61 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1rf5 h ALA 103 CO 0.07 0.64 0.00 0.41 0.00 0.00 0.00 179.25 180.37 1rf5 n GLY 104 N -0.02 2.71 3.73 0.00 0.00 -1.26 -2.26 105.19 108.10 1rf5 n GLY 104 Ca -0.02 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 1rf5 n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf5 s ALA 105 N -2.39 3.60 -0.89 4.61 0.00 -1.17 -4.55 121.76 120.97 1rf5 s ALA 105 Ca 0.47 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.71 1rf5 s ALA 105 Cb 0.35 -1.97 0.34 0.00 0.00 0.00 0.00 23.12 21.84 1rf5 s ALA 105 CO 0.15 0.32 1.97 -0.40 0.00 0.00 0.00 175.76 177.80 1rf5 n ASP 106 N 3.02 7.46 -3.81 0.00 3.85 -1.26 -3.74 116.55 122.07 1rf5 n ASP 106 Ca -0.17 -3.80 -0.12 0.00 -0.71 0.00 0.00 54.79 49.99 1rf5 n ASP 106 Cb 0.53 -1.09 -0.09 0.00 -1.35 0.00 0.00 41.12 39.13 1rf5 n ASP 106 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 1rf5 s PHE 107 N -4.14 -0.06 0.24 2.11 -0.12 -1.25 -5.05 117.98 109.71 1rf5 s PHE 107 Ca 0.49 -0.00 -0.30 0.00 -0.05 0.00 0.00 56.93 57.07 1rf5 s PHE 107 Cb 0.38 0.03 -0.09 0.00 -0.63 0.00 0.00 43.02 42.71 1rf5 s PHE 107 CO -0.35 -0.39 1.11 -1.21 -0.05 0.00 0.00 175.22 174.34 1rf5 s GLU 108 N -1.80 4.61 0.04 1.99 0.41 -1.26 -4.50 118.70 118.19 1rf5 s GLU 108 Ca -0.11 1.79 -0.04 0.00 -0.41 0.00 0.00 54.97 56.21 1rf5 s GLU 108 Cb -0.04 -3.22 -0.02 0.00 -1.78 0.00 0.00 34.13 29.07 1rf5 s GLU 108 CO 0.01 0.14 0.06 0.54 -0.49 0.00 0.00 175.26 175.51 1rf5 s VAL 109 N -0.77 0.14 -0.07 2.63 0.11 -0.33 -4.87 120.40 117.25 1rf5 s VAL 109 Ca 0.47 -1.19 0.04 0.00 -2.93 0.00 0.00 61.98 58.37 1rf5 s VAL 109 Cb -0.31 -0.92 -0.00 0.00 -1.53 0.00 0.00 36.38 33.61 1rf5 s VAL 109 CO 0.39 -0.66 -0.20 -0.70 -3.33 0.00 0.00 175.10 170.60 1rf5 s GLU 110 N -2.70 2.28 -0.20 1.54 2.12 -1.26 -1.38 118.70 119.10 1rf5 s GLU 110 Ca -0.04 -0.71 0.01 0.00 0.36 0.00 0.00 54.97 54.59 1rf5 s GLU 110 Cb -0.01 -1.86 0.04 0.00 0.26 0.00 0.00 34.13 32.56 1rf5 s GLU 110 CO -0.05 0.21 -0.14 -1.64 -0.54 0.00 0.00 175.26 173.10 1rf5 s MET 111 N 0.20 2.45 0.09 4.30 -1.94 -0.31 -0.34 119.30 123.77 1rf5 s MET 111 Ca -0.10 -0.94 0.05 0.00 -1.71 0.00 0.00 55.69 52.98 1rf5 s MET 111 Cb -0.15 -2.56 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 1rf5 s MET 111 CO 0.05 -0.37 -0.12 -0.59 -0.01 0.00 0.00 175.02 173.98 1rf5 s PHE 112 N 1.29 1.18 0.00 -0.03 -0.71 -0.79 -1.36 117.98 117.57 1rf5 s PHE 112 Ca -0.00 -0.57 0.00 0.00 -1.04 0.00 0.00 56.93 55.32 1rf5 s PHE 112 Cb -0.16 -0.64 0.00 0.00 -1.21 0.00 0.00 43.02 41.01 1rf5 s PHE 112 CO -0.09 0.05 0.00 0.41 -1.34 0.00 0.00 175.22 174.25 1rf5 n GLY 113 N 0.79 4.93 0.92 1.99 0.00 -1.26 -0.85 105.19 111.71 1rf5 n GLY 113 Ca -0.18 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.18 1rf5 n GLY 113 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rf5 n ASP 114 N -1.13 0.08 0.21 1.61 3.85 -0.75 -4.82 116.55 115.61 1rf5 n ASP 114 Ca 0.00 -1.15 0.06 0.00 -0.71 0.00 0.00 54.79 52.99 1rf5 n ASP 114 Cb 0.00 -0.23 0.47 0.00 -1.35 0.00 0.00 41.12 40.02 1rf5 n ASP 114 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 1rf5 h ASP 115 N -0.36 0.00 -0.06 -1.12 3.32 -1.99 -2.01 116.42 114.20 1rf5 h ASP 115 Ca -0.10 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.70 1rf5 h ASP 115 Cb 0.29 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.85 1rf5 h ASP 115 CO 0.08 0.27 -0.94 -1.28 -1.72 0.00 0.00 179.24 175.64 1rf5 h SER 116 N 0.00 0.94 0.63 6.45 0.87 -1.93 -3.27 113.55 117.23 1rf5 h SER 116 Ca -0.00 -0.69 -0.16 0.00 -1.23 0.00 0.00 61.79 59.70 1rf5 h SER 116 Cb 0.53 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 1rf5 h SER 116 CO 0.04 1.50 -0.74 0.25 -0.53 0.00 0.00 176.83 177.34 1rf5 h LEU 117 N 0.46 0.11 -0.63 2.23 6.46 -1.77 -3.21 115.31 118.97 1rf5 h LEU 117 Ca -0.10 -0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.58 1rf5 h LEU 117 Cb 1.59 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.48 1rf5 h LEU 117 CO 0.19 0.81 0.00 -1.20 -0.62 0.00 0.00 178.44 177.62 1rf5 n SER 118 N -3.71 0.64 -0.36 1.25 7.64 -0.77 -2.20 113.62 116.11 1rf5 n SER 118 Ca -0.02 0.65 0.13 0.00 1.01 0.00 0.00 58.87 60.64 1rf5 n SER 118 Cb 0.71 -0.79 0.30 0.00 -1.01 0.00 0.00 64.21 63.42 1rf5 n SER 118 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1rf5 n LYS 119 N -2.20 1.08 -3.56 1.43 5.02 -1.21 -4.15 118.16 114.57 1rf5 n LYS 119 Ca 0.02 -0.72 -0.36 0.00 -2.02 0.00 0.00 58.31 55.23 1rf5 n LYS 119 Cb 0.24 -1.49 -0.07 0.00 -0.02 0.00 0.00 35.03 33.69 1rf5 n LYS 119 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1rf5 s ARG 120 N -2.42 4.18 0.47 1.97 0.52 -0.93 -5.08 118.95 117.66 1rf5 s ARG 120 Ca 0.25 0.09 -0.22 0.00 -0.52 0.00 0.00 55.73 55.33 1rf5 s ARG 120 Cb 0.19 -3.40 -0.08 0.00 0.52 0.00 0.00 34.95 32.19 1rf5 s ARG 120 CO 0.50 0.31 1.11 -1.25 0.02 0.00 0.00 175.30 175.99 1rf5 s PRO 121 N 0.26 3.78 0.00 3.54 0.04 -1.26 -4.42 135.00 136.94 1rf5 s PRO 121 Ca 0.17 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1rf5 s PRO 121 Cb -0.13 -2.30 0.00 0.00 0.04 0.00 0.00 34.50 32.11 1rf5 s PRO 121 CO 0.04 -0.49 0.78 -1.33 0.04 0.00 0.00 177.00 176.04 1rf5 n MET 122 N -0.63 1.56 0.30 4.56 2.81 -0.77 -4.77 117.12 120.17 1rf5 n MET 122 Ca 0.08 -1.08 0.19 0.00 -1.81 0.00 0.00 57.70 55.08 1rf5 n MET 122 Cb 0.50 -0.92 0.90 0.00 -0.71 0.00 0.00 33.22 32.99 1rf5 n MET 122 CO 0.00 0.00 0.00 0.38 1.51 0.00 0.00 175.97 177.86 1rf5 h ASP 123 N 0.00 0.00 1.33 7.83 -0.00 -1.58 -0.24 116.42 123.76 1rf5 h ASP 123 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1rf5 h ASP 123 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.77 1rf5 h ASP 123 CO 0.00 0.03 0.00 0.03 -0.00 0.00 0.00 179.24 179.30 1rf5 h ARG 124 N 0.00 0.00 0.00 4.15 3.08 -1.87 -3.00 114.38 116.75 1rf5 h ARG 124 Ca -0.00 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.68 1rf5 h ARG 124 Cb 0.29 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.27 1rf5 h ARG 124 CO 0.00 0.00 -2.40 0.28 -1.07 0.00 0.00 179.97 176.78 1rf5 n VAL 125 N -2.83 1.41 0.10 2.04 0.31 -0.22 -4.57 118.33 114.56 1rf5 n VAL 125 Ca 0.03 -0.55 -0.04 0.00 -0.01 0.00 0.00 64.34 63.77 1rf5 n VAL 125 Cb 0.38 -1.35 0.14 0.00 -0.91 0.00 0.00 33.84 32.10 1rf5 n VAL 125 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 1rf5 h THR 126 N 0.00 1.39 0.23 2.52 1.35 -1.32 -3.14 112.91 113.93 1rf5 h THR 126 Ca -0.55 -1.96 -0.01 0.00 -0.55 0.00 0.00 66.41 63.34 1rf5 h THR 126 Cb 1.86 2.00 0.00 0.00 -1.73 0.00 0.00 68.15 70.28 1rf5 h THR 126 CO -0.08 0.58 -0.11 0.25 -0.25 0.00 0.00 175.52 175.90 1rf5 h LEU 127 N 0.15 -0.26 -0.99 3.87 5.85 -1.77 -1.67 115.31 120.49 1rf5 h LEU 127 Ca -0.00 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 1rf5 h LEU 127 Cb 1.08 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 1rf5 h LEU 127 CO 0.09 -0.09 -0.43 1.55 -0.34 0.00 0.00 178.44 179.22 1rf5 h PRO 128 N -0.42 0.00 -0.09 5.25 0.13 -1.81 -3.18 132.00 131.89 1rf5 h PRO 128 Ca -0.03 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.96 1rf5 h PRO 128 Cb 0.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.43 1rf5 h PRO 128 CO 0.05 0.43 -0.55 -0.07 -0.23 0.00 0.00 178.00 177.63 1rf5 h LEU 129 N 0.00 0.29 -1.89 1.56 3.38 -1.48 -2.90 115.31 114.27 1rf5 h LEU 129 Ca -0.00 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 1rf5 h LEU 129 Cb 0.88 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1rf5 h LEU 129 CO 0.06 0.79 -0.08 0.11 0.09 0.00 0.00 178.44 179.40 1rf5 h LYS 130 N 0.20 0.00 0.00 1.13 1.57 -1.28 -1.77 116.57 116.42 1rf5 h LYS 130 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 1rf5 h LYS 130 Cb 1.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 1rf5 h LYS 130 CO 0.09 0.08 -0.22 0.87 -0.57 0.00 0.00 179.45 179.70 1rf5 h LYS 131 N 0.00 0.00 0.05 3.15 1.57 -1.58 -3.24 116.57 116.52 1rf5 h LYS 131 Ca -0.00 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.49 1rf5 h LYS 131 Cb 0.37 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1rf5 h LYS 131 CO 0.01 0.22 -1.58 0.52 -0.57 0.00 0.00 179.45 178.05 1rf5 h MET 132 N 0.00 0.11 0.00 3.15 2.86 -1.42 -3.46 114.93 116.18 1rf5 h MET 132 Ca -0.00 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1rf5 h MET 132 Cb 0.60 0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.33 1rf5 h MET 132 CO 0.03 0.86 0.00 0.41 1.06 0.00 0.00 176.91 179.27 1rf5 n GLY 133 N 1.61 1.06 3.71 8.32 0.00 -1.18 -0.10 105.19 118.62 1rf5 n GLY 133 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1rf5 n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rf5 s VAL 134 N 0.00 4.02 -0.22 1.61 0.11 -1.24 -4.69 120.40 119.99 1rf5 s VAL 134 Ca 0.00 1.43 -0.20 0.00 -2.93 0.00 0.00 61.98 60.28 1rf5 s VAL 134 Cb 0.00 -3.92 -0.02 0.00 -1.53 0.00 0.00 36.38 30.91 1rf5 s VAL 134 CO 0.00 0.08 0.60 -0.55 -3.33 0.00 0.00 175.10 171.91 1rf5 s SER 135 N 1.20 6.61 0.00 3.54 0.15 -1.26 -4.04 113.70 119.90 1rf5 s SER 135 Ca 0.59 0.74 0.00 0.00 0.70 0.00 0.00 55.95 57.98 1rf5 s SER 135 Cb -0.29 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1rf5 s SER 135 CO 0.28 -0.29 0.00 -0.38 1.20 0.00 0.00 173.24 174.04 1rf5 n ILE 136 N 4.88 0.00 -1.05 6.45 -0.00 -1.26 -1.67 119.36 126.72 1rf5 n ILE 136 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.73 1rf5 n ILE 136 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.14 1rf5 n ILE 136 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1rf5 n SER 137 N 0.00 -5.84 0.00 4.38 3.41 -1.26 -4.44 113.62 109.87 1rf5 n SER 137 Ca 0.00 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 1rf5 n SER 137 Cb 0.00 -2.92 0.00 0.00 -0.26 0.00 0.00 64.21 61.03 1rf5 n SER 137 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rf5 n GLY 138 N -1.49 4.68 3.82 5.00 0.00 -1.26 -3.16 105.19 112.78 1rf5 n GLY 138 Ca 0.00 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 1rf5 n GLY 138 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rf5 s GLN 139 N 4.57 3.23 1.01 1.61 -0.21 -0.26 -4.80 119.66 124.81 1rf5 s GLN 139 Ca 0.00 -0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.02 1rf5 s GLN 139 Cb 0.00 -2.98 0.00 0.00 1.00 0.00 0.00 33.01 31.03 1rf5 s GLN 139 CO 0.00 0.69 0.00 0.25 -2.12 0.00 0.00 175.29 174.11 1rf5 n THR 140 N 1.41 0.00 0.16 -0.19 -2.24 -1.26 0.30 114.28 112.45 1rf5 n THR 140 Ca -0.15 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.67 1rf5 n THR 140 Cb 0.53 -0.30 0.17 0.00 -2.10 0.00 0.00 70.33 68.63 1rf5 n THR 140 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1rf5 h GLU 141 N 0.00 0.00 -0.10 -0.78 4.57 -2.01 -3.06 114.58 113.20 1rf5 h GLU 141 Ca 0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1rf5 h GLU 141 Cb 0.80 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.39 1rf5 h GLU 141 CO 0.01 0.47 0.00 2.89 -1.18 0.00 0.00 179.01 181.20 1rf5 n ARG 142 N -3.37 1.39 -3.32 1.92 1.85 -1.26 -4.88 116.66 108.99 1rf5 n ARG 142 Ca 0.01 -0.59 -0.10 0.00 -1.00 0.00 0.00 57.85 56.17 1rf5 n ARG 142 Cb 0.64 -1.33 0.01 0.00 -1.05 0.00 0.00 32.46 30.73 1rf5 n ARG 142 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1rf5 n ASP 143 N -0.17 -6.75 -4.81 2.89 8.00 -1.12 -1.85 116.55 112.74 1rf5 n ASP 143 Ca 0.14 -0.42 -0.34 0.00 0.71 0.00 0.00 54.79 54.88 1rf5 n ASP 143 Cb 0.20 -4.14 -0.07 0.00 -0.02 0.00 0.00 41.12 37.09 1rf5 n ASP 143 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rf5 s LEU 144 N -4.51 4.10 0.58 0.64 1.43 0.15 -2.40 118.68 118.66 1rf5 s LEU 144 Ca 0.05 1.65 -0.21 0.00 -1.03 0.00 0.00 54.13 54.60 1rf5 s LEU 144 Cb -0.01 -4.26 -0.04 0.00 0.03 0.00 0.00 46.19 41.91 1rf5 s LEU 144 CO 0.80 -0.23 1.31 -2.65 0.23 0.00 0.00 176.35 175.81 1rf5 n PRO 145 N -0.17 1.48 -2.03 1.29 -0.02 -1.26 -1.10 135.00 133.19 1rf5 n PRO 145 Ca 0.04 0.55 -0.31 0.00 -2.02 0.00 0.00 63.50 61.76 1rf5 n PRO 145 Cb 0.53 -2.53 -0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1rf5 n PRO 145 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1rf5 s PRO 146 N -2.99 3.64 0.04 0.52 0.04 -1.26 -4.73 135.00 130.25 1rf5 s PRO 146 Ca 0.75 0.87 0.08 0.00 0.04 0.00 0.00 61.00 62.73 1rf5 s PRO 146 Cb -0.41 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1rf5 s PRO 146 CO 0.47 -0.53 -0.23 -0.51 0.04 0.00 0.00 177.00 176.24 1rf5 s LEU 147 N -4.80 2.15 -0.09 -3.56 1.43 -0.46 -4.12 118.68 109.23 1rf5 s LEU 147 Ca 0.57 -0.53 -0.05 0.00 -1.03 0.00 0.00 54.13 53.09 1rf5 s LEU 147 Cb -0.11 -1.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.97 1rf5 s LEU 147 CO 0.45 0.20 0.10 -0.13 0.23 0.00 0.00 176.35 177.21 1rf5 s ARG 148 N -1.13 3.28 -0.02 1.70 0.52 -1.19 -1.16 118.95 120.95 1rf5 s ARG 148 Ca 0.09 -0.25 0.03 0.00 -0.52 0.00 0.00 55.73 55.08 1rf5 s ARG 148 Cb -0.09 -3.04 -0.00 0.00 0.52 0.00 0.00 34.95 32.33 1rf5 s ARG 148 CO 0.02 0.74 -0.09 -1.17 0.02 0.00 0.00 175.30 174.82 1rf5 s LEU 149 N -1.10 1.90 0.00 2.53 0.20 -0.48 -4.22 118.68 117.52 1rf5 s LEU 149 Ca 0.16 -0.18 0.00 0.00 0.69 0.00 0.00 54.13 54.80 1rf5 s LEU 149 Cb -0.12 -0.51 0.00 0.00 -0.43 0.00 0.00 46.19 45.13 1rf5 s LEU 149 CO 0.05 0.09 0.00 1.17 -0.29 0.00 0.00 176.35 177.37 1rf5 n LYS 150 N 3.07 0.00 0.00 1.98 0.00 -0.67 -1.19 118.16 121.35 1rf5 n LYS 150 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.15 1rf5 n LYS 150 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.59 1rf5 n LYS 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1rf5 n GLY 151 N 3.15 2.34 3.10 3.14 0.00 -1.25 -3.80 105.19 111.87 1rf5 n GLY 151 Ca 0.00 -1.80 -0.17 0.00 0.00 0.00 0.00 46.02 44.05 1rf5 n GLY 151 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rf5 s THR 152 N -2.37 0.83 -0.38 2.61 -4.23 -0.96 -4.47 115.64 106.68 1rf5 s THR 152 Ca 0.00 -1.04 0.21 0.00 -1.18 0.00 0.00 61.69 59.68 1rf5 s THR 152 Cb 0.00 -0.81 0.28 0.00 1.34 0.00 0.00 72.50 73.31 1rf5 s THR 152 CO 0.00 -0.19 1.57 0.50 -0.54 0.00 0.00 174.62 175.96 1rf5 h LYS 153 N 4.69 0.00 -1.45 3.99 3.11 -1.86 -3.30 116.57 121.76 1rf5 h LYS 153 Ca -0.37 0.00 -0.55 0.00 -2.81 0.00 0.00 60.65 56.92 1rf5 h LYS 153 Cb 1.19 0.00 -0.22 0.00 -1.00 0.00 0.00 32.23 32.20 1rf5 h LYS 153 CO 0.42 0.11 0.68 0.09 -2.81 0.00 0.00 179.45 177.95 1rf5 n ASN 154 N -3.13 7.10 -4.72 4.20 3.02 -1.26 -4.98 115.26 115.50 1rf5 n ASN 154 Ca 0.04 -3.47 -0.42 0.00 -0.03 0.00 0.00 54.58 50.69 1rf5 n ASN 154 Cb 0.58 -1.05 -0.03 0.00 -0.61 0.00 0.00 39.78 38.66 1rf5 n ASN 154 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1rf5 s LEU 155 N -2.96 4.37 0.15 3.41 2.96 -1.24 -4.91 118.68 120.47 1rf5 s LEU 155 Ca 0.51 2.49 -0.13 0.00 -0.22 0.00 0.00 54.13 56.77 1rf5 s LEU 155 Cb 0.39 -3.59 -0.07 0.00 0.50 0.00 0.00 46.19 43.42 1rf5 s LEU 155 CO -0.09 -0.75 0.54 -0.13 -1.32 0.00 0.00 176.35 174.60 1rf5 s ARG 156 N 1.10 3.94 0.59 1.98 0.52 0.86 -4.14 118.95 123.80 1rf5 s ARG 156 Ca 0.67 0.45 -0.19 0.00 -0.52 0.00 0.00 55.73 56.14 1rf5 s ARG 156 Cb -0.41 -2.90 -0.04 0.00 0.52 0.00 0.00 34.95 32.13 1rf5 s ARG 156 CO 0.31 0.46 1.20 -2.14 0.02 0.00 0.00 175.30 175.15 1rf5 s PRO 157 N -2.07 3.02 -0.09 3.54 0.02 -1.26 -4.60 135.00 133.57 1rf5 s PRO 157 Ca 0.39 1.81 -0.05 0.00 0.02 0.00 0.00 61.00 63.17 1rf5 s PRO 157 Cb -0.14 -1.94 -0.04 0.00 0.02 0.00 0.00 34.50 32.39 1rf5 s PRO 157 CO 0.19 -1.17 0.14 -1.50 -0.33 0.00 0.00 177.00 174.33 1rf5 s ILE 158 N -1.60 5.37 -0.50 2.83 2.07 -1.26 -4.92 121.20 123.19 1rf5 s ILE 158 Ca 0.77 0.06 0.03 0.00 -1.41 0.00 0.00 60.65 60.10 1rf5 s ILE 158 Cb -0.30 -3.38 0.16 0.00 0.13 0.00 0.00 42.46 39.07 1rf5 s ILE 158 CO 0.33 0.54 0.34 -1.00 -1.91 0.00 0.00 174.94 173.23 1rf5 s HIS 159 N -1.10 2.04 -0.00 3.50 3.76 -1.26 -0.58 115.29 121.66 1rf5 s HIS 159 Ca 0.18 -2.59 0.02 0.00 -0.15 0.00 0.00 55.06 52.52 1rf5 s HIS 159 Cb -0.12 -1.73 -0.01 0.00 1.11 0.00 0.00 32.58 31.83 1rf5 s HIS 159 CO 0.08 -0.74 -0.07 -0.47 -0.85 0.00 0.00 174.74 172.69 1rf5 s TYR 160 N -0.19 0.66 -0.17 1.40 6.14 -1.00 -5.03 117.35 119.16 1rf5 s TYR 160 Ca 0.25 -0.15 -0.04 0.00 0.64 0.00 0.00 57.07 57.76 1rf5 s TYR 160 Cb -0.10 -0.42 -0.03 0.00 0.42 0.00 0.00 41.96 41.84 1rf5 s TYR 160 CO -0.11 -0.01 -0.02 -2.00 0.64 0.00 0.00 175.55 174.05 1rf5 s GLU 161 N -0.28 3.68 0.08 4.97 2.12 -1.26 -1.93 118.70 126.08 1rf5 s GLU 161 Ca 0.02 -0.51 -0.31 0.00 0.36 0.00 0.00 54.97 54.54 1rf5 s GLU 161 Cb -0.03 -2.99 -0.07 0.00 0.26 0.00 0.00 34.13 31.30 1rf5 s GLU 161 CO -0.00 0.18 1.37 -0.51 -0.54 0.00 0.00 175.26 175.75 1rf5 s LEU 162 N 0.55 4.36 0.34 2.70 1.02 -0.59 -4.93 118.68 122.12 1rf5 s LEU 162 Ca -0.02 2.23 0.25 0.00 0.02 0.00 0.00 54.13 56.61 1rf5 s LEU 162 Cb -0.14 -3.58 0.63 0.00 0.02 0.00 0.00 46.19 43.12 1rf5 s LEU 162 CO 0.02 -0.65 1.71 1.55 0.02 0.00 0.00 176.35 179.01 1rf5 h PRO 163 N 7.07 0.00 -4.72 1.29 0.13 -1.97 -3.35 132.00 130.46 1rf5 h PRO 163 Ca -0.41 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.39 1rf5 h PRO 163 Cb 1.20 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.10 1rf5 h PRO 163 CO 0.87 0.00 -0.75 -1.50 -0.23 0.00 0.00 178.00 176.38 1rf5 s ILE 164 N -3.19 0.67 -1.21 -3.56 1.10 -1.26 -5.03 121.20 108.72 1rf5 s ILE 164 Ca 0.08 -0.88 -0.21 0.00 -0.51 0.00 0.00 60.65 59.14 1rf5 s ILE 164 Cb 0.09 -0.66 0.00 0.00 0.15 0.00 0.00 42.46 42.03 1rf5 s ILE 164 CO 0.62 -0.17 1.80 0.00 -2.11 0.00 0.00 174.94 175.08 1rf5 s ALA 165 N -0.96 2.58 -0.07 1.50 0.00 -1.26 -4.70 121.76 118.84 1rf5 s ALA 165 Ca -0.04 -2.48 0.02 0.00 0.00 0.00 0.00 51.96 49.46 1rf5 s ALA 165 Cb -0.08 -4.64 0.01 0.00 0.00 0.00 0.00 23.12 18.41 1rf5 s ALA 165 CO 0.01 -4.16 -0.11 0.45 0.00 0.00 0.00 175.76 171.94 1rf5 s SER 166 N 5.41 1.82 0.23 0.00 0.15 -1.26 -5.02 113.70 115.03 1rf5 s SER 166 Ca 0.60 -0.30 0.12 0.00 0.70 0.00 0.00 55.95 57.07 1rf5 s SER 166 Cb 0.01 -0.82 0.04 0.00 -1.71 0.00 0.00 66.02 63.54 1rf5 s SER 166 CO 0.08 0.01 1.42 0.00 1.20 0.00 0.00 173.24 175.95 1rf5 h ALA 167 N 7.15 0.60 -0.26 5.45 0.00 -1.91 -3.14 119.26 127.15 1rf5 h ALA 167 Ca -0.31 -0.62 -0.15 0.00 0.00 0.00 0.00 54.91 53.82 1rf5 h ALA 167 Cb 1.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1rf5 h ALA 167 CO 0.47 0.86 -0.46 1.96 0.00 0.00 0.00 179.25 182.08 1rf5 h GLN 168 N 0.00 0.68 -0.25 0.00 4.20 -1.95 -0.97 115.11 116.82 1rf5 h GLN 168 Ca -0.01 -0.38 -0.18 0.00 0.06 0.00 0.00 58.65 58.14 1rf5 h GLN 168 Cb 1.47 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 29.27 1rf5 h GLN 168 CO 0.09 1.00 -0.58 0.28 -0.67 0.00 0.00 178.83 178.95 1rf5 h VAL 169 N 0.55 1.29 -0.44 -0.54 2.07 -1.94 -2.45 116.25 114.79 1rf5 h VAL 169 Ca 0.03 -1.78 -0.05 0.00 0.82 0.00 0.00 66.70 65.72 1rf5 h VAL 169 Cb 1.01 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.46 1rf5 h VAL 169 CO 0.09 0.57 0.08 0.50 0.02 0.00 0.00 177.57 178.84 1rf5 h LYS 170 N 0.59 0.73 -0.21 1.57 3.64 -1.48 -2.17 116.57 119.25 1rf5 h LYS 170 Ca 0.01 -0.19 -0.16 0.00 -1.27 0.00 0.00 60.65 59.04 1rf5 h LYS 170 Cb 1.17 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1rf5 h LYS 170 CO 0.12 0.75 -0.52 0.77 -2.27 0.00 0.00 179.45 178.30 1rf5 h SER 171 N 0.59 0.65 -0.43 4.20 0.02 -1.22 -1.65 113.55 115.72 1rf5 h SER 171 Ca 0.14 -0.34 -0.09 0.00 -0.84 0.00 0.00 61.79 60.66 1rf5 h SER 171 Cb 0.36 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1rf5 h SER 171 CO 0.01 1.05 -0.04 0.00 -1.14 0.00 0.00 176.83 176.71 1rf5 h ALA 172 N 0.96 0.99 0.00 3.77 0.00 -1.40 -1.15 119.26 122.44 1rf5 h ALA 172 Ca 0.02 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 1rf5 h ALA 172 Cb 1.06 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1rf5 h ALA 172 CO 0.10 0.61 -0.44 -0.07 0.00 0.00 0.00 179.25 179.45 1rf5 h LEU 173 N 0.79 0.00 -0.15 0.00 4.07 -1.31 -2.81 115.31 115.89 1rf5 h LEU 173 Ca 0.14 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.87 1rf5 h LEU 173 Cb 0.53 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.28 1rf5 h LEU 173 CO 0.03 0.44 -0.81 0.24 -1.08 0.00 0.00 178.44 177.25 1rf5 h MET 174 N 0.00 0.77 -0.13 1.13 2.86 -0.85 -2.48 114.93 116.23 1rf5 h MET 174 Ca -0.00 -0.65 -0.11 0.00 -2.06 0.00 0.00 59.70 56.87 1rf5 h MET 174 Cb 0.99 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.78 1rf5 h MET 174 CO 0.06 1.26 -0.41 0.74 1.06 0.00 0.00 176.91 179.61 1rf5 h PHE 175 N 0.52 0.33 0.00 -0.22 0.05 -1.20 -2.82 116.94 113.60 1rf5 h PHE 175 Ca -0.06 -0.09 -0.13 0.00 3.82 0.00 0.00 57.97 61.51 1rf5 h PHE 175 Cb 1.44 -0.07 -0.02 0.00 2.00 0.00 0.00 35.95 39.30 1rf5 h PHE 175 CO 0.09 0.65 -0.60 0.00 -0.18 0.00 0.00 178.31 178.27 1rf5 h ALA 176 N 1.34 0.81 0.00 2.45 0.00 -1.37 -3.19 119.26 119.30 1rf5 h ALA 176 Ca 0.02 -0.54 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 1rf5 h ALA 176 Cb 0.83 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1rf5 h ALA 176 CO 0.07 0.74 -0.43 0.00 0.00 0.00 0.00 179.25 179.63 1rf5 h ALA 177 N 1.40 1.05 0.00 0.00 0.00 -1.19 -2.90 119.26 117.61 1rf5 h ALA 177 Ca -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1rf5 h ALA 177 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1rf5 h ALA 177 CO 0.08 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.14 1rf5 n LEU 178 N -3.68 0.00 -0.10 0.00 4.77 -1.12 -3.52 117.00 113.35 1rf5 n LEU 178 Ca -0.01 0.48 -0.12 0.00 -0.03 0.00 0.00 56.01 56.33 1rf5 n LEU 178 Cb 0.51 -0.48 -0.12 0.00 -2.33 0.00 0.00 43.42 41.01 1rf5 n LEU 178 CO 0.38 -0.09 -1.15 0.00 -1.33 0.00 0.00 177.39 175.20 1rf5 n GLN 179 N -1.48 0.84 -2.54 3.23 6.02 -1.12 -3.11 117.38 119.23 1rf5 n GLN 179 Ca 0.06 0.07 -0.39 0.00 -0.01 0.00 0.00 57.00 56.73 1rf5 n GLN 179 Cb 0.27 -1.44 -0.04 0.00 1.02 0.00 0.00 30.24 30.04 1rf5 n GLN 179 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rf5 s ALA 180 N -2.43 3.30 -0.50 -1.58 0.00 -1.11 -4.60 121.76 114.83 1rf5 s ALA 180 Ca -0.20 0.79 -0.24 0.00 0.00 0.00 0.00 51.96 52.31 1rf5 s ALA 180 Cb 0.06 -3.29 0.03 0.00 0.00 0.00 0.00 23.12 19.93 1rf5 s ALA 180 CO 0.60 -0.12 0.92 0.15 0.00 0.00 0.00 175.76 177.30 1rf5 s LYS 181 N -1.75 3.41 0.00 0.00 3.01 -1.26 -3.72 119.74 119.44 1rf5 s LYS 181 Ca 0.48 -0.09 0.00 0.00 -1.01 0.00 0.00 55.97 55.35 1rf5 s LYS 181 Cb -0.28 -3.99 0.00 0.00 -1.01 0.00 0.00 37.83 32.55 1rf5 s LYS 181 CO 0.35 -1.34 0.00 0.41 0.51 0.00 0.00 175.35 175.28 1rf5 n GLY 182 N 5.03 0.91 3.67 -3.33 0.00 -0.95 -4.66 105.19 105.86 1rf5 n GLY 182 Ca 0.03 -1.91 -0.39 0.00 0.00 0.00 0.00 46.02 43.75 1rf5 n GLY 182 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rf5 s GLU 183 N -1.49 4.23 -0.11 1.61 2.12 -1.26 -2.68 118.70 121.11 1rf5 s GLU 183 Ca 0.00 0.53 0.01 0.00 0.36 0.00 0.00 54.97 55.87 1rf5 s GLU 183 Cb 0.00 -3.55 -0.02 0.00 0.26 0.00 0.00 34.13 30.82 1rf5 s GLU 183 CO 0.00 -0.15 -0.13 -1.12 -0.54 0.00 0.00 175.26 173.33 1rf5 s SER 184 N 1.11 4.09 -0.19 -1.70 0.01 -0.66 -4.52 113.70 111.83 1rf5 s SER 184 Ca 0.27 -0.27 0.01 0.00 1.31 0.00 0.00 55.95 57.27 1rf5 s SER 184 Cb -0.16 -1.43 0.03 0.00 0.21 0.00 0.00 66.02 64.67 1rf5 s SER 184 CO 0.10 0.21 -0.18 -0.69 0.41 0.00 0.00 173.24 173.10 1rf5 s VAL 185 N 0.06 2.12 -0.20 3.43 1.01 0.26 -1.20 120.40 125.88 1rf5 s VAL 185 Ca -0.05 -1.03 -0.01 0.00 0.00 0.00 0.00 61.98 60.89 1rf5 s VAL 185 Cb -0.14 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.30 1rf5 s VAL 185 CO 0.04 0.45 -0.13 -0.63 0.00 0.00 0.00 175.10 174.83 1rf5 s ILE 186 N 1.27 2.62 -0.17 2.22 1.01 0.33 -2.37 121.20 126.11 1rf5 s ILE 186 Ca 0.03 -0.75 -0.05 0.00 0.00 0.00 0.00 60.65 59.88 1rf5 s ILE 186 Cb -0.14 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.15 1rf5 s ILE 186 CO -0.11 0.49 0.00 -0.63 0.00 0.00 0.00 174.94 174.69 1rf5 s ILE 187 N 1.35 4.18 0.29 2.92 1.01 -0.81 -0.55 121.20 129.60 1rf5 s ILE 187 Ca 0.05 -0.25 -0.22 0.00 0.00 0.00 0.00 60.65 60.23 1rf5 s ILE 187 Cb -0.14 -2.86 -0.09 0.00 0.01 0.00 0.00 42.46 39.38 1rf5 s ILE 187 CO -0.09 0.47 0.84 -1.61 0.00 0.00 0.00 174.94 174.55 1rf5 s GLU 188 N 0.51 4.37 0.09 2.79 2.02 -0.77 -1.55 118.70 126.16 1rf5 s GLU 188 Ca -0.01 1.07 -0.14 0.00 0.02 0.00 0.00 54.97 55.91 1rf5 s GLU 188 Cb -0.14 -2.76 -0.15 0.00 0.10 0.00 0.00 34.13 31.19 1rf5 s GLU 188 CO 0.02 0.29 1.31 -0.22 0.02 0.00 0.00 175.26 176.68 1rf5 h LYS 189 N 3.11 0.72 -3.72 1.61 3.11 -1.84 -3.46 116.57 116.10 1rf5 h LYS 189 Ca -0.47 -0.55 -0.08 0.00 -2.81 0.00 0.00 60.65 56.73 1rf5 h LYS 189 Cb 1.19 0.10 -0.13 0.00 -1.00 0.00 0.00 32.23 32.39 1rf5 h LYS 189 CO 0.65 1.17 -0.28 -2.00 -2.81 0.00 0.00 179.45 176.18 1rf5 s GLU 190 N -3.83 0.99 -0.51 1.90 2.56 -1.26 -5.02 118.70 113.54 1rf5 s GLU 190 Ca -0.11 -0.96 -0.27 0.00 0.00 0.00 0.00 54.97 53.63 1rf5 s GLU 190 Cb 0.08 0.38 -0.03 0.00 2.00 0.00 0.00 34.13 36.56 1rf5 s GLU 190 CO 0.87 -0.35 1.99 0.71 -0.56 0.00 0.00 175.26 177.92 1rf5 s TYR 191 N -3.88 1.54 0.55 5.30 1.51 -1.26 -4.92 117.35 116.19 1rf5 s TYR 191 Ca 0.08 0.92 0.09 0.00 -1.01 0.00 0.00 57.07 57.15 1rf5 s TYR 191 Cb 0.04 -3.98 0.08 0.00 -0.11 0.00 0.00 41.96 37.99 1rf5 s TYR 191 CO -0.08 -2.57 0.76 0.95 -1.11 0.00 0.00 175.55 173.50 1rf5 s THR 192 N 9.27 2.27 0.19 -0.71 -4.23 -1.26 -4.97 115.64 116.20 1rf5 s THR 192 Ca 0.78 -1.00 -0.31 0.00 -1.18 0.00 0.00 61.69 59.98 1rf5 s THR 192 Cb -0.17 -2.27 -0.10 0.00 1.34 0.00 0.00 72.50 71.31 1rf5 s THR 192 CO 0.25 0.00 1.54 0.00 -0.54 0.00 0.00 174.62 175.87 1rf5 s ARG 193 N -4.62 4.22 0.00 3.99 1.70 -1.26 -4.96 118.95 118.02 1rf5 s ARG 193 Ca 0.61 2.36 0.00 0.00 -0.47 0.00 0.00 55.73 58.23 1rf5 s ARG 193 Cb -0.06 -3.14 0.00 0.00 -0.57 0.00 0.00 34.95 31.18 1rf5 s ARG 193 CO 0.38 -0.57 0.00 0.27 -1.08 0.00 0.00 175.30 174.30 1rf5 n ASN 194 N 3.51 0.00 0.00 -2.89 0.23 -1.26 -4.77 115.26 110.08 1rf5 n ASN 194 Ca 0.12 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.17 1rf5 n ASN 194 Cb 0.39 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1rf5 n ASN 194 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1rf5 n HIS 195 N -0.29 0.00 0.04 -2.53 8.25 -1.26 -4.22 115.22 115.21 1rf5 n HIS 195 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 1rf5 n HIS 195 Cb 0.00 0.00 0.27 0.00 1.12 0.00 0.00 29.99 31.38 1rf5 n HIS 195 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1rf5 h THR 196 N 0.00 1.23 -0.01 1.59 2.02 -1.95 -1.42 112.91 114.37 1rf5 h THR 196 Ca 0.00 -1.04 -0.13 0.00 0.77 0.00 0.00 66.41 66.01 1rf5 h THR 196 Cb 0.00 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1rf5 h THR 196 CO 0.00 0.33 -0.61 -0.33 0.37 0.00 0.00 175.52 175.28 1rf5 h GLU 197 N 0.39 0.03 -0.03 6.66 3.07 -1.97 -1.90 114.58 120.82 1rf5 h GLU 197 Ca 0.07 -0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 58.75 1rf5 h GLU 197 Cb 0.52 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.44 1rf5 h GLU 197 CO 0.03 0.63 -0.61 -0.44 -1.40 0.00 0.00 179.01 177.22 1rf5 h ASP 198 N 0.02 0.60 0.90 1.42 3.45 -1.81 -3.15 116.42 117.85 1rf5 h ASP 198 Ca -0.01 -0.72 -0.07 0.00 0.43 0.00 0.00 57.03 56.67 1rf5 h ASP 198 Cb 1.09 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 39.67 1rf5 h ASP 198 CO 0.08 1.23 -0.32 -0.03 -1.57 0.00 0.00 179.24 178.64 1rf5 h MET 199 N 0.01 0.00 -0.15 3.56 4.05 -1.28 -2.17 114.93 118.95 1rf5 h MET 199 Ca -0.07 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 1rf5 h MET 199 Cb 1.30 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.09 1rf5 h MET 199 CO 0.12 0.32 0.00 1.25 0.23 0.00 0.00 176.91 178.83 1rf5 h LEU 200 N 0.00 0.27 -1.21 3.39 6.46 -1.41 -1.42 115.31 121.39 1rf5 h LEU 200 Ca -0.00 -0.31 -0.08 0.00 -0.12 0.00 0.00 57.88 57.37 1rf5 h LEU 200 Cb 0.85 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.70 1rf5 h LEU 200 CO 0.04 0.51 -0.39 1.56 -0.62 0.00 0.00 178.44 179.54 1rf5 h GLN 201 N 0.02 0.00 -0.27 1.25 4.20 -1.49 0.34 115.11 119.16 1rf5 h GLN 201 Ca 0.04 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1rf5 h GLN 201 Cb 0.37 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 1rf5 h GLN 201 CO 0.01 0.39 -0.25 0.37 -0.67 0.00 0.00 178.83 178.68 1rf5 h GLN 202 N 0.00 0.65 -0.06 1.46 4.15 -1.31 -3.23 115.11 116.77 1rf5 h GLN 202 Ca -0.00 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.08 1rf5 h GLN 202 Cb 0.71 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.40 1rf5 h GLN 202 CO 0.05 0.94 0.00 1.19 -1.93 0.00 0.00 178.83 179.08 1rf5 n PHE 203 N -4.32 0.08 0.00 3.99 3.01 -0.54 -4.88 117.46 114.80 1rf5 n PHE 203 Ca -0.04 -0.04 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1rf5 n PHE 203 Cb 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.91 1rf5 n PHE 203 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1rf5 n GLY 204 N 0.94 0.99 3.93 1.37 0.00 -1.07 -0.72 105.19 110.63 1rf5 n GLY 204 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1rf5 n GLY 204 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rf5 s GLY 205 N -1.91 1.69 -0.01 -0.02 0.00 0.12 -4.92 107.32 102.27 1rf5 s GLY 205 Ca 0.00 -0.94 0.02 0.00 0.00 0.00 0.00 44.72 43.80 1rf5 s GLY 205 CO 0.00 -0.51 -0.08 0.30 0.00 0.00 0.00 173.10 172.81 1rf5 s HIS 206 N -3.29 0.74 0.13 1.90 3.76 -1.26 -4.24 115.29 113.03 1rf5 s HIS 206 Ca 0.61 -0.14 -0.14 0.00 -0.15 0.00 0.00 55.06 55.23 1rf5 s HIS 206 Cb -0.10 -0.48 0.02 0.00 1.11 0.00 0.00 32.58 33.12 1rf5 s HIS 206 CO 0.45 -0.02 0.37 -0.48 -0.85 0.00 0.00 174.74 174.21 1rf5 s LEU 207 N -0.14 0.58 -0.08 0.89 2.34 -1.26 -4.48 118.68 116.52 1rf5 s LEU 207 Ca 0.02 -0.46 0.03 0.00 0.06 0.00 0.00 54.13 53.79 1rf5 s LEU 207 Cb -0.04 1.68 0.01 0.00 -0.56 0.00 0.00 46.19 47.28 1rf5 s LEU 207 CO -0.00 -0.87 -0.19 -0.44 -1.06 0.00 0.00 176.35 173.79 1rf5 s SER 208 N -2.84 2.52 -0.05 1.48 0.01 -0.28 -5.00 113.70 109.54 1rf5 s SER 208 Ca 0.06 -0.45 0.06 0.00 1.31 0.00 0.00 55.95 56.93 1rf5 s SER 208 Cb 0.02 -1.16 -0.02 0.00 0.21 0.00 0.00 66.02 65.08 1rf5 s SER 208 CO -0.09 0.11 -0.23 0.68 0.41 0.00 0.00 173.24 174.12 1rf5 s VAL 209 N 0.48 2.29 -0.37 3.43 -7.23 -1.26 -0.18 120.40 117.55 1rf5 s VAL 209 Ca -0.17 -0.99 0.13 0.00 -1.81 0.00 0.00 61.98 59.14 1rf5 s VAL 209 Cb -0.17 -1.84 0.38 0.00 0.56 0.00 0.00 36.38 35.30 1rf5 s VAL 209 CO 0.07 0.57 0.85 -0.67 -0.31 0.00 0.00 175.10 175.61 1rf5 n ASP 210 N 2.78 0.56 -2.69 4.85 4.64 0.26 -5.02 116.55 121.93 1rf5 n ASP 210 Ca -0.17 -2.98 -0.04 0.00 -1.38 0.00 0.00 54.79 50.22 1rf5 n ASP 210 Cb 0.52 -0.28 0.00 0.00 -1.04 0.00 0.00 41.12 40.33 1rf5 n ASP 210 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1rf5 n GLY 211 N 0.16 -2.74 4.04 0.27 0.00 -1.26 -3.70 105.19 101.96 1rf5 n GLY 211 Ca 0.18 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.99 1rf5 n GLY 211 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rf5 n LYS 212 N 0.17 0.00 -2.52 1.61 5.02 -1.26 -4.96 118.16 116.22 1rf5 n LYS 212 Ca 0.06 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.92 1rf5 n LYS 212 Cb 0.21 -0.04 -0.02 0.00 -0.02 0.00 0.00 35.03 35.16 1rf5 n LYS 212 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1rf5 s LYS 213 N 0.00 3.83 -0.17 1.97 2.20 -1.24 -1.84 119.74 124.49 1rf5 s LYS 213 Ca 0.00 0.93 -0.01 0.00 -0.36 0.00 0.00 55.97 56.53 1rf5 s LYS 213 Cb 0.00 -3.88 -0.01 0.00 -1.51 0.00 0.00 37.83 32.43 1rf5 s LYS 213 CO 0.00 -1.24 -0.11 0.42 -0.36 0.00 0.00 175.35 174.07 1rf5 s ILE 214 N 4.42 3.03 -0.21 5.43 1.01 0.29 -0.57 121.20 134.60 1rf5 s ILE 214 Ca 0.52 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 1rf5 s ILE 214 Cb -0.12 -2.31 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 1rf5 s ILE 214 CO 0.26 0.49 -0.06 -0.89 0.00 0.00 0.00 174.94 174.74 1rf5 s THR 215 N 0.87 3.28 -0.12 2.92 2.01 0.74 -0.51 115.64 124.84 1rf5 s THR 215 Ca -0.03 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.46 1rf5 s THR 215 Cb -0.15 -2.48 0.02 0.00 0.01 0.00 0.00 72.50 69.89 1rf5 s THR 215 CO 0.00 0.44 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.53 1rf5 s VAL 216 N 1.38 1.52 -0.14 3.82 1.01 -0.34 -1.13 120.40 126.54 1rf5 s VAL 216 Ca 0.05 -0.65 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 1rf5 s VAL 216 Cb -0.14 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1rf5 s VAL 216 CO -0.03 0.45 0.11 -1.10 0.00 0.00 0.00 175.10 174.53 1rf5 s GLN 217 N 1.08 3.57 0.14 2.72 -0.21 -1.26 -1.65 119.66 124.06 1rf5 s GLN 217 Ca -0.04 -0.20 0.04 0.00 0.02 0.00 0.00 55.36 55.18 1rf5 s GLN 217 Cb -0.14 -3.18 -0.04 0.00 1.00 0.00 0.00 33.01 30.64 1rf5 s GLN 217 CO -0.03 0.63 -0.10 0.20 -2.12 0.00 0.00 175.29 173.87 1rf5 s GLY 218 N -0.62 1.03 0.77 3.09 0.00 -1.09 -4.43 107.32 106.07 1rf5 s GLY 218 Ca 0.12 -1.47 -0.12 0.00 0.00 0.00 0.00 44.72 43.26 1rf5 s GLY 218 CO 0.02 -1.57 1.10 -4.14 0.00 0.00 0.00 173.10 168.51 1rf5 s PRO 219 N -3.75 2.29 -0.14 2.90 0.02 -1.24 -2.24 135.00 132.84 1rf5 s PRO 219 Ca 0.16 0.55 -0.13 0.00 0.02 0.00 0.00 61.00 61.60 1rf5 s PRO 219 Cb 0.03 -1.95 -0.06 0.00 0.02 0.00 0.00 34.50 32.54 1rf5 s PRO 219 CO -0.00 -1.45 -0.27 0.94 -0.33 0.00 0.00 177.00 175.89 1rf5 n GLN 220 N -3.30 0.41 -1.39 5.54 -0.06 -1.18 -5.04 117.38 112.36 1rf5 n GLN 220 Ca 0.07 0.17 0.00 0.00 -2.00 0.00 0.00 57.00 55.24 1rf5 n GLN 220 Cb 0.57 -1.21 0.00 0.00 -4.06 0.00 0.00 30.24 25.53 1rf5 n GLN 220 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1rf5 n LYS 221 N -4.16 -2.64 -4.20 3.69 0.00 -1.26 -5.01 118.16 104.58 1rf5 n LYS 221 Ca -0.18 2.14 -0.24 0.00 0.00 0.00 0.00 58.31 60.03 1rf5 n LYS 221 Cb 0.49 -2.22 -0.07 0.00 0.00 0.00 0.00 35.03 33.23 1rf5 n LYS 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1rf5 s LEU 222 N -0.26 3.14 -0.00 3.14 2.01 -1.26 -4.75 118.68 120.69 1rf5 s LEU 222 Ca 0.00 -0.87 0.08 0.00 0.01 0.00 0.00 54.13 53.35 1rf5 s LEU 222 Cb 0.00 -1.57 -0.02 0.00 0.01 0.00 0.00 46.19 44.61 1rf5 s LEU 222 CO 0.00 -0.27 -0.24 -0.89 1.01 0.00 0.00 176.35 175.96 1rf5 s THR 223 N -2.47 1.88 0.33 5.49 2.01 0.10 -0.98 115.64 122.01 1rf5 s THR 223 Ca 0.36 -1.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.00 1rf5 s THR 223 Cb -0.01 -1.57 -0.10 0.00 0.01 0.00 0.00 72.50 70.82 1rf5 s THR 223 CO 0.21 0.47 1.35 -0.83 -0.69 0.00 0.00 174.62 175.13 1rf5 s GLY 224 N -0.71 2.93 0.18 4.40 0.00 -1.02 -4.67 107.32 108.43 1rf5 s GLY 224 Ca 0.09 1.32 0.06 0.00 0.00 0.00 0.00 44.72 46.19 1rf5 s GLY 224 CO -0.00 2.00 -0.13 1.20 0.00 0.00 0.00 173.10 176.17 1rf5 s GLN 225 N -1.72 1.22 -0.51 2.90 -1.52 -1.23 -4.83 119.66 113.96 1rf5 s GLN 225 Ca 0.50 -1.53 -0.22 0.00 -1.95 0.00 0.00 55.36 52.16 1rf5 s GLN 225 Cb -0.41 -0.92 0.04 0.00 -0.22 0.00 0.00 33.01 31.50 1rf5 s GLN 225 CO 0.54 0.14 0.81 0.21 -0.25 0.00 0.00 175.29 176.74 1rf5 s LYS 226 N -3.67 3.29 -0.26 2.91 2.20 -1.26 -2.60 119.74 120.36 1rf5 s LYS 226 Ca 0.20 -0.40 -0.09 0.00 -0.36 0.00 0.00 55.97 55.32 1rf5 s LYS 226 Cb 0.00 -4.04 -0.04 0.00 -1.51 0.00 0.00 37.83 32.25 1rf5 s LYS 226 CO 0.04 -1.32 0.12 0.08 -0.36 0.00 0.00 175.35 173.91 1rf5 s VAL 227 N 3.42 4.75 -0.45 4.02 1.01 0.63 -4.99 120.40 128.79 1rf5 s VAL 227 Ca 0.26 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 62.12 1rf5 s VAL 227 Cb -0.14 -3.23 0.10 0.00 0.00 0.00 0.00 36.38 33.10 1rf5 s VAL 227 CO 0.18 0.31 0.31 -0.69 0.00 0.00 0.00 175.10 175.21 1rf5 s VAL 228 N 1.57 4.24 -0.02 2.92 1.01 -1.26 -0.09 120.40 128.77 1rf5 s VAL 228 Ca 0.06 -1.58 -0.30 0.00 0.00 0.00 0.00 61.98 60.16 1rf5 s VAL 228 Cb -0.15 -3.70 -0.06 0.00 0.00 0.00 0.00 36.38 32.47 1rf5 s VAL 228 CO 0.06 -0.64 1.63 -0.69 0.00 0.00 0.00 175.10 175.46 1rf5 s VAL 229 N 1.40 3.48 0.61 2.92 1.01 -0.23 -4.97 120.40 124.61 1rf5 s VAL 229 Ca 0.04 0.70 -0.17 0.00 0.00 0.00 0.00 61.98 62.55 1rf5 s VAL 229 Cb -0.25 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 1rf5 s VAL 229 CO 0.01 -0.04 1.11 -2.84 0.00 0.00 0.00 175.10 173.34 1rf5 s PRO 230 N 3.57 3.03 0.80 2.72 0.02 -1.26 -4.76 135.00 139.12 1rf5 s PRO 230 Ca 0.73 1.45 -0.13 0.00 0.02 0.00 0.00 61.00 63.07 1rf5 s PRO 230 Cb -0.35 -1.98 0.20 0.00 0.02 0.00 0.00 34.50 32.40 1rf5 s PRO 230 CO 0.30 -1.08 0.65 0.41 -0.33 0.00 0.00 177.00 176.95 1rf5 n GLY 231 N -0.32 -2.94 3.59 0.52 0.00 -0.55 -1.39 105.19 104.11 1rf5 n GLY 231 Ca 0.11 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 1rf5 n GLY 231 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rf5 s ASP 232 N -3.18 6.28 0.47 1.61 3.68 0.50 -3.69 116.67 122.34 1rf5 s ASP 232 Ca 0.43 0.22 0.21 0.00 2.13 0.00 0.00 52.55 55.54 1rf5 s ASP 232 Cb -0.05 -2.23 1.16 0.00 -1.45 0.00 0.00 42.92 40.36 1rf5 s ASP 232 CO 0.34 -0.27 1.99 0.40 0.13 0.00 0.00 175.17 177.76 1rf5 h ILE 233 N 5.44 0.84 -0.68 4.11 5.03 -1.85 0.13 117.51 130.53 1rf5 h ILE 233 Ca -0.30 -0.74 -0.07 0.00 -0.12 0.00 0.00 64.86 63.62 1rf5 h ILE 233 Cb 1.15 1.44 -0.03 0.00 -3.03 0.00 0.00 36.82 36.35 1rf5 h ILE 233 CO 0.68 0.19 0.14 0.28 -0.68 0.00 0.00 178.15 178.76 1rf5 h SER 234 N 0.00 1.04 0.93 1.72 0.02 -1.93 0.18 113.55 115.51 1rf5 h SER 234 Ca -0.00 -0.23 -0.21 0.00 -0.84 0.00 0.00 61.79 60.51 1rf5 h SER 234 Cb 0.42 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 1rf5 h SER 234 CO 0.03 1.01 -0.98 0.28 -1.14 0.00 0.00 176.83 176.03 1rf5 h SER 235 N 1.03 0.03 1.38 3.07 0.02 -1.77 -3.29 113.55 114.02 1rf5 h SER 235 Ca 0.21 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1rf5 h SER 235 Cb 0.39 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1rf5 h SER 235 CO 0.01 0.99 -0.35 0.00 -1.14 0.00 0.00 176.83 176.34 1rf5 h ALA 236 N 1.01 0.83 -0.01 3.77 0.00 -0.57 -3.26 119.26 121.04 1rf5 h ALA 236 Ca -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1rf5 h ALA 236 Cb 1.71 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 1rf5 h ALA 236 CO 0.13 0.43 -0.07 0.00 0.00 0.00 0.00 179.25 179.74 1rf5 h ALA 237 N 1.65 1.86 -0.41 0.00 0.00 -0.71 0.14 119.26 121.80 1rf5 h ALA 237 Ca -0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1rf5 h ALA 237 Cb 1.13 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1rf5 h ALA 237 CO 0.04 0.10 -0.10 0.74 0.00 0.00 0.00 179.25 180.04 1rf5 h PHE 238 N 0.02 0.78 0.02 0.00 -1.00 -1.73 -2.00 116.94 113.03 1rf5 h PHE 238 Ca 0.00 -0.14 -0.25 0.00 2.81 0.00 0.00 57.97 60.40 1rf5 h PHE 238 Cb 0.13 -0.20 -0.03 0.00 3.61 0.00 0.00 35.95 39.46 1rf5 h PHE 238 CO 0.00 0.79 -1.32 -1.49 -1.61 0.00 0.00 178.31 174.68 1rf5 h TRP 239 N 0.66 0.09 -0.64 -0.55 -0.00 -1.50 -2.75 115.95 111.25 1rf5 h TRP 239 Ca 0.11 -0.07 -0.04 0.00 -0.00 0.00 0.00 58.89 58.90 1rf5 h TRP 239 Cb 0.56 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 29.69 1rf5 h TRP 239 CO 0.03 1.07 0.25 -0.07 -0.00 0.00 0.00 178.44 179.72 1rf5 h LEU 240 N 0.01 0.89 -0.10 -4.49 3.38 -0.67 -1.82 115.31 112.51 1rf5 h LEU 240 Ca -0.14 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 1rf5 h LEU 240 Cb 1.89 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.42 1rf5 h LEU 240 CO 0.12 0.83 -0.38 0.58 0.09 0.00 0.00 178.44 179.68 1rf5 h VAL 241 N 0.90 1.39 -0.66 1.22 2.07 -1.48 -3.23 116.25 116.46 1rf5 h VAL 241 Ca 0.21 -1.72 0.05 0.00 0.82 0.00 0.00 66.70 66.06 1rf5 h VAL 241 Cb 0.22 2.20 -0.04 0.00 -1.52 0.00 0.00 31.29 32.15 1rf5 h VAL 241 CO -0.02 0.51 0.44 0.00 0.02 0.00 0.00 177.57 178.52 1rf5 h ALA 242 N 0.47 1.71 -0.37 1.67 0.00 -1.41 0.54 119.26 121.87 1rf5 h ALA 242 Ca -0.02 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1rf5 h ALA 242 Cb 1.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1rf5 h ALA 242 CO 0.08 0.20 -0.17 0.78 0.00 0.00 0.00 179.25 180.14 1rf5 h GLY 243 N 0.72 0.74 1.82 0.00 0.00 -1.40 -0.47 103.07 104.48 1rf5 h GLY 243 Ca 0.28 -0.59 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 1rf5 h GLY 243 CO -0.08 0.54 -0.54 1.41 0.00 0.00 0.00 176.54 177.87 1rf5 h LEU 244 N 0.61 0.00 0.02 3.11 3.38 -1.34 -2.57 115.31 118.52 1rf5 h LEU 244 Ca 0.10 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.69 1rf5 h LEU 244 Cb 0.64 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 1rf5 h LEU 244 CO 0.04 0.37 -2.34 -0.38 0.09 0.00 0.00 178.44 176.23 1rf5 n ILE 245 N -3.13 1.51 -2.73 1.22 -0.00 0.10 -2.83 119.36 113.51 1rf5 n ILE 245 Ca 0.01 -0.67 -0.40 0.00 -0.00 0.00 0.00 62.75 61.69 1rf5 n ILE 245 Cb 0.69 -1.19 -0.06 0.00 -0.00 0.00 0.00 39.64 39.09 1rf5 n ILE 245 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1rf5 s ALA 246 N -2.52 3.34 0.54 -1.39 0.00 -0.20 -5.01 121.76 116.52 1rf5 s ALA 246 Ca -0.25 0.64 -0.20 0.00 0.00 0.00 0.00 51.96 52.15 1rf5 s ALA 246 Cb 0.08 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.92 1rf5 s ALA 246 CO 0.70 0.17 1.19 -1.25 0.00 0.00 0.00 175.76 176.57 1rf5 s PRO 247 N -1.17 3.31 -1.24 0.00 0.04 -1.26 -3.90 135.00 130.79 1rf5 s PRO 247 Ca 0.41 1.81 -0.19 0.00 0.04 0.00 0.00 61.00 63.07 1rf5 s PRO 247 Cb -0.26 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.16 1rf5 s PRO 247 CO 0.33 -0.93 0.64 0.09 0.04 0.00 0.00 177.00 177.17 1rf5 n ASN 248 N -1.13 -3.57 -4.09 6.66 3.02 -1.26 -3.78 115.26 111.11 1rf5 n ASN 248 Ca 0.11 -1.11 -0.22 0.00 -0.03 0.00 0.00 54.58 53.34 1rf5 n ASN 248 Cb 0.49 -2.75 -0.15 0.00 -0.61 0.00 0.00 39.78 36.76 1rf5 n ASN 248 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1rf5 s SER 249 N -3.73 1.53 -0.06 6.41 0.01 -1.25 -3.31 113.70 113.30 1rf5 s SER 249 Ca 0.35 -0.24 -0.02 0.00 1.31 0.00 0.00 55.95 57.35 1rf5 s SER 249 Cb -0.15 -0.20 0.03 0.00 0.21 0.00 0.00 66.02 65.91 1rf5 s SER 249 CO 0.91 0.15 0.07 -0.60 0.41 0.00 0.00 173.24 174.18 1rf5 s ARG 250 N -0.25 -0.06 -0.14 12.44 3.52 -0.48 -2.37 118.95 131.61 1rf5 s ARG 250 Ca 0.04 0.35 0.02 0.00 -0.13 0.00 0.00 55.73 56.01 1rf5 s ARG 250 Cb -0.06 -0.63 0.01 0.00 -1.56 0.00 0.00 34.95 32.72 1rf5 s ARG 250 CO -0.00 -0.36 -0.20 -0.51 -0.81 0.00 0.00 175.30 173.42 1rf5 s LEU 251 N 2.18 2.00 -0.21 -0.88 1.02 -0.80 -3.53 118.68 118.47 1rf5 s LEU 251 Ca 0.05 -0.57 -0.08 0.00 0.02 0.00 0.00 54.13 53.55 1rf5 s LEU 251 Cb -0.12 -1.36 -0.04 0.00 0.02 0.00 0.00 46.19 44.69 1rf5 s LEU 251 CO -0.04 0.05 0.09 -0.69 0.02 0.00 0.00 176.35 175.78 1rf5 s VAL 252 N 0.96 4.87 -0.23 -1.59 1.01 -0.88 -1.84 120.40 122.70 1rf5 s VAL 252 Ca -0.04 0.00 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1rf5 s VAL 252 Cb -0.15 -3.23 0.06 0.00 0.00 0.00 0.00 36.38 33.06 1rf5 s VAL 252 CO -0.04 0.42 -0.08 -0.76 0.00 0.00 0.00 175.10 174.64 1rf5 s LEU 253 N 0.70 2.72 0.12 3.92 1.43 -0.28 -1.44 118.68 125.86 1rf5 s LEU 253 Ca 0.05 -1.17 -0.08 0.00 -1.03 0.00 0.00 54.13 51.90 1rf5 s LEU 253 Cb -0.13 -1.29 -0.06 0.00 0.03 0.00 0.00 46.19 44.74 1rf5 s LEU 253 CO 0.02 -0.20 0.41 -1.10 0.23 0.00 0.00 176.35 175.71 1rf5 s GLN 254 N 1.32 3.72 -0.89 1.70 -0.21 -1.15 -0.87 119.66 123.28 1rf5 s GLN 254 Ca -0.06 0.10 -0.06 0.00 0.02 0.00 0.00 55.36 55.37 1rf5 s GLN 254 Cb -0.19 -2.90 -0.00 0.00 1.00 0.00 0.00 33.01 30.92 1rf5 s GLN 254 CO -0.06 0.50 0.70 -1.71 -2.12 0.00 0.00 175.29 172.59 1rf5 n ASN 255 N 0.50 -6.10 -0.09 5.90 5.15 -1.26 -4.53 115.26 114.83 1rf5 n ASN 255 Ca -0.05 -0.65 -0.15 0.00 -0.60 0.00 0.00 54.58 53.13 1rf5 n ASN 255 Cb 0.52 -3.54 -0.07 0.00 -0.53 0.00 0.00 39.78 36.17 1rf5 n ASN 255 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1rf5 n VAL 256 N -2.77 1.48 0.00 3.44 0.31 -1.11 -1.48 118.33 118.21 1rf5 n VAL 256 Ca -0.14 0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1rf5 n VAL 256 Cb 0.59 -2.19 0.00 0.00 -0.91 0.00 0.00 33.84 31.33 1rf5 n VAL 256 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1rf5 n GLY 257 N 1.49 2.09 2.65 2.92 0.00 -1.26 -2.45 105.19 110.63 1rf5 n GLY 257 Ca -0.23 -1.10 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 1rf5 n GLY 257 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1rf5 n ILE 258 N 1.65 2.32 -2.74 -0.61 -5.35 0.14 -4.74 119.36 110.03 1rf5 n ILE 258 Ca 0.00 -5.28 -0.41 0.00 -0.27 0.00 0.00 62.75 56.79 1rf5 n ILE 258 Cb 0.00 -1.57 -0.05 0.00 -1.74 0.00 0.00 39.64 36.28 1rf5 n ILE 258 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1rf5 s ASN 259 N -2.90 7.53 0.42 7.28 2.47 -1.26 -4.83 114.94 123.65 1rf5 s ASN 259 Ca 0.44 1.83 0.08 0.00 0.42 0.00 0.00 52.86 55.63 1rf5 s ASN 259 Cb 0.23 -2.59 0.91 0.00 -1.45 0.00 0.00 41.25 38.35 1rf5 s ASN 259 CO -0.09 0.00 2.06 1.05 -3.72 0.00 0.00 177.10 176.40 1rf5 h GLU 260 N 5.18 0.48 -0.08 0.43 9.09 -1.97 -0.06 114.58 127.65 1rf5 h GLU 260 Ca -0.43 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 58.95 1rf5 h GLU 260 Cb 1.21 -0.11 0.00 0.00 -1.65 0.00 0.00 28.75 28.20 1rf5 h GLU 260 CO 0.71 0.32 0.00 0.25 0.05 0.00 0.00 179.01 180.33 1rf5 n THR 261 N -4.48 0.10 0.00 -1.06 -2.24 -1.26 -3.92 114.28 101.42 1rf5 n THR 261 Ca 0.03 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1rf5 n THR 261 Cb 0.09 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1rf5 n THR 261 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1rf5 n ARG 262 N 0.09 3.84 -2.23 -0.78 5.12 -0.43 -4.34 116.66 117.93 1rf5 n ARG 262 Ca 0.18 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.68 1rf5 n ARG 262 Cb 0.30 -0.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.97 1rf5 n ARG 262 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1rf5 n THR 263 N -1.02 5.05 0.08 0.55 -2.24 -0.17 -4.61 114.28 111.92 1rf5 n THR 263 Ca 0.00 -4.61 -0.16 0.00 -2.27 0.00 0.00 64.05 57.00 1rf5 n THR 263 Cb 0.00 -2.12 -0.14 0.00 -2.10 0.00 0.00 70.33 65.97 1rf5 n THR 263 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1rf5 h GLY 264 N 6.16 0.29 1.03 3.38 0.00 -1.82 -3.36 103.07 108.75 1rf5 h GLY 264 Ca 0.55 -0.75 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 1rf5 h GLY 264 CO 1.49 0.65 0.05 0.16 0.00 0.00 0.00 176.54 178.89 1rf5 h ILE 265 N 0.07 1.26 -0.99 2.60 -0.00 -1.83 -2.96 117.51 115.66 1rf5 h ILE 265 Ca -0.20 -1.04 0.01 0.00 -0.00 0.00 0.00 64.86 63.63 1rf5 h ILE 265 Cb 2.00 0.85 -0.05 0.00 -0.00 0.00 0.00 36.82 39.62 1rf5 h ILE 265 CO 0.18 0.38 0.65 0.40 -0.00 0.00 0.00 178.15 179.75 1rf5 h ILE 266 N 0.83 1.26 -0.21 0.16 2.04 -1.94 0.21 117.51 119.86 1rf5 h ILE 266 Ca 0.16 -0.47 -0.09 0.00 1.00 0.00 0.00 64.86 65.46 1rf5 h ILE 266 Cb 0.47 -0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.34 1rf5 h ILE 266 CO 0.02 0.25 -0.25 0.44 0.00 0.00 0.00 178.15 178.61 1rf5 h ASP 267 N 1.35 0.39 -0.04 1.72 3.32 -1.69 -1.73 116.42 119.74 1rf5 h ASP 267 Ca 0.36 -0.13 -0.13 0.00 0.02 0.00 0.00 57.03 57.16 1rf5 h ASP 267 Cb -0.15 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.30 1rf5 h ASP 267 CO -0.08 0.65 -0.47 0.58 -1.72 0.00 0.00 179.24 178.20 1rf5 h VAL 268 N 0.35 1.43 -0.74 -1.35 2.07 -1.16 -2.80 116.25 114.05 1rf5 h VAL 268 Ca 0.05 -1.93 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 1rf5 h VAL 268 Cb 0.63 2.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.84 1rf5 h VAL 268 CO 0.05 0.56 0.44 0.40 0.02 0.00 0.00 177.57 179.04 1rf5 h ILE 269 N -0.12 1.21 -0.58 4.57 2.04 -0.57 -0.50 117.51 123.57 1rf5 h ILE 269 Ca -0.05 -0.48 -0.08 0.00 1.00 0.00 0.00 64.86 65.25 1rf5 h ILE 269 Cb 1.16 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1rf5 h ILE 269 CO 0.09 0.22 0.04 -0.09 0.00 0.00 0.00 178.15 178.42 1rf5 h ARG 270 N 1.02 0.97 0.00 2.37 9.65 -1.40 -0.71 114.38 126.28 1rf5 h ARG 270 Ca 0.27 -0.27 -0.09 0.00 -1.10 0.00 0.00 59.98 58.78 1rf5 h ARG 270 Cb -0.02 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.43 1rf5 h ARG 270 CO -0.05 0.94 -0.43 0.00 2.80 0.00 0.00 179.97 183.22 1rf5 h ALA 271 N 1.13 0.89 0.00 2.80 0.00 -1.20 -3.06 119.26 119.83 1rf5 h ALA 271 Ca 0.17 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1rf5 h ALA 271 Cb 0.47 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1rf5 h ALA 271 CO 0.02 0.54 -0.34 0.52 0.00 0.00 0.00 179.25 179.99 1rf5 h MET 272 N 0.00 0.00 0.00 0.00 2.86 -0.87 -3.46 114.93 113.47 1rf5 h MET 272 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1rf5 h MET 272 Cb 1.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.70 1rf5 h MET 272 CO 0.06 0.34 0.00 0.41 1.06 0.00 0.00 176.91 178.78 1rf5 n GLY 273 N 1.07 1.38 3.78 8.32 0.00 -0.87 -0.97 105.19 117.89 1rf5 n GLY 273 Ca 0.02 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1rf5 n GLY 273 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rf5 s GLY 274 N -2.04 2.91 -0.70 -0.02 0.00 -0.33 -4.75 107.32 102.39 1rf5 s GLY 274 Ca 0.00 0.45 -0.27 0.00 0.00 0.00 0.00 44.72 44.90 1rf5 s GLY 274 CO 0.00 0.94 1.50 0.54 0.00 0.00 0.00 173.10 176.08 1rf5 s LYS 275 N -1.48 2.99 -0.20 2.90 1.02 -1.26 -4.64 119.74 119.07 1rf5 s LYS 275 Ca 0.42 0.04 0.01 0.00 0.02 0.00 0.00 55.97 56.45 1rf5 s LYS 275 Cb -0.22 -4.30 0.04 0.00 -0.52 0.00 0.00 37.83 32.83 1rf5 s LYS 275 CO 0.27 -2.38 -0.10 -1.17 -0.92 0.00 0.00 175.35 171.05 1rf5 s LEU 276 N 6.99 2.23 -0.02 3.17 2.96 -1.26 -2.55 118.68 130.19 1rf5 s LEU 276 Ca 0.47 -0.88 -0.10 0.00 -0.22 0.00 0.00 54.13 53.41 1rf5 s LEU 276 Cb -0.09 -1.20 -0.05 0.00 0.50 0.00 0.00 46.19 45.34 1rf5 s LEU 276 CO 0.16 -0.15 0.29 -1.61 -1.32 0.00 0.00 176.35 173.72 1rf5 s GLU 277 N 1.42 3.67 -0.14 1.98 2.02 0.33 -4.95 118.70 123.03 1rf5 s GLU 277 Ca -0.01 0.10 -0.00 0.00 0.02 0.00 0.00 54.97 55.08 1rf5 s GLU 277 Cb -0.16 -3.15 0.03 0.00 0.10 0.00 0.00 34.13 30.95 1rf5 s GLU 277 CO -0.08 0.69 -0.10 -1.50 0.02 0.00 0.00 175.26 174.30 1rf5 s ILE 278 N -1.16 1.29 0.18 -1.63 2.07 -1.26 -1.58 121.20 119.11 1rf5 s ILE 278 Ca 0.23 -0.55 0.01 0.00 -1.41 0.00 0.00 60.65 58.94 1rf5 s ILE 278 Cb -0.14 -1.31 -0.05 0.00 0.13 0.00 0.00 42.46 41.10 1rf5 s ILE 278 CO 0.12 0.33 0.03 0.42 -1.91 0.00 0.00 174.94 173.93 1rf5 s THR 279 N 1.59 0.57 -1.02 4.00 -4.23 -0.45 -4.96 115.64 111.14 1rf5 s THR 279 Ca 0.03 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.46 1rf5 s THR 279 Cb -0.14 -2.20 -0.03 0.00 1.34 0.00 0.00 72.50 71.47 1rf5 s THR 279 CO -0.09 -0.39 0.81 -0.62 -0.54 0.00 0.00 174.62 173.80 1rf5 n GLU 280 N -0.26 -1.61 -2.94 3.99 4.71 -1.26 0.16 120.64 123.42 1rf5 n GLU 280 Ca -0.05 0.80 -0.41 0.00 -0.01 0.00 0.00 57.16 57.48 1rf5 n GLU 280 Cb 0.64 -4.87 -0.05 0.00 -1.01 0.00 0.00 31.44 26.15 1rf5 n GLU 280 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1rf5 s ILE 281 N -3.32 4.87 -0.45 -3.67 1.01 -1.26 -3.94 121.20 114.43 1rf5 s ILE 281 Ca 0.36 1.44 -0.15 0.00 0.00 0.00 0.00 60.65 62.29 1rf5 s ILE 281 Cb -0.09 -4.08 0.05 0.00 0.01 0.00 0.00 42.46 38.35 1rf5 s ILE 281 CO 0.80 -0.06 0.36 -0.62 0.00 0.00 0.00 174.94 175.42 1rf5 s ASP 282 N 1.39 6.13 0.44 3.58 3.68 0.44 -4.97 116.67 127.38 1rf5 s ASP 282 Ca 0.33 -1.14 0.24 0.00 2.13 0.00 0.00 52.55 54.11 1rf5 s ASP 282 Cb -0.15 -2.18 0.86 0.00 -1.45 0.00 0.00 42.92 40.00 1rf5 s ASP 282 CO 0.08 -0.57 1.79 1.55 0.13 0.00 0.00 175.17 178.15 1rf5 h PRO 283 N 8.71 0.00 0.01 4.34 0.13 -1.96 0.17 132.00 143.40 1rf5 h PRO 283 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1rf5 h PRO 283 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1rf5 h PRO 283 CO 0.82 0.20 -0.01 0.28 -0.23 0.00 0.00 178.00 179.06 1rf5 h VAL 284 N 0.00 1.54 -0.01 1.56 2.07 -1.97 -3.31 116.25 116.13 1rf5 h VAL 284 Ca -0.00 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.59 1rf5 h VAL 284 Cb 0.79 2.79 0.00 0.00 -1.52 0.00 0.00 31.29 33.36 1rf5 h VAL 284 CO 0.03 0.48 -0.12 0.00 0.02 0.00 0.00 177.57 177.98 1rf5 n ALA 285 N -2.56 2.81 -3.77 1.67 0.00 -1.23 -4.90 120.51 112.52 1rf5 n ALA 285 Ca -0.09 -0.37 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 1rf5 n ALA 285 Cb 0.39 -1.22 0.03 0.00 0.00 0.00 0.00 19.45 18.65 1rf5 n ALA 285 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1rf5 n LYS 286 N -0.47 -0.97 -4.05 0.00 0.00 0.54 -4.81 118.16 108.40 1rf5 n LYS 286 Ca 0.16 0.45 -0.14 0.00 -0.00 0.00 0.00 58.31 58.79 1rf5 n LYS 286 Cb 0.32 -3.48 -0.13 0.00 -0.00 0.00 0.00 35.03 31.74 1rf5 n LYS 286 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1rf5 s SER 287 N -3.38 0.47 0.06 -5.58 1.04 -0.86 0.26 113.70 105.71 1rf5 s SER 287 Ca 0.38 -0.20 -0.12 0.00 0.48 0.00 0.00 55.95 56.49 1rf5 s SER 287 Cb -0.16 -0.01 0.01 0.00 0.10 0.00 0.00 66.02 65.95 1rf5 s SER 287 CO 0.89 -0.04 0.27 0.00 0.98 0.00 0.00 173.24 175.34 1rf5 s ALA 288 N -0.47 -0.55 -0.13 5.32 0.00 -1.26 -0.42 121.76 124.26 1rf5 s ALA 288 Ca -0.03 -0.19 -0.27 0.00 0.00 0.00 0.00 51.96 51.47 1rf5 s ALA 288 Cb -0.04 0.38 -0.02 0.00 0.00 0.00 0.00 23.12 23.45 1rf5 s ALA 288 CO -0.00 -0.45 0.91 0.99 0.00 0.00 0.00 175.76 177.22 1rf5 s THR 289 N -2.95 4.84 -0.16 0.00 2.01 0.12 -2.74 115.64 116.77 1rf5 s THR 289 Ca -0.02 1.84 0.00 0.00 0.31 0.00 0.00 61.69 63.81 1rf5 s THR 289 Cb 0.01 -4.22 -0.00 0.00 0.01 0.00 0.00 72.50 68.29 1rf5 s THR 289 CO -0.06 0.03 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.00 1rf5 s LEU 290 N 1.96 2.49 -0.10 4.42 1.43 -0.05 -1.34 118.68 127.48 1rf5 s LEU 290 Ca 0.44 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 53.10 1rf5 s LEU 290 Cb -0.18 -1.57 -0.00 0.00 0.03 0.00 0.00 46.19 44.47 1rf5 s LEU 290 CO 0.16 0.08 -0.23 -0.63 0.23 0.00 0.00 176.35 175.96 1rf5 s ILE 291 N 0.85 2.17 0.08 -0.59 1.01 -0.62 -1.13 121.20 122.98 1rf5 s ILE 291 Ca -0.05 -0.99 0.09 0.00 0.00 0.00 0.00 60.65 59.71 1rf5 s ILE 291 Cb -0.15 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 1rf5 s ILE 291 CO -0.01 0.56 -0.23 0.68 0.00 0.00 0.00 174.94 175.94 1rf5 s VAL 292 N 0.29 2.47 0.16 2.92 -7.23 -0.77 -0.51 120.40 117.73 1rf5 s VAL 292 Ca -0.17 -1.48 0.06 0.00 -1.81 0.00 0.00 61.98 58.59 1rf5 s VAL 292 Cb -0.17 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.67 1rf5 s VAL 292 CO 0.08 0.22 -0.13 -1.61 -0.31 0.00 0.00 175.10 173.35 1rf5 s GLU 293 N -1.71 1.14 -0.15 4.82 2.02 -1.06 -1.91 118.70 121.85 1rf5 s GLU 293 Ca 0.14 -1.42 -0.29 0.00 0.02 0.00 0.00 54.97 53.42 1rf5 s GLU 293 Cb -0.10 -0.90 -0.06 0.00 0.10 0.00 0.00 34.13 33.17 1rf5 s GLU 293 CO 0.06 0.15 2.04 -1.12 0.02 0.00 0.00 175.26 176.40 1rf5 s SER 294 N -2.95 5.89 0.08 -0.19 0.01 -0.97 -3.87 113.70 111.70 1rf5 s SER 294 Ca 0.16 2.04 0.03 0.00 1.31 0.00 0.00 55.95 59.49 1rf5 s SER 294 Cb -0.01 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 1rf5 s SER 294 CO 0.04 -1.59 -0.09 -0.44 0.41 0.00 0.00 173.24 171.56 1rf5 s SER 295 N 6.51 1.27 -0.20 2.44 0.01 -1.13 -4.98 113.70 117.61 1rf5 s SER 295 Ca 0.92 -0.74 -0.21 0.00 1.31 0.00 0.00 55.95 57.22 1rf5 s SER 295 Cb -0.34 0.02 -0.02 0.00 0.21 0.00 0.00 66.02 65.89 1rf5 s SER 295 CO 0.36 -0.25 0.66 -1.81 0.41 0.00 0.00 173.24 172.61 1rf5 s ASP 296 N -2.19 6.71 0.23 2.44 1.01 -1.26 -4.82 116.67 118.78 1rf5 s ASP 296 Ca 0.01 0.87 0.07 0.00 0.71 0.00 0.00 52.55 54.21 1rf5 s ASP 296 Cb -0.05 -2.36 -0.04 0.00 1.01 0.00 0.00 42.92 41.48 1rf5 s ASP 296 CO -0.00 -0.31 0.10 -0.76 0.21 0.00 0.00 175.17 174.41 1rf5 s LEU 297 N 2.07 3.57 0.22 1.23 1.43 -1.26 -4.70 118.68 121.23 1rf5 s LEU 297 Ca 0.30 -0.35 0.11 0.00 -1.03 0.00 0.00 54.13 53.16 1rf5 s LEU 297 Cb -0.16 -2.14 -0.05 0.00 0.03 0.00 0.00 46.19 43.88 1rf5 s LEU 297 CO 0.10 0.01 -0.23 -0.54 0.23 0.00 0.00 176.35 175.93 1rf5 s LYS 298 N -3.51 1.55 0.00 1.70 -0.14 -0.14 -1.27 119.74 117.94 1rf5 s LYS 298 Ca 0.31 -1.59 0.00 0.00 -1.36 0.00 0.00 55.97 53.33 1rf5 s LYS 298 Cb -0.08 -1.80 0.00 0.00 -1.68 0.00 0.00 37.83 34.26 1rf5 s LYS 298 CO 0.22 0.37 0.46 0.41 -0.76 0.00 0.00 175.35 176.06 1rf5 n GLY 299 N 0.02 -2.94 0.47 -3.33 0.00 -0.83 -4.55 105.19 94.02 1rf5 n GLY 299 Ca -0.10 0.62 0.01 0.00 0.00 0.00 0.00 46.02 46.55 1rf5 n GLY 299 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1rf5 n THR 300 N -1.15 -0.76 -4.55 2.61 5.66 -1.25 -4.44 114.28 110.40 1rf5 n THR 300 Ca 0.00 0.41 -0.33 0.00 -3.05 0.00 0.00 64.05 61.08 1rf5 n THR 300 Cb 0.00 -0.68 -0.13 0.00 -1.55 0.00 0.00 70.33 67.97 1rf5 n THR 300 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 1rf5 s GLU 301 N -4.22 3.54 -0.28 1.09 2.12 -1.26 -3.33 118.70 116.36 1rf5 s GLU 301 Ca 0.00 -0.60 0.02 0.00 0.36 0.00 0.00 54.97 54.76 1rf5 s GLU 301 Cb 0.00 -2.79 0.07 0.00 0.26 0.00 0.00 34.13 31.66 1rf5 s GLU 301 CO 0.00 0.22 -0.06 0.42 -0.54 0.00 0.00 175.26 175.30 1rf5 s ILE 302 N 0.38 2.36 0.25 -3.70 1.01 -0.50 -5.00 121.20 116.00 1rf5 s ILE 302 Ca -0.07 -1.72 -0.20 0.00 0.00 0.00 0.00 60.65 58.66 1rf5 s ILE 302 Cb -0.15 -2.44 0.03 0.00 0.01 0.00 0.00 42.46 39.90 1rf5 s ILE 302 CO 0.04 -0.15 0.65 0.00 0.00 0.00 0.00 174.94 175.49 1rf5 n GLY 304 N -0.43 0.47 0.00 0.00 0.00 -1.26 -3.65 105.19 100.33 1rf5 n GLY 304 Ca -0.06 -0.96 0.11 0.00 0.00 0.00 0.00 46.02 45.10 1rf5 n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf5 n ALA 305 N 7.41 2.09 0.15 4.61 0.00 -1.26 -2.97 120.51 130.54 1rf5 n ALA 305 Ca 0.00 -0.10 0.01 0.00 0.00 0.00 0.00 53.44 53.35 1rf5 n ALA 305 Cb 0.00 -1.35 0.19 0.00 0.00 0.00 0.00 19.45 18.29 1rf5 n ALA 305 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1rf5 h LEU 306 N 0.00 0.00 0.66 0.00 5.85 -1.99 -3.37 115.31 116.46 1rf5 h LEU 306 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1rf5 h LEU 306 Cb 0.25 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.29 1rf5 h LEU 306 CO 0.00 0.56 -0.32 0.40 -0.34 0.00 0.00 178.44 178.74 1rf5 h ILE 307 N 0.00 0.34 0.00 4.05 1.08 -1.77 -2.93 117.51 118.28 1rf5 h ILE 307 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 1rf5 h ILE 307 Cb 1.11 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 35.20 1rf5 h ILE 307 CO 0.07 0.00 0.00 -2.65 -0.69 0.00 0.00 178.15 174.88 1rf5 n PRO 308 N -5.48 0.03 0.00 2.37 -0.02 -1.26 -0.87 135.00 129.77 1rf5 n PRO 308 Ca -0.13 0.32 0.11 0.00 -2.02 0.00 0.00 63.50 61.78 1rf5 n PRO 308 Cb 0.36 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.44 1rf5 n PRO 308 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1rf5 n ARG 309 N -1.36 0.13 -0.36 -0.52 1.74 -1.11 -4.45 116.66 110.73 1rf5 n ARG 309 Ca 0.01 -0.09 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1rf5 n ARG 309 Cb 0.03 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1rf5 n ARG 309 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1rf5 n LEU 310 N -1.35 0.08 -0.15 0.55 -0.00 -0.05 -2.66 117.00 113.42 1rf5 n LEU 310 Ca 0.06 -0.82 0.06 0.00 -0.00 0.00 0.00 56.01 55.31 1rf5 n LEU 310 Cb 0.34 -0.01 0.37 0.00 -0.00 0.00 0.00 43.42 44.12 1rf5 n LEU 310 CO 0.37 0.20 1.21 0.16 -0.00 0.00 0.00 177.39 179.33 1rf5 h ILE 311 N 5.79 1.03 0.00 1.47 3.07 -1.65 -0.14 117.51 127.07 1rf5 h ILE 311 Ca 0.00 -0.24 -0.03 0.00 1.55 0.00 0.00 64.86 66.13 1rf5 h ILE 311 Cb 1.29 0.26 -0.00 0.00 -0.27 0.00 0.00 36.82 38.09 1rf5 h ILE 311 CO 0.00 0.13 -0.17 0.44 -1.05 0.00 0.00 178.15 177.50 1rf5 h ASP 312 N 0.70 0.00 -0.23 2.16 3.45 -1.90 -3.26 116.42 117.34 1rf5 h ASP 312 Ca 0.29 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.75 1rf5 h ASP 312 Cb 0.23 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.00 1rf5 h ASP 312 CO -0.09 0.17 0.00 -0.62 -1.57 0.00 0.00 179.24 177.13 1rf5 n GLU 313 N -3.18 2.11 -0.23 3.56 4.71 -0.11 -4.53 120.64 122.97 1rf5 n GLU 313 Ca 0.02 -1.66 -0.03 0.00 -0.01 0.00 0.00 57.16 55.48 1rf5 n GLU 313 Cb 0.53 -1.46 0.08 0.00 -1.01 0.00 0.00 31.44 29.59 1rf5 n GLU 313 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 1rf5 h LEU 314 N 3.42 0.63 -1.32 -4.62 3.38 -1.48 -0.03 115.31 115.28 1rf5 h LEU 314 Ca 0.00 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1rf5 h LEU 314 Cb 0.75 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 1rf5 h LEU 314 CO 0.00 0.43 0.46 -0.65 0.09 0.00 0.00 178.44 178.77 1rf5 h PRO 315 N 0.76 0.91 0.11 1.13 0.11 -1.87 -1.50 132.00 131.65 1rf5 h PRO 315 Ca 0.28 -0.05 -0.27 0.00 0.11 0.00 0.00 66.00 66.07 1rf5 h PRO 315 Cb 0.08 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 30.99 1rf5 h PRO 315 CO -0.13 0.60 -1.19 0.82 -0.21 0.00 0.00 178.00 177.88 1rf5 h ILE 316 N 0.94 1.50 -0.27 4.15 5.03 -1.74 -3.17 117.51 123.95 1rf5 h ILE 316 Ca 0.26 -3.00 -0.10 0.00 -0.12 0.00 0.00 64.86 61.89 1rf5 h ILE 316 Cb -0.10 2.88 -0.01 0.00 -3.03 0.00 0.00 36.82 36.55 1rf5 h ILE 316 CO -0.06 0.88 -0.27 0.40 -0.68 0.00 0.00 178.15 178.42 1rf5 h ILE 317 N 0.09 1.27 -0.42 -0.67 2.04 -0.91 -1.87 117.51 117.04 1rf5 h ILE 317 Ca -0.12 -1.33 0.03 0.00 1.00 0.00 0.00 64.86 64.44 1rf5 h ILE 317 Cb 1.91 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 39.32 1rf5 h ILE 317 CO 0.20 0.42 0.22 0.00 0.00 0.00 0.00 178.15 178.99 1rf5 h ALA 318 N 1.24 0.52 -0.03 1.87 0.00 -1.28 0.16 119.26 121.74 1rf5 h ALA 318 Ca 0.06 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 1rf5 h ALA 318 Cb 0.71 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1rf5 h ALA 318 CO 0.05 -0.13 -0.59 1.25 0.00 0.00 0.00 179.25 179.84 1rf5 h LEU 319 N 0.45 0.11 -1.32 0.00 5.85 -1.51 -2.56 115.31 116.32 1rf5 h LEU 319 Ca 0.17 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 1rf5 h LEU 319 Cb 0.06 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1rf5 h LEU 319 CO -0.11 0.68 -0.34 0.25 -0.34 0.00 0.00 178.44 178.58 1rf5 h LEU 320 N 0.07 0.00 0.00 2.25 5.85 -0.78 -3.00 115.31 119.70 1rf5 h LEU 320 Ca -0.01 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1rf5 h LEU 320 Cb 1.06 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 1rf5 h LEU 320 CO 0.08 0.34 -0.31 0.00 -0.34 0.00 0.00 178.44 178.21 1rf5 h ALA 321 N 1.66 0.83 0.00 1.25 0.00 -0.34 -3.29 119.26 119.37 1rf5 h ALA 321 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1rf5 h ALA 321 Cb 0.60 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1rf5 h ALA 321 CO 0.04 0.25 0.00 0.25 0.00 0.00 0.00 179.25 179.80 1rf5 n THR 322 N -3.10 0.71 0.41 0.00 -2.24 -1.00 -2.77 114.28 106.29 1rf5 n THR 322 Ca 0.02 0.17 0.04 0.00 -2.27 0.00 0.00 64.05 62.02 1rf5 n THR 322 Cb 0.62 -0.86 -0.01 0.00 -2.10 0.00 0.00 70.33 67.97 1rf5 n THR 322 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rf5 n GLN 323 N -1.55 2.60 -3.04 -0.78 1.13 -1.24 -0.03 117.38 114.47 1rf5 n GLN 323 Ca 0.04 -0.44 -0.40 0.00 -1.94 0.00 0.00 57.00 54.26 1rf5 n GLN 323 Cb 0.22 -1.02 -0.05 0.00 0.11 0.00 0.00 30.24 29.50 1rf5 n GLN 323 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1rf5 s ALA 324 N -1.41 3.49 0.03 -1.58 0.00 -1.11 -3.84 121.76 117.35 1rf5 s ALA 324 Ca 0.07 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 51.63 1rf5 s ALA 324 Cb 0.07 -3.04 -0.07 0.00 0.00 0.00 0.00 23.12 20.08 1rf5 s ALA 324 CO 0.26 -0.48 1.57 1.14 0.00 0.00 0.00 175.76 178.25 1rf5 s GLN 325 N 1.73 4.22 0.00 0.00 -2.07 -0.39 -3.14 119.66 120.00 1rf5 s GLN 325 Ca 0.33 2.20 0.00 0.00 -1.82 0.00 0.00 55.36 56.07 1rf5 s GLN 325 Cb -0.16 -3.63 0.00 0.00 -1.09 0.00 0.00 33.01 28.13 1rf5 s GLN 325 CO 0.12 -0.69 0.00 0.41 -1.32 0.00 0.00 175.29 173.81 1rf5 n GLY 326 N 3.89 0.29 3.25 2.60 0.00 -1.26 -1.97 105.19 111.98 1rf5 n GLY 326 Ca 0.15 -2.18 -0.32 0.00 0.00 0.00 0.00 46.02 43.66 1rf5 n GLY 326 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rf5 s VAL 327 N 0.00 2.31 -0.21 1.61 1.01 -1.26 -1.84 120.40 122.02 1rf5 s VAL 327 Ca 0.00 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 61.01 1rf5 s VAL 327 Cb 0.00 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 1rf5 s VAL 327 CO 0.00 0.55 0.01 -0.89 0.00 0.00 0.00 175.10 174.77 1rf5 s THR 328 N 0.46 4.05 -0.18 3.92 2.01 0.89 -3.75 115.64 123.05 1rf5 s THR 328 Ca -0.14 -0.28 -0.00 0.00 0.31 0.00 0.00 61.69 61.58 1rf5 s THR 328 Cb -0.17 -2.84 0.00 0.00 0.01 0.00 0.00 72.50 69.50 1rf5 s THR 328 CO 0.06 0.41 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.56 1rf5 s VAL 329 N 1.08 2.57 -0.22 3.82 1.01 -1.21 -0.40 120.40 127.05 1rf5 s VAL 329 Ca 0.03 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 1rf5 s VAL 329 Cb -0.14 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1rf5 s VAL 329 CO 0.02 0.51 0.05 -0.63 0.00 0.00 0.00 175.10 175.05 1rf5 s ILE 330 N 1.10 4.33 0.20 2.22 1.01 -0.65 -1.41 121.20 127.99 1rf5 s ILE 330 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 60.65 60.54 1rf5 s ILE 330 Cb -0.14 -2.99 -0.05 0.00 0.01 0.00 0.00 42.46 39.29 1rf5 s ILE 330 CO -0.05 0.39 -0.13 -0.54 0.00 0.00 0.00 174.94 174.61 1rf5 s LYS 331 N 1.18 1.29 -1.20 2.79 1.02 -0.71 -2.82 119.74 121.30 1rf5 s LYS 331 Ca 0.04 -1.58 -0.01 0.00 0.02 0.00 0.00 55.97 54.44 1rf5 s LYS 331 Cb -0.14 -1.01 -0.01 0.00 -0.52 0.00 0.00 37.83 36.14 1rf5 s LYS 331 CO 0.03 0.15 0.92 -0.25 -0.92 0.00 0.00 175.35 175.27 1rf5 n ASP 332 N -0.36 -2.62 -3.63 2.83 9.92 -0.82 -4.36 116.55 117.52 1rf5 n ASP 332 Ca -0.08 -0.69 -0.21 0.00 -0.53 0.00 0.00 54.79 53.28 1rf5 n ASP 332 Cb 0.61 -4.86 -0.17 0.00 -0.64 0.00 0.00 41.12 36.06 1rf5 n ASP 332 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1rf5 s ALA 333 N -3.43 0.15 0.00 2.24 0.00 0.72 -4.84 121.76 116.59 1rf5 s ALA 333 Ca 0.08 0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.16 1rf5 s ALA 333 Cb -0.01 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.23 1rf5 s ALA 333 CO 0.75 -0.81 0.00 0.39 0.00 0.00 0.00 175.76 176.09 1rf5 n GLU 334 N 5.30 0.00 0.00 0.00 4.71 -1.26 -3.64 120.64 125.75 1rf5 n GLU 334 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.10 1rf5 n GLU 334 Cb 0.50 -0.90 0.00 0.00 -1.01 0.00 0.00 31.44 30.02 1rf5 n GLU 334 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1rf5 n GLU 335 N -2.45 0.00 0.00 3.49 1.02 -1.26 -4.68 120.64 116.76 1rf5 n GLU 335 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1rf5 n GLU 335 Cb 0.45 -0.14 0.00 0.00 -0.02 0.00 0.00 31.44 31.73 1rf5 n GLU 335 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1rf5 n LEU 336 N 0.00 0.00 -4.27 -4.62 4.32 -1.26 -2.83 117.00 108.34 1rf5 n LEU 336 Ca 0.00 0.00 -0.44 0.00 -0.02 0.00 0.00 56.01 55.55 1rf5 n LEU 336 Cb 0.00 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.74 1rf5 n LEU 336 CO 0.00 0.00 0.15 -0.75 -1.22 0.00 0.00 177.39 175.57 1rf5 s LYS 337 N 0.00 2.94 4.42 3.23 2.47 -0.63 -4.88 119.74 127.29 1rf5 s LYS 337 Ca 0.00 -1.96 0.00 0.00 -1.56 0.00 0.00 55.97 52.45 1rf5 s LYS 337 Cb 0.00 -4.17 0.00 0.00 -1.46 0.00 0.00 37.83 32.20 1rf5 s LYS 337 CO 0.00 -1.27 0.00 0.28 0.16 0.00 0.00 175.35 174.52 1rf5 n VAL 338 N 4.72 0.00 -0.06 4.02 0.31 -1.26 -1.49 118.33 124.57 1rf5 n VAL 338 Ca -0.04 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.21 1rf5 n VAL 338 Cb 0.42 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.27 1rf5 n VAL 338 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1rf5 n LYS 339 N 0.00 1.04 -2.75 5.55 5.02 -1.26 -4.69 118.16 121.07 1rf5 n LYS 339 Ca 0.00 0.05 -0.34 0.00 -2.02 0.00 0.00 58.31 56.00 1rf5 n LYS 339 Cb 0.00 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.67 1rf5 n LYS 339 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1rf5 s GLU 340 N -2.27 4.23 0.00 1.97 0.41 -0.56 -4.44 118.70 118.04 1rf5 s GLU 340 Ca -0.14 1.23 0.00 0.00 -0.41 0.00 0.00 54.97 55.65 1rf5 s GLU 340 Cb 0.04 -2.31 0.00 0.00 -1.78 0.00 0.00 34.13 30.08 1rf5 s GLU 340 CO 0.36 -0.04 0.00 0.25 -0.49 0.00 0.00 175.26 175.34 1rf5 n THR 341 N -0.42 0.00 0.08 3.63 -2.24 -1.13 -1.61 114.28 112.59 1rf5 n THR 341 Ca 0.06 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 1rf5 n THR 341 Cb 0.53 -0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.52 1rf5 n THR 341 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1rf5 h ASP 342 N 0.00 0.05 -0.08 3.42 3.45 -1.86 -3.27 116.42 118.14 1rf5 h ASP 342 Ca 0.00 -0.05 -0.22 0.00 0.43 0.00 0.00 57.03 57.19 1rf5 h ASP 342 Cb 0.00 -0.02 0.01 0.00 -0.56 0.00 0.00 39.33 38.76 1rf5 h ASP 342 CO 0.00 0.96 -0.77 -0.09 -1.57 0.00 0.00 179.24 177.76 1rf5 h ARG 343 N 0.01 0.73 0.00 3.56 2.43 -1.91 -2.91 114.38 116.29 1rf5 h ARG 343 Ca -0.02 -0.60 0.00 0.00 -0.81 0.00 0.00 59.98 58.55 1rf5 h ARG 343 Cb 1.64 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 31.32 1rf5 h ARG 343 CO 0.13 1.21 0.00 -0.84 -1.51 0.00 0.00 179.97 178.96 1rf5 h ILE 344 N 0.50 0.00 0.13 1.20 3.07 -1.97 -2.41 117.51 118.03 1rf5 h ILE 344 Ca -0.05 -0.48 -0.23 0.00 1.55 0.00 0.00 64.86 65.65 1rf5 h ILE 344 Cb 1.40 1.39 0.01 0.00 -0.27 0.00 0.00 36.82 39.35 1rf5 h ILE 344 CO 0.16 0.00 -1.08 -0.61 -1.05 0.00 0.00 178.15 175.57 1rf5 h GLN 345 N 0.00 0.28 0.00 0.16 5.75 -1.60 -3.08 115.11 116.62 1rf5 h GLN 345 Ca 0.00 -0.47 -0.07 0.00 -0.15 0.00 0.00 58.65 57.95 1rf5 h GLN 345 Cb 0.56 0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.28 1rf5 h GLN 345 CO 0.00 1.23 -0.36 -0.39 -2.65 0.00 0.00 178.83 176.66 1rf5 h VAL 346 N -0.35 0.79 -0.10 2.39 -1.51 -1.48 -1.01 116.25 114.98 1rf5 h VAL 346 Ca -0.21 -1.54 -0.21 0.00 -1.23 0.00 0.00 66.70 63.51 1rf5 h VAL 346 Cb 1.69 1.97 0.01 0.00 -2.13 0.00 0.00 31.29 32.84 1rf5 h VAL 346 CO 0.11 0.35 -0.77 0.58 -1.23 0.00 0.00 177.57 176.61 1rf5 h VAL 347 N 0.00 1.30 -0.65 7.19 2.07 -1.58 -2.30 116.25 122.28 1rf5 h VAL 347 Ca -0.00 -2.01 -0.08 0.00 0.82 0.00 0.00 66.70 65.43 1rf5 h VAL 347 Cb 0.95 2.14 -0.03 0.00 -1.52 0.00 0.00 31.29 32.83 1rf5 h VAL 347 CO 0.05 0.62 0.10 0.00 0.02 0.00 0.00 177.57 178.36 1rf5 h ALA 348 N 0.49 0.87 -0.37 1.67 0.00 -1.43 -1.96 119.26 118.53 1rf5 h ALA 348 Ca -0.07 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 1rf5 h ALA 348 Cb 1.42 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1rf5 h ALA 348 CO 0.16 0.63 -0.13 -0.44 0.00 0.00 0.00 179.25 179.48 1rf5 h ASP 349 N 1.00 0.64 0.36 0.00 3.32 -1.21 -0.63 116.42 119.90 1rf5 h ASP 349 Ca 0.20 -0.18 -0.21 0.00 0.02 0.00 0.00 57.03 56.85 1rf5 h ASP 349 Cb 0.44 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1rf5 h ASP 349 CO 0.01 0.79 -0.89 0.00 -1.72 0.00 0.00 179.24 177.43 1rf5 h ALA 350 N 1.27 0.43 0.10 3.45 0.00 -1.29 -3.11 119.26 120.10 1rf5 h ALA 350 Ca 0.10 -0.69 -0.32 0.00 0.00 0.00 0.00 54.91 54.00 1rf5 h ALA 350 Cb 0.56 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1rf5 h ALA 350 CO 0.04 0.82 -1.67 -0.07 0.00 0.00 0.00 179.25 178.36 1rf5 h LEU 351 N 0.22 0.33 -1.47 0.00 3.38 -1.30 -3.21 115.31 113.27 1rf5 h LEU 351 Ca -0.06 -0.55 -0.06 0.00 0.09 0.00 0.00 57.88 57.30 1rf5 h LEU 351 Cb 1.51 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 1rf5 h LEU 351 CO 0.15 1.47 -0.27 0.78 0.09 0.00 0.00 178.44 180.66 1rf5 h ASN 352 N 0.06 0.00 1.03 -0.43 2.35 -1.24 -1.00 115.58 116.34 1rf5 h ASN 352 Ca -0.29 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.41 1rf5 h ASN 352 Cb 2.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.38 1rf5 h ASN 352 CO 0.13 0.27 -0.23 0.77 -1.65 0.00 0.00 177.43 176.72 1rf5 h SER 353 N 0.00 0.00 1.29 5.81 4.64 -1.64 -2.94 113.55 120.71 1rf5 h SER 353 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rf5 h SER 353 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1rf5 h SER 353 CO 0.04 0.23 -0.48 0.24 -0.87 0.00 0.00 176.83 175.99 1rf5 h MET 354 N 0.00 0.00 0.00 4.77 2.86 -1.29 -3.43 114.93 117.84 1rf5 h MET 354 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1rf5 h MET 354 Cb 0.81 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.47 1rf5 h MET 354 CO 0.03 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.41 1rf5 n GLY 355 N 1.23 1.73 3.97 8.32 0.00 -0.72 0.46 105.19 120.18 1rf5 n GLY 355 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 1rf5 n GLY 355 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rf5 s ALA 356 N -1.85 3.17 -0.49 4.61 0.00 -0.48 -4.59 121.76 122.14 1rf5 s ALA 356 Ca 0.00 -1.55 0.03 0.00 0.00 0.00 0.00 51.96 50.44 1rf5 s ALA 356 Cb 0.00 -2.28 0.15 0.00 0.00 0.00 0.00 23.12 20.99 1rf5 s ALA 356 CO 0.00 -1.82 0.32 0.34 0.00 0.00 0.00 175.76 174.60 1rf5 s ASP 357 N -4.80 3.30 -0.11 0.00 3.68 -1.26 -4.53 116.67 112.94 1rf5 s ASP 357 Ca 0.69 -2.98 0.02 0.00 2.13 0.00 0.00 52.55 52.41 1rf5 s ASP 357 Cb -0.05 -0.98 0.01 0.00 -1.45 0.00 0.00 42.92 40.46 1rf5 s ASP 357 CO 0.47 -0.20 -0.18 -0.63 0.13 0.00 0.00 175.17 174.76 1rf5 s ILE 358 N -0.08 1.74 -0.25 4.11 1.01 -1.26 -2.06 121.20 124.41 1rf5 s ILE 358 Ca 0.23 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 60.10 1rf5 s ILE 358 Cb -0.13 -1.55 0.05 0.00 0.01 0.00 0.00 42.46 40.84 1rf5 s ILE 358 CO -0.09 0.49 -0.11 0.28 0.00 0.00 0.00 174.94 175.52 1rf5 s THR 359 N 0.82 2.30 0.25 2.92 -1.32 -0.67 -4.98 115.64 114.96 1rf5 s THR 359 Ca -0.09 -1.47 -0.30 0.00 -1.21 0.00 0.00 61.69 58.62 1rf5 s THR 359 Cb -0.16 -2.29 -0.09 0.00 -1.51 0.00 0.00 72.50 68.46 1rf5 s THR 359 CO 0.00 0.06 1.16 -2.84 -2.21 0.00 0.00 174.62 170.79 1rf5 s PRO 360 N 1.16 4.55 0.06 7.08 0.02 -1.26 -1.32 135.00 145.29 1rf5 s PRO 360 Ca -0.06 1.88 0.00 0.00 0.02 0.00 0.00 61.00 62.85 1rf5 s PRO 360 Cb -0.19 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.14 1rf5 s PRO 360 CO -0.06 0.05 0.03 0.25 -0.33 0.00 0.00 177.00 176.95 1rf5 n THR 361 N 1.62 0.00 0.14 0.99 -2.24 0.12 -4.94 114.28 109.96 1rf5 n THR 361 Ca 0.01 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1rf5 n THR 361 Cb 0.44 -0.25 0.14 0.00 -2.10 0.00 0.00 70.33 68.56 1rf5 n THR 361 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rf5 h ALA 362 N 0.85 0.81 -0.13 6.98 0.00 -1.97 -3.30 119.26 122.50 1rf5 h ALA 362 Ca -0.05 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1rf5 h ALA 362 Cb 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1rf5 h ALA 362 CO 0.07 0.76 0.00 -0.40 0.00 0.00 0.00 179.25 179.69 1rf5 n ASP 363 N -3.55 2.19 0.00 0.00 5.68 -1.26 -4.79 116.55 114.81 1rf5 n ASP 363 Ca -0.00 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.62 1rf5 n ASP 363 Cb 0.67 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.56 1rf5 n ASP 363 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rf5 n GLY 364 N 0.38 -0.53 3.38 6.12 0.00 -1.24 -0.20 105.19 113.10 1rf5 n GLY 364 Ca 0.07 -0.07 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1rf5 n GLY 364 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1rf5 s MET 365 N 0.00 0.90 -0.19 1.61 0.23 -1.13 0.11 119.30 120.83 1rf5 s MET 365 Ca 0.00 -0.02 -0.04 0.00 -1.03 0.00 0.00 55.69 54.60 1rf5 s MET 365 Cb 0.00 0.41 -0.02 0.00 -1.53 0.00 0.00 34.83 33.70 1rf5 s MET 365 CO 0.00 -0.28 -0.04 0.42 -2.03 0.00 0.00 175.02 173.09 1rf5 s ILE 366 N -1.51 3.58 -0.18 3.16 1.01 -0.44 -1.64 121.20 125.19 1rf5 s ILE 366 Ca -0.11 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1rf5 s ILE 366 Cb -0.02 -2.60 0.01 0.00 0.01 0.00 0.00 42.46 39.86 1rf5 s ILE 366 CO 0.05 0.45 -0.18 -0.63 0.00 0.00 0.00 174.94 174.63 1rf5 s ILE 367 N 1.03 2.30 -0.33 2.92 1.01 0.46 -1.67 121.20 126.92 1rf5 s ILE 367 Ca 0.01 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.64 1rf5 s ILE 367 Cb -0.15 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.34 1rf5 s ILE 367 CO 0.00 0.52 0.37 -0.54 0.00 0.00 0.00 174.94 175.30 1rf5 s LYS 368 N 1.18 3.65 0.00 2.79 1.02 -0.87 -0.08 119.74 127.43 1rf5 s LYS 368 Ca 0.02 -0.32 0.00 0.00 0.02 0.00 0.00 55.97 55.69 1rf5 s LYS 368 Cb -0.14 -3.78 0.00 0.00 -0.52 0.00 0.00 37.83 33.40 1rf5 s LYS 368 CO -0.08 -0.48 0.00 0.41 -0.92 0.00 0.00 175.35 174.28 1rf5 n GLY 369 N 4.91 0.42 3.65 -3.33 0.00 -0.77 -4.29 105.19 105.78 1rf5 n GLY 369 Ca -0.09 -1.86 -0.28 0.00 0.00 0.00 0.00 46.02 43.80 1rf5 n GLY 369 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1rf5 n LYS 370 N -0.50 -1.19 -4.90 1.61 3.00 0.96 -4.70 118.16 112.43 1rf5 n LYS 370 Ca 0.00 0.61 -0.33 0.00 -0.00 0.00 0.00 58.31 58.60 1rf5 n LYS 370 Cb 0.00 -3.86 -0.15 0.00 0.00 0.00 0.00 35.03 31.02 1rf5 n LYS 370 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1rf5 s SER 371 N -3.32 3.77 -0.12 3.14 0.01 -0.35 -4.99 113.70 111.84 1rf5 s SER 371 Ca 0.33 -0.38 -0.29 0.00 1.31 0.00 0.00 55.95 56.92 1rf5 s SER 371 Cb -0.13 -1.49 -0.02 0.00 0.21 0.00 0.00 66.02 64.59 1rf5 s SER 371 CO 0.86 0.18 1.23 0.00 0.41 0.00 0.00 173.24 175.92 1rf5 s ALA 372 N 0.26 3.59 0.05 1.44 0.00 -1.26 -4.85 121.76 120.99 1rf5 s ALA 372 Ca -0.11 0.51 -0.18 0.00 0.00 0.00 0.00 51.96 52.17 1rf5 s ALA 372 Cb -0.16 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.32 1rf5 s ALA 372 CO 0.06 -1.00 0.53 -0.51 0.00 0.00 0.00 175.76 174.84 1rf5 s LEU 373 N 2.96 4.51 0.48 0.00 1.43 -1.26 -4.69 118.68 122.11 1rf5 s LEU 373 Ca 0.55 1.18 0.02 0.00 -1.03 0.00 0.00 54.13 54.85 1rf5 s LEU 373 Cb -0.23 -2.82 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 1rf5 s LEU 373 CO 0.17 0.28 0.06 -1.38 0.23 0.00 0.00 176.35 175.71 1rf5 s HIS 374 N -1.05 1.77 0.23 0.29 -3.43 0.17 -4.06 115.29 109.22 1rf5 s HIS 374 Ca 0.28 -1.15 -0.30 0.00 -0.80 0.00 0.00 55.06 53.09 1rf5 s HIS 374 Cb -0.19 -1.40 -0.09 0.00 -1.43 0.00 0.00 32.58 29.48 1rf5 s HIS 374 CO 0.17 -0.04 1.20 0.20 -2.00 0.00 0.00 174.74 174.28 1rf5 s GLY 375 N -3.79 2.78 0.15 -1.38 0.00 -0.92 -4.64 107.32 99.52 1rf5 s GLY 375 Ca 0.10 1.00 -0.20 0.00 0.00 0.00 0.00 44.72 45.61 1rf5 s GLY 375 CO 0.07 1.81 0.53 0.00 0.00 0.00 0.00 173.10 175.50 1rf5 s ALA 376 N -0.44 -1.34 -0.20 3.20 0.00 -1.18 -4.80 121.76 117.01 1rf5 s ALA 376 Ca 0.51 0.26 -0.10 0.00 0.00 0.00 0.00 51.96 52.63 1rf5 s ALA 376 Cb -0.34 0.82 -0.05 0.00 0.00 0.00 0.00 23.12 23.55 1rf5 s ALA 376 CO 0.40 -0.73 0.13 0.50 0.00 0.00 0.00 175.76 176.06 1rf5 s ARG 377 N -3.78 4.17 -0.05 0.00 3.52 -1.26 -2.22 118.95 119.33 1rf5 s ARG 377 Ca 0.02 -0.21 0.03 0.00 -0.13 0.00 0.00 55.73 55.44 1rf5 s ARG 377 Cb -0.00 -3.41 0.00 0.00 -1.56 0.00 0.00 34.95 29.98 1rf5 s ARG 377 CO -0.12 0.31 -0.14 0.08 -0.81 0.00 0.00 175.30 174.62 1rf5 s VAL 378 N 0.33 1.24 -0.15 7.11 1.01 -0.80 -4.99 120.40 124.14 1rf5 s VAL 378 Ca 0.08 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 1rf5 s VAL 378 Cb -0.11 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1rf5 s VAL 378 CO -0.02 0.37 0.08 0.21 0.00 0.00 0.00 175.10 175.74 1rf5 s ASN 379 N 0.30 5.79 0.14 3.32 2.47 -1.26 -1.65 114.94 124.05 1rf5 s ASN 379 Ca -0.08 0.19 0.02 0.00 0.42 0.00 0.00 52.86 53.41 1rf5 s ASN 379 Cb -0.13 -1.91 -0.10 0.00 -1.45 0.00 0.00 41.25 37.66 1rf5 s ASN 379 CO 0.03 0.26 1.31 0.71 -3.72 0.00 0.00 177.10 175.69 1rf5 h THR 380 N 4.53 1.55 -2.53 -5.21 1.35 -1.81 -3.48 112.91 107.29 1rf5 h THR 380 Ca -0.44 -2.88 -0.40 0.00 -0.55 0.00 0.00 66.41 62.15 1rf5 h THR 380 Cb 1.18 2.64 -0.04 0.00 -1.73 0.00 0.00 68.15 70.20 1rf5 h THR 380 CO 0.66 0.83 -0.49 0.49 -0.25 0.00 0.00 175.52 176.76 1rf5 n PHE 381 N -3.57 -0.80 -0.22 4.73 3.01 -1.26 -2.42 117.46 116.93 1rf5 n PHE 381 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 1rf5 n PHE 381 Cb 0.88 -3.75 0.00 0.00 -0.01 0.00 0.00 39.48 36.60 1rf5 n PHE 381 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1rf5 n GLY 382 N -0.95 0.75 3.69 1.37 0.00 -1.26 -5.07 105.19 103.73 1rf5 n GLY 382 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 1rf5 n GLY 382 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rf5 s ASP 383 N -2.49 6.32 0.20 1.61 3.68 -1.02 -4.92 116.67 120.05 1rf5 s ASP 383 Ca 0.00 0.37 0.09 0.00 2.13 0.00 0.00 52.55 55.14 1rf5 s ASP 383 Cb 0.00 -2.17 0.07 0.00 -1.45 0.00 0.00 42.92 39.38 1rf5 s ASP 383 CO 0.00 0.04 1.44 1.12 0.13 0.00 0.00 175.17 177.91 1rf5 h HIS 384 N 7.13 0.00 -0.01 -5.34 2.07 -1.90 -3.29 115.15 113.81 1rf5 h HIS 384 Ca -0.39 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 56.96 1rf5 h HIS 384 Cb 1.16 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.13 1rf5 h HIS 384 CO 0.64 0.80 -0.80 0.00 -3.07 0.00 0.00 177.93 175.50 1rf5 h ARG 385 N 0.00 0.14 -0.14 5.12 3.08 -1.93 -2.96 114.38 117.69 1rf5 h ARG 385 Ca -0.01 -0.13 -0.22 0.00 0.07 0.00 0.00 59.98 59.69 1rf5 h ARG 385 Cb 1.44 0.04 0.01 0.00 0.08 0.00 0.00 29.97 31.53 1rf5 h ARG 385 CO 0.10 0.86 -0.79 0.82 -1.07 0.00 0.00 179.97 179.89 1rf5 h ILE 386 N 0.08 1.29 -0.58 2.04 5.03 -1.92 -2.41 117.51 121.03 1rf5 h ILE 386 Ca -0.03 -2.01 -0.06 0.00 -0.12 0.00 0.00 64.86 62.64 1rf5 h ILE 386 Cb 1.39 2.02 -0.02 0.00 -3.03 0.00 0.00 36.82 37.18 1rf5 h ILE 386 CO 0.12 0.63 0.14 1.23 -0.68 0.00 0.00 178.15 179.59 1rf5 h GLY 387 N 0.65 1.01 2.00 5.37 0.00 -1.62 -0.82 103.07 109.66 1rf5 h GLY 387 Ca -0.05 -0.64 -0.12 0.00 0.00 0.00 0.00 47.33 46.52 1rf5 h GLY 387 CO 0.16 0.59 -0.57 -0.33 0.00 0.00 0.00 176.54 176.39 1rf5 h MET 388 N 0.85 0.00 -0.22 4.80 2.86 -1.59 -2.29 114.93 119.33 1rf5 h MET 388 Ca 0.18 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.76 1rf5 h MET 388 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1rf5 h MET 388 CO 0.00 0.57 -0.12 1.98 1.06 0.00 0.00 176.91 180.40 1rf5 h MET 389 N 0.00 0.48 -0.00 1.72 -1.53 -1.15 -3.07 114.93 111.37 1rf5 h MET 389 Ca -0.01 -0.22 -0.09 0.00 -3.44 0.00 0.00 59.70 55.94 1rf5 h MET 389 Cb 1.07 -0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 32.10 1rf5 h MET 389 CO 0.07 0.76 -0.45 1.15 0.14 0.00 0.00 176.91 178.59 1rf5 h THR 390 N 0.18 1.32 -0.47 -0.77 2.02 -1.13 -2.38 112.91 111.68 1rf5 h THR 390 Ca 0.05 -1.54 -0.07 0.00 0.77 0.00 0.00 66.41 65.62 1rf5 h THR 390 Cb 0.63 1.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.85 1rf5 h THR 390 CO 0.04 0.44 0.03 0.00 0.37 0.00 0.00 175.52 176.40 1rf5 h ALA 391 N 1.54 0.63 0.00 6.16 0.00 -1.39 -1.45 119.26 124.75 1rf5 h ALA 391 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1rf5 h ALA 391 Cb 0.80 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1rf5 h ALA 391 CO 0.06 0.41 -0.38 -0.84 0.00 0.00 0.00 179.25 178.50 1rf5 h ILE 392 N 0.67 0.00 0.00 0.00 3.07 -1.52 -3.18 117.51 116.55 1rf5 h ILE 392 Ca 0.14 -0.51 -0.10 0.00 1.55 0.00 0.00 64.86 65.93 1rf5 h ILE 392 Cb 0.46 1.26 -0.01 0.00 -0.27 0.00 0.00 36.82 38.26 1rf5 h ILE 392 CO 0.02 0.00 -0.49 0.00 -1.05 0.00 0.00 178.15 176.63 1rf5 h ALA 393 N 2.49 0.72 0.00 0.16 0.00 -1.25 -3.28 119.26 118.10 1rf5 h ALA 393 Ca 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 1rf5 h ALA 393 Cb 0.76 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1rf5 h ALA 393 CO 0.00 0.62 -0.43 0.00 0.00 0.00 0.00 179.25 179.44 1rf5 h ALA 394 N 1.51 1.09 0.00 0.00 0.00 -1.24 -3.08 119.26 117.54 1rf5 h ALA 394 Ca -0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1rf5 h ALA 394 Cb 1.31 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1rf5 h ALA 394 CO 0.06 0.53 -0.09 -0.07 0.00 0.00 0.00 179.25 179.69 1rf5 h LEU 395 N 0.00 0.00 0.00 0.00 3.38 -1.61 -2.22 115.31 114.86 1rf5 h LEU 395 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rf5 h LEU 395 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1rf5 h LEU 395 CO 0.06 0.09 -0.45 0.18 0.09 0.00 0.00 178.44 178.40 1rf5 n LEU 396 N -3.48 0.72 -4.67 1.67 4.32 -1.16 -1.90 117.00 112.49 1rf5 n LEU 396 Ca -0.02 0.32 -0.43 0.00 -0.02 0.00 0.00 56.01 55.87 1rf5 n LEU 396 Cb 0.23 -0.22 -0.02 0.00 -1.62 0.00 0.00 43.42 41.78 1rf5 n LEU 396 CO 0.28 -0.08 1.01 -0.69 -1.22 0.00 0.00 177.39 176.68 1rf5 s VAL 397 N -3.14 4.29 -0.15 4.08 1.01 -0.83 -4.65 120.40 121.00 1rf5 s VAL 397 Ca 0.08 1.59 0.12 0.00 0.00 0.00 0.00 61.98 63.76 1rf5 s VAL 397 Cb 0.13 -4.02 -0.17 0.00 0.00 0.00 0.00 36.38 32.32 1rf5 s VAL 397 CO 0.69 -0.06 0.03 0.00 0.00 0.00 0.00 175.10 175.75 1rf5 n ALA 398 N 5.84 1.64 -3.61 5.51 0.00 -1.26 -0.88 120.51 127.75 1rf5 n ALA 398 Ca 0.12 -0.93 -0.34 0.00 0.00 0.00 0.00 53.44 52.29 1rf5 n ALA 398 Cb 0.46 -0.04 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 1rf5 n ALA 398 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1rf5 s ASP 399 N -4.87 3.94 0.00 0.00 3.68 -1.26 -4.92 116.67 113.24 1rf5 s ASP 399 Ca -0.09 -0.45 0.00 0.00 2.13 0.00 0.00 52.55 54.14 1rf5 s ASP 399 Cb 0.04 -1.65 0.00 0.00 -1.45 0.00 0.00 42.92 39.86 1rf5 s ASP 399 CO 0.57 0.01 0.00 0.61 0.13 0.00 0.00 175.17 176.49 1rf5 n GLY 400 N 4.59 0.03 3.47 2.66 0.00 -1.26 -2.16 105.19 112.51 1rf5 n GLY 400 Ca -0.19 -1.82 -0.31 0.00 0.00 0.00 0.00 46.02 43.70 1rf5 n GLY 400 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rf5 s GLU 401 N -1.83 2.16 -0.25 1.61 0.41 -1.26 -4.48 118.70 115.06 1rf5 s GLU 401 Ca 0.00 -0.93 -0.09 0.00 -0.41 0.00 0.00 54.97 53.55 1rf5 s GLU 401 Cb 0.00 -2.23 -0.04 0.00 -1.78 0.00 0.00 34.13 30.08 1rf5 s GLU 401 CO 0.00 0.55 0.11 0.08 -0.49 0.00 0.00 175.26 175.51 1rf5 s VAL 402 N -0.90 4.71 -0.03 2.63 1.01 -1.26 -3.09 120.40 123.47 1rf5 s VAL 402 Ca 0.14 -0.04 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 1rf5 s VAL 402 Cb -0.11 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 1rf5 s VAL 402 CO 0.05 0.33 0.02 -1.61 0.00 0.00 0.00 175.10 173.89 1rf5 s GLU 403 N 1.46 2.92 -0.11 2.72 2.02 -0.94 -1.92 118.70 124.83 1rf5 s GLU 403 Ca 0.06 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.53 1rf5 s GLU 403 Cb -0.15 -2.76 0.02 0.00 0.10 0.00 0.00 34.13 31.35 1rf5 s GLU 403 CO 0.05 0.65 -0.10 -1.17 0.02 0.00 0.00 175.26 174.72 1rf5 s LEU 404 N -1.40 1.37 0.02 1.80 1.98 0.29 -1.91 118.68 120.81 1rf5 s LEU 404 Ca 0.18 -0.34 -0.07 0.00 -2.89 0.00 0.00 54.13 51.01 1rf5 s LEU 404 Cb -0.12 -0.92 -0.05 0.00 0.66 0.00 0.00 46.19 45.77 1rf5 s LEU 404 CO 0.09 -0.08 0.29 -1.81 -1.89 0.00 0.00 176.35 172.95 1rf5 s ASP 405 N 1.50 6.52 -1.09 3.68 -0.00 -0.66 -1.78 116.67 124.84 1rf5 s ASP 405 Ca 0.02 0.60 -0.13 0.00 -0.00 0.00 0.00 52.55 53.04 1rf5 s ASP 405 Cb -0.13 -2.11 -0.04 0.00 -0.00 0.00 0.00 42.92 40.64 1rf5 s ASP 405 CO -0.07 0.24 0.86 0.54 -0.00 0.00 0.00 175.17 176.75 1rf5 n ARG 406 N 1.11 -1.74 0.00 8.23 1.74 -1.26 -3.16 116.66 121.58 1rf5 n ARG 406 Ca -0.11 0.67 0.13 0.00 -0.77 0.00 0.00 57.85 57.78 1rf5 n ARG 406 Cb 0.53 -5.00 0.67 0.00 -1.02 0.00 0.00 32.46 27.64 1rf5 n ARG 406 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rf5 n ALA 407 N -3.68 2.34 0.44 7.54 0.00 -1.26 -3.31 120.51 122.57 1rf5 n ALA 407 Ca -0.08 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.36 1rf5 n ALA 407 Cb 0.60 -1.44 0.48 0.00 0.00 0.00 0.00 19.45 19.09 1rf5 n ALA 407 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1rf5 h GLU 408 N 0.00 0.00 0.00 0.00 3.07 -1.98 -3.09 114.58 112.58 1rf5 h GLU 408 Ca 0.00 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.80 1rf5 h GLU 408 Cb 0.28 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1rf5 h GLU 408 CO 0.00 0.00 -0.28 0.00 -1.40 0.00 0.00 179.01 177.33 1rf5 h ALA 409 N 2.31 1.32 0.00 3.43 0.00 -1.88 -2.90 119.26 121.54 1rf5 h ALA 409 Ca 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1rf5 h ALA 409 Cb 0.47 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1rf5 h ALA 409 CO 0.00 0.34 -0.15 0.82 0.00 0.00 0.00 179.25 180.26 1rf5 h ILE 410 N 0.00 0.96 0.00 0.00 2.04 -1.80 -2.89 117.51 115.82 1rf5 h ILE 410 Ca -0.00 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1rf5 h ILE 410 Cb 0.57 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 1rf5 h ILE 410 CO 0.04 0.15 0.00 0.59 0.00 0.00 0.00 178.15 178.93 1rf5 n ASN 411 N -4.14 0.00 0.09 1.72 4.13 -1.09 -1.37 115.26 114.60 1rf5 n ASN 411 Ca -0.02 0.28 -0.02 0.00 1.68 0.00 0.00 54.58 56.50 1rf5 n ASN 411 Cb 0.23 -0.36 0.22 0.00 -1.54 0.00 0.00 39.78 38.33 1rf5 n ASN 411 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 1rf5 h THR 412 N 0.00 1.31 0.00 3.41 2.02 -1.72 -3.39 112.91 114.54 1rf5 h THR 412 Ca 0.00 -1.52 0.00 0.00 0.77 0.00 0.00 66.41 65.66 1rf5 h THR 412 Cb 0.09 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 1rf5 h THR 412 CO 0.00 0.46 -0.53 -1.54 0.37 0.00 0.00 175.52 174.28 1rf5 n SER 413 N -4.02 2.48 -3.64 4.18 3.41 -1.12 -4.98 113.62 109.92 1rf5 n SER 413 Ca -0.01 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.32 1rf5 n SER 413 Cb 0.48 0.18 -0.11 0.00 -0.26 0.00 0.00 64.21 64.50 1rf5 n SER 413 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1rf5 s TYR 414 N -1.53 2.15 0.31 7.33 6.04 -0.47 -4.93 117.35 126.25 1rf5 s TYR 414 Ca 0.00 -2.68 0.13 0.00 0.04 0.00 0.00 57.07 54.56 1rf5 s TYR 414 Cb 0.00 -1.76 0.60 0.00 -1.04 0.00 0.00 41.96 39.76 1rf5 s TYR 414 CO 0.00 -0.72 1.74 -1.00 -1.54 0.00 0.00 175.55 174.03 1rf5 h PRO 415 N 5.84 0.00 -1.04 4.97 0.13 -1.74 -3.20 132.00 136.95 1rf5 h PRO 415 Ca 0.16 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.63 1rf5 h PRO 415 Cb 0.86 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.66 1rf5 h PRO 415 CO 0.51 0.46 0.40 -1.13 -0.23 0.00 0.00 178.00 178.01 1rf5 n SER 416 N -3.89 6.87 -0.01 1.44 3.41 -1.26 -4.67 113.62 115.51 1rf5 n SER 416 Ca -0.01 -3.78 -0.16 0.00 -0.26 0.00 0.00 58.87 54.65 1rf5 n SER 416 Cb 0.49 -0.80 -0.11 0.00 -0.26 0.00 0.00 64.21 63.53 1rf5 n SER 416 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1rf5 h PHE 417 N 2.16 0.45 0.00 7.33 3.04 -1.94 -2.82 116.94 125.15 1rf5 h PHE 417 Ca 0.53 -0.23 -0.05 0.00 3.98 0.00 0.00 57.97 62.20 1rf5 h PHE 417 Cb 0.93 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.38 1rf5 h PHE 417 CO 1.24 1.03 -0.24 0.74 -2.02 0.00 0.00 178.31 179.06 1rf5 h PHE 418 N -0.26 0.00 -0.15 0.41 -1.00 -1.87 -1.71 116.94 112.35 1rf5 h PHE 418 Ca -0.05 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.57 1rf5 h PHE 418 Cb 1.13 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.69 1rf5 h PHE 418 CO 0.16 0.24 -0.57 -0.44 -1.61 0.00 0.00 178.31 176.09 1rf5 h ASP 419 N 0.00 0.53 0.72 2.17 3.32 -1.89 -2.18 116.42 119.09 1rf5 h ASP 419 Ca -0.00 -0.29 -0.20 0.00 0.02 0.00 0.00 57.03 56.56 1rf5 h ASP 419 Cb 0.86 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.24 1rf5 h ASP 419 CO 0.03 0.99 -0.90 0.44 -1.72 0.00 0.00 179.24 178.08 1rf5 h ASP 420 N 0.36 0.15 -0.25 6.45 3.32 -1.25 -3.13 116.42 122.06 1rf5 h ASP 420 Ca 0.00 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 56.75 1rf5 h ASP 420 Cb 1.10 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.60 1rf5 h ASP 420 CO 0.10 0.97 -0.49 0.25 -1.72 0.00 0.00 179.24 178.35 1rf5 h LEU 421 N 0.05 0.91 -1.09 1.55 5.85 -1.29 -3.07 115.31 118.22 1rf5 h LEU 421 Ca -0.03 -0.46 -0.09 0.00 0.84 0.00 0.00 57.88 58.14 1rf5 h LEU 421 Cb 1.55 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1rf5 h LEU 421 CO 0.13 1.24 -0.34 -0.33 -0.34 0.00 0.00 178.44 178.80 1rf5 h GLU 422 N 0.65 0.21 0.00 1.25 4.39 -1.46 -2.68 114.58 116.95 1rf5 h GLU 422 Ca 0.03 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.52 1rf5 h GLU 422 Cb 1.08 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.70 1rf5 h GLU 422 CO 0.11 0.53 -0.57 0.66 -1.16 0.00 0.00 179.01 178.57 1rf5 h SER 423 N 0.19 0.00 0.29 1.42 4.64 -1.54 -3.02 113.55 115.52 1rf5 h SER 423 Ca 0.02 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.12 1rf5 h SER 423 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1rf5 h SER 423 CO 0.05 0.57 -0.92 -0.07 -0.87 0.00 0.00 176.83 175.59 1rf5 h LEU 424 N 0.00 0.57 -0.43 5.97 3.38 -1.40 -1.77 115.31 121.63 1rf5 h LEU 424 Ca -0.01 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.46 1rf5 h LEU 424 Cb 1.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 1rf5 h LEU 424 CO 0.07 1.24 0.05 0.40 0.09 0.00 0.00 178.44 180.30 1rf5 h ILE 425 N 0.26 1.25 -0.04 1.22 2.04 -1.47 -2.29 117.51 118.47 1rf5 h ILE 425 Ca -0.08 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 64.86 1rf5 h ILE 425 Cb 1.55 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 1rf5 h ILE 425 CO 0.16 0.32 0.00 1.41 0.00 0.00 0.00 178.15 180.04 1rf5 n HIS 426 N -4.47 0.03 1.47 1.37 8.25 -1.15 -4.88 115.22 115.84 1rf5 n HIS 426 Ca -0.00 -0.01 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 1rf5 n HIS 426 Cb 0.25 0.00 0.70 0.00 1.12 0.00 0.00 29.99 32.06 1rf5 n HIS 426 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39