#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fxl s VAL 3 N 0.00 3.67 -0.01 0.00 1.01 -1.26 -4.85 120.40 118.95 2fxl s VAL 3 Ca 0.00 0.73 0.09 0.00 0.00 0.00 0.00 61.98 62.81 2fxl s VAL 3 Cb 0.00 -3.73 -0.23 0.00 0.00 0.00 0.00 36.38 32.42 2fxl s VAL 3 CO 0.00 -0.35 0.79 0.11 0.00 0.00 0.00 175.10 175.65 2fxl h LYS 4 N 11.14 0.03 -2.13 2.72 1.57 -2.06 -3.48 116.57 124.36 2fxl h LYS 4 Ca -0.33 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.33 2fxl h LYS 4 Cb 1.15 0.02 -0.19 0.00 0.08 0.00 0.00 32.23 33.30 2fxl h LYS 4 CO 1.01 0.68 0.16 0.00 -0.57 0.00 0.00 179.45 180.73 2fxl s ALA 5 N -2.62 -1.69 -0.27 3.86 0.00 -1.26 -5.16 121.76 114.62 2fxl s ALA 5 Ca -0.05 1.20 -0.21 0.00 0.00 0.00 0.00 51.96 52.91 2fxl s ALA 5 Cb 0.08 0.05 0.08 0.00 0.00 0.00 0.00 23.12 23.33 2fxl s ALA 5 CO 0.82 -0.38 0.72 0.00 0.00 0.00 0.00 175.76 176.92 2fxl s ALA 6 N -1.32 -1.84 0.00 0.00 0.00 -1.26 -5.16 121.76 112.18 2fxl s ALA 6 Ca -0.11 2.20 -0.21 0.00 0.00 0.00 0.00 51.96 53.85 2fxl s ALA 6 Cb -0.00 -1.30 0.04 0.00 0.00 0.00 0.00 23.12 21.85 2fxl s ALA 6 CO 0.08 -0.36 0.46 -0.98 0.00 0.00 0.00 175.76 174.97 2fxl s ARG 7 N 0.95 0.88 0.06 0.00 1.70 -1.26 -4.57 118.95 116.71 2fxl s ARG 7 Ca -0.04 -0.14 -0.21 0.00 -0.47 0.00 0.00 55.73 54.86 2fxl s ARG 7 Cb -0.05 0.40 0.05 0.00 -0.57 0.00 0.00 34.95 34.78 2fxl s ARG 7 CO -0.09 -0.28 0.50 1.52 -1.08 0.00 0.00 175.30 175.87 2fxl s TYR 8 N -1.78 -0.40 -0.56 5.89 1.13 -0.92 -4.91 117.35 115.81 2fxl s TYR 8 Ca -0.09 0.40 0.00 0.00 -1.41 0.00 0.00 57.07 55.96 2fxl s TYR 8 Cb -0.02 0.33 0.00 0.00 -1.10 0.00 0.00 41.96 41.17 2fxl s TYR 8 CO 0.03 -0.65 0.00 0.41 -2.51 0.00 0.00 175.55 172.83 2fxl n GLY 9 N 0.34 -0.85 3.08 5.49 0.00 -1.26 -0.08 105.19 111.92 2fxl n GLY 9 Ca -0.18 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 2fxl n GLY 9 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fxl s LYS 10 N -0.54 1.73 0.26 1.61 2.47 -0.48 -4.82 119.74 119.97 2fxl s LYS 10 Ca 0.00 -0.51 0.11 0.00 -1.56 0.00 0.00 55.97 54.00 2fxl s LYS 10 Cb 0.00 -1.46 -0.05 0.00 -1.46 0.00 0.00 37.83 34.86 2fxl s LYS 10 CO 0.00 0.14 -0.12 0.34 0.16 0.00 0.00 175.35 175.87 2fxl s ASP 11 N 0.31 4.01 -1.24 1.43 -1.08 -1.26 -1.47 116.67 117.37 2fxl s ASP 11 Ca -0.09 -0.83 -0.06 0.00 -0.52 0.00 0.00 52.55 51.05 2fxl s ASP 11 Cb -0.13 -0.55 0.01 0.00 -1.46 0.00 0.00 42.92 40.79 2fxl s ASP 11 CO 0.03 0.04 0.83 0.59 0.52 0.00 0.00 175.17 177.18 2fxl n ASN 12 N -0.59 -5.69 -4.56 -0.34 3.02 -1.10 -4.95 115.26 101.05 2fxl n ASN 12 Ca -0.07 -0.38 -0.43 0.00 -0.03 0.00 0.00 54.58 53.67 2fxl n ASN 12 Cb 0.59 -4.38 -0.04 0.00 -0.61 0.00 0.00 39.78 35.34 2fxl n ASN 12 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2fxl s VAL 13 N -3.21 4.32 0.06 2.41 1.01 -0.42 -4.87 120.40 119.71 2fxl s VAL 13 Ca 0.41 0.66 -0.26 0.00 0.00 0.00 0.00 61.98 62.80 2fxl s VAL 13 Cb -0.18 -4.55 -0.06 0.00 0.00 0.00 0.00 36.38 31.59 2fxl s VAL 13 CO 0.51 -1.06 0.80 -0.13 0.00 0.00 0.00 175.10 175.22 2fxl s ARG 14 N 4.16 4.54 -0.03 2.72 0.52 -1.26 -0.54 118.95 129.05 2fxl s ARG 14 Ca 0.37 1.14 0.01 0.00 -0.52 0.00 0.00 55.73 56.73 2fxl s ARG 14 Cb -0.10 -3.36 0.02 0.00 0.52 0.00 0.00 34.95 32.03 2fxl s ARG 14 CO 0.24 0.28 -0.03 0.08 0.02 0.00 0.00 175.30 175.89 2fxl s VAL 15 N -0.09 0.39 -0.06 3.52 1.01 -0.37 -4.99 120.40 119.80 2fxl s VAL 15 Ca 0.40 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.35 2fxl s VAL 15 Cb -0.21 -0.42 -0.02 0.00 0.00 0.00 0.00 36.38 35.73 2fxl s VAL 15 CO 0.24 0.17 -0.18 -0.47 0.00 0.00 0.00 175.10 174.87 2fxl s TYR 16 N 0.72 2.61 -0.02 5.22 6.14 -1.26 -0.66 117.35 130.10 2fxl s TYR 16 Ca -0.08 -0.36 0.02 0.00 0.64 0.00 0.00 57.07 57.28 2fxl s TYR 16 Cb -0.12 -1.63 0.00 0.00 0.42 0.00 0.00 41.96 40.63 2fxl s TYR 16 CO -0.00 0.03 -0.07 0.21 0.64 0.00 0.00 175.55 176.35 2fxl s LYS 17 N -0.47 0.78 -0.06 4.97 2.20 0.21 -5.00 119.74 122.37 2fxl s LYS 17 Ca 0.06 -0.24 0.02 0.00 -0.36 0.00 0.00 55.97 55.44 2fxl s LYS 17 Cb -0.12 -0.75 -0.03 0.00 -1.51 0.00 0.00 37.83 35.42 2fxl s LYS 17 CO 0.01 0.09 -0.09 0.54 -0.36 0.00 0.00 175.35 175.54 2fxl s VAL 18 N 0.21 3.48 -0.16 4.02 0.11 -1.26 -0.64 120.40 126.16 2fxl s VAL 18 Ca -0.03 -0.57 -0.01 0.00 -2.93 0.00 0.00 61.98 58.44 2fxl s VAL 18 Cb -0.08 -2.40 -0.01 0.00 -1.53 0.00 0.00 36.38 32.36 2fxl s VAL 18 CO 0.00 0.59 -0.11 -2.28 -3.33 0.00 0.00 175.10 169.98 2fxl s HIS 19 N -0.79 2.85 -0.18 1.54 2.46 0.15 -4.98 115.29 116.34 2fxl s HIS 19 Ca 0.12 -0.81 0.01 0.00 0.47 0.00 0.00 55.06 54.85 2fxl s HIS 19 Cb -0.11 -1.93 0.02 0.00 -0.13 0.00 0.00 32.58 30.44 2fxl s HIS 19 CO 0.01 -0.36 -0.19 0.15 -2.47 0.00 0.00 174.74 171.89 2fxl s LYS 20 N 0.75 2.85 -0.62 2.88 1.02 -1.26 -0.41 119.74 124.95 2fxl s LYS 20 Ca -0.05 -0.85 -0.21 0.00 0.02 0.00 0.00 55.97 54.88 2fxl s LYS 20 Cb -0.15 -2.56 0.08 0.00 -0.52 0.00 0.00 37.83 34.68 2fxl s LYS 20 CO 0.01 -0.25 0.86 0.34 -0.92 0.00 0.00 175.35 175.39 2fxl s ASP 21 N 1.29 6.19 0.18 2.83 3.68 -0.07 -4.92 116.67 125.85 2fxl s ASP 21 Ca 0.04 -1.07 -0.25 0.00 2.13 0.00 0.00 52.55 53.39 2fxl s ASP 21 Cb -0.14 -2.37 0.05 0.00 -1.45 0.00 0.00 42.92 39.01 2fxl s ASP 21 CO -0.12 -1.28 1.55 -0.33 0.13 0.00 0.00 175.17 175.12 2fxl h GLU 22 N 9.39 -0.07 0.15 4.34 5.08 -1.93 1.65 114.58 133.18 2fxl h GLU 22 Ca -0.29 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.08 2fxl h GLU 22 Cb 1.08 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.31 2fxl h GLU 22 CO 1.13 -0.05 -0.44 -0.22 -1.00 0.00 0.00 179.01 178.43 2fxl h LYS 23 N -0.08 -0.64 0.00 2.33 3.64 -1.97 -3.25 116.57 116.60 2fxl h LYS 23 Ca 0.22 0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.45 2fxl h LYS 23 Cb 0.52 0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 2fxl h LYS 23 CO -0.88 -0.43 -1.38 1.79 -2.27 0.00 0.00 179.45 176.28 2fxl h THR 24 N -0.67 0.71 0.00 1.00 1.35 -1.92 -3.47 112.91 109.91 2fxl h THR 24 Ca -0.01 -2.31 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 2fxl h THR 24 Cb 0.65 2.23 0.00 0.00 -1.73 0.00 0.00 68.15 69.31 2fxl h THR 24 CO -0.21 0.41 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 2fxl n GLY 25 N 1.42 1.39 3.73 5.82 0.00 0.56 -5.03 105.19 113.09 2fxl n GLY 25 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2fxl n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fxl s VAL 26 N -2.84 3.30 0.09 1.61 1.01 -1.23 -4.77 120.40 117.56 2fxl s VAL 26 Ca 0.00 1.02 0.07 0.00 0.00 0.00 0.00 61.98 63.07 2fxl s VAL 26 Cb 0.00 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2fxl s VAL 26 CO 0.00 0.13 -0.13 -1.10 0.00 0.00 0.00 175.10 174.00 2fxl s GLN 27 N 0.26 2.06 -0.03 2.72 -0.21 0.15 -0.90 119.66 123.71 2fxl s GLN 27 Ca 0.59 -1.03 0.01 0.00 0.02 0.00 0.00 55.36 54.95 2fxl s GLN 27 Cb -0.36 -2.25 0.02 0.00 1.00 0.00 0.00 33.01 31.42 2fxl s GLN 27 CO 0.36 0.51 -0.03 0.99 -2.12 0.00 0.00 175.29 175.00 2fxl s THR 28 N -1.13 0.39 0.18 -0.19 2.01 0.45 -4.53 115.64 112.82 2fxl s THR 28 Ca 0.19 -0.07 0.11 0.00 0.31 0.00 0.00 61.69 62.22 2fxl s THR 28 Cb -0.11 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 2fxl s THR 28 CO 0.11 0.18 -0.20 0.68 -0.69 0.00 0.00 174.62 174.70 2fxl s VAL 29 N 0.76 2.61 -0.05 3.82 -7.23 -1.26 -0.68 120.40 118.37 2fxl s VAL 29 Ca -0.09 -1.88 0.02 0.00 -1.81 0.00 0.00 61.98 58.22 2fxl s VAL 29 Cb -0.12 -2.25 0.01 0.00 0.56 0.00 0.00 36.38 34.58 2fxl s VAL 29 CO -0.00 -0.09 -0.08 -0.31 -0.31 0.00 0.00 175.10 174.31 2fxl s TYR 30 N -1.60 1.03 -0.03 2.82 2.02 0.19 -4.86 117.35 116.91 2fxl s TYR 30 Ca 0.21 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 56.61 2fxl s TYR 30 Cb -0.08 -0.80 0.01 0.00 -0.40 0.00 0.00 41.96 40.69 2fxl s TYR 30 CO 0.11 -0.19 -0.05 -2.00 -1.57 0.00 0.00 175.55 171.85 2fxl s GLU 31 N 0.65 0.68 0.18 -0.62 2.12 -1.26 -0.62 118.70 119.83 2fxl s GLU 31 Ca -0.11 -0.14 -0.02 0.00 0.36 0.00 0.00 54.97 55.07 2fxl s GLU 31 Cb -0.14 -0.69 -0.04 0.00 0.26 0.00 0.00 34.13 33.53 2fxl s GLU 31 CO 0.02 -0.00 0.12 0.00 -0.54 0.00 0.00 175.26 174.86 2fxl s MET 32 N 0.52 1.12 -0.09 4.30 0.23 0.16 -1.31 119.30 124.23 2fxl s MET 32 Ca -0.07 -1.53 0.03 0.00 -1.03 0.00 0.00 55.69 53.09 2fxl s MET 32 Cb -0.10 0.27 0.01 0.00 -1.53 0.00 0.00 34.83 33.48 2fxl s MET 32 CO -0.00 -0.36 -0.19 0.99 -2.03 0.00 0.00 175.02 173.44 2fxl s THR 33 N -4.11 1.67 -0.04 3.16 2.01 -0.20 -1.24 115.64 116.88 2fxl s THR 33 Ca 0.33 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 61.61 2fxl s THR 33 Cb 0.07 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 71.09 2fxl s THR 33 CO 0.08 0.47 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.54 2fxl s VAL 34 N 0.57 2.10 -0.07 3.82 1.01 0.30 -0.87 120.40 127.26 2fxl s VAL 34 Ca -0.15 -1.07 0.04 0.00 0.00 0.00 0.00 61.98 60.80 2fxl s VAL 34 Cb -0.17 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.47 2fxl s VAL 34 CO 0.05 0.58 -0.20 0.00 0.00 0.00 0.00 175.10 175.52 2fxl s VAL 36 N 0.26 0.61 -0.08 0.00 1.01 -0.54 -0.04 120.40 121.62 2fxl s VAL 36 Ca -0.12 -0.05 0.05 0.00 0.00 0.00 0.00 61.98 61.85 2fxl s VAL 36 Cb -0.15 -0.70 -0.00 0.00 0.00 0.00 0.00 36.38 35.53 2fxl s VAL 36 CO 0.06 0.29 -0.23 -0.76 0.00 0.00 0.00 175.10 174.46 2fxl s LEU 37 N 1.69 2.02 0.02 3.92 1.43 -0.06 -1.38 118.68 126.33 2fxl s LEU 37 Ca 0.02 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 2fxl s LEU 37 Cb -0.13 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.76 2fxl s LEU 37 CO -0.05 0.17 -0.02 -0.76 0.23 0.00 0.00 176.35 175.93 2fxl s LEU 38 N 0.18 3.42 0.08 1.79 1.43 0.88 -0.28 118.68 126.18 2fxl s LEU 38 Ca -0.12 -0.09 0.09 0.00 -1.03 0.00 0.00 54.13 52.98 2fxl s LEU 38 Cb -0.16 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.01 2fxl s LEU 38 CO 0.06 0.25 -0.23 -1.61 0.23 0.00 0.00 176.35 175.06 2fxl s GLU 39 N -1.73 1.38 0.00 1.70 2.02 -0.23 -2.18 118.70 119.67 2fxl s GLU 39 Ca 0.21 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 54.09 2fxl s GLU 39 Cb -0.11 -1.62 0.00 0.00 0.10 0.00 0.00 34.13 32.49 2fxl s GLU 39 CO 0.12 0.40 0.00 0.41 0.02 0.00 0.00 175.26 176.21 2fxl n GLY 40 N 1.44 -0.69 2.93 -1.39 0.00 -1.26 -1.26 105.19 104.97 2fxl n GLY 40 Ca -0.18 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 2fxl n GLY 40 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2fxl n GLU 41 N 0.00 3.01 0.00 1.61 1.02 0.56 -4.41 120.64 122.42 2fxl n GLU 41 Ca 0.00 -2.86 0.00 0.00 -0.02 0.00 0.00 57.16 54.28 2fxl n GLU 41 Cb 0.00 -3.29 0.00 0.00 -0.02 0.00 0.00 31.44 28.13 2fxl n GLU 41 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2fxl n ILE 42 N 5.18 0.69 0.13 -3.67 -5.35 -1.26 -4.80 119.36 110.27 2fxl n ILE 42 Ca 0.50 -0.75 0.15 0.00 -0.27 0.00 0.00 62.75 62.38 2fxl n ILE 42 Cb 0.40 0.68 0.69 0.00 -1.74 0.00 0.00 39.64 39.68 2fxl n ILE 42 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2fxl h GLU 43 N 0.00 0.00 0.00 6.28 3.07 -1.98 -1.83 114.58 120.12 2fxl h GLU 43 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2fxl h GLU 43 Cb 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 2fxl h GLU 43 CO 0.00 0.00 0.00 1.79 -1.40 0.00 0.00 179.01 179.40 2fxl h THR 44 N 0.00 0.00 -0.25 1.13 1.35 -1.88 -1.29 112.91 111.97 2fxl h THR 44 Ca 0.14 -0.47 -0.06 0.00 -0.55 0.00 0.00 66.41 65.47 2fxl h THR 44 Cb 0.57 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 68.35 2fxl h THR 44 CO -0.00 0.00 -0.09 0.77 -0.25 0.00 0.00 175.52 175.95 2fxl h SER 45 N 0.00 0.37 0.05 5.36 4.64 -1.28 0.75 113.55 123.44 2fxl h SER 45 Ca 0.00 -0.08 -0.13 0.00 -0.47 0.00 0.00 61.79 61.11 2fxl h SER 45 Cb 0.55 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2fxl h SER 45 CO 0.00 0.51 -0.55 1.88 -0.87 0.00 0.00 176.83 177.80 2fxl h TYR 46 N 0.37 0.46 0.02 4.77 -1.99 -1.44 -3.28 116.97 115.89 2fxl h TYR 46 Ca 0.08 -0.28 -0.32 0.00 2.00 0.00 0.00 58.73 60.20 2fxl h TYR 46 Cb 0.40 -0.04 -0.05 0.00 2.00 0.00 0.00 36.73 39.04 2fxl h TYR 46 CO 0.01 1.14 -1.91 0.25 -0.00 0.00 0.00 178.16 177.65 2fxl n THR 47 N -4.28 1.59 0.17 -2.88 -2.24 -0.58 -4.50 114.28 101.56 2fxl n THR 47 Ca -0.11 -0.78 0.03 0.00 -2.27 0.00 0.00 64.05 60.92 2fxl n THR 47 Cb 0.67 -1.06 0.03 0.00 -2.10 0.00 0.00 70.33 67.88 2fxl n THR 47 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2fxl n LYS 48 N -3.07 0.38 -3.09 -0.78 4.76 0.17 -4.98 118.16 111.56 2fxl n LYS 48 Ca -0.23 -1.02 -0.22 0.00 -2.87 0.00 0.00 58.31 53.97 2fxl n LYS 48 Cb 1.07 -1.11 0.04 0.00 -1.84 0.00 0.00 35.03 33.19 2fxl n LYS 48 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2fxl n ALA 49 N 0.26 -0.98 -3.10 7.82 0.00 -0.94 -4.94 120.51 118.62 2fxl n ALA 49 Ca 0.04 0.30 -0.45 0.00 0.00 0.00 0.00 53.44 53.33 2fxl n ALA 49 Cb 0.18 -4.04 -0.05 0.00 0.00 0.00 0.00 19.45 15.53 2fxl n ALA 49 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2fxl s ASP 50 N -2.84 6.19 0.00 0.00 2.15 -0.67 -4.87 116.67 116.63 2fxl s ASP 50 Ca 0.34 -1.45 0.30 0.00 0.43 0.00 0.00 52.55 52.17 2fxl s ASP 50 Cb -0.15 -2.28 1.40 0.00 -0.30 0.00 0.00 42.92 41.59 2fxl s ASP 50 CO 0.42 -1.02 1.95 0.59 -0.17 0.00 0.00 175.17 176.94 2fxl n ASN 51 N 6.05 0.45 0.23 -0.34 3.02 -1.26 -3.16 115.26 120.24 2fxl n ASN 51 Ca -0.10 -0.75 0.07 0.00 -0.03 0.00 0.00 54.58 53.76 2fxl n ASN 51 Cb 0.42 -0.07 0.54 0.00 -0.61 0.00 0.00 39.78 40.06 2fxl n ASN 51 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2fxl h SER 52 N 0.61 0.00 0.81 6.41 4.64 -1.98 -0.58 113.55 123.46 2fxl h SER 52 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fxl h SER 52 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2fxl h SER 52 CO 0.00 0.18 0.00 1.33 -0.87 0.00 0.00 176.83 177.47 2fxl n VAL 53 N -4.17 0.06 -3.17 0.95 0.24 -1.25 -4.80 118.33 106.18 2fxl n VAL 53 Ca -0.02 0.01 -0.41 0.00 -2.04 0.00 0.00 64.34 61.88 2fxl n VAL 53 Cb 0.25 -0.53 -0.07 0.00 -1.47 0.00 0.00 33.84 32.02 2fxl n VAL 53 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2fxl s ILE 54 N -2.84 4.98 -0.46 1.34 1.01 -0.23 -4.91 121.20 120.09 2fxl s ILE 54 Ca 0.19 0.72 -0.28 0.00 0.00 0.00 0.00 60.65 61.28 2fxl s ILE 54 Cb 0.19 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.70 2fxl s ILE 54 CO 0.49 -0.12 1.52 -0.69 0.00 0.00 0.00 174.94 176.14 2fxl s VAL 55 N 2.50 3.74 0.33 2.92 1.01 -1.26 -4.98 120.40 124.66 2fxl s VAL 55 Ca 0.23 0.70 -0.28 0.00 0.00 0.00 0.00 61.98 62.63 2fxl s VAL 55 Cb -0.15 -4.15 -0.13 0.00 0.00 0.00 0.00 36.38 31.95 2fxl s VAL 55 CO 0.12 -0.83 1.21 0.00 0.00 0.00 0.00 175.10 175.59 2fxl n ALA 56 N 9.66 0.85 0.22 5.51 0.00 -1.26 -4.81 120.51 130.68 2fxl n ALA 56 Ca 0.17 0.37 0.06 0.00 0.00 0.00 0.00 53.44 54.03 2fxl n ALA 56 Cb 0.48 -2.19 0.53 0.00 0.00 0.00 0.00 19.45 18.28 2fxl n ALA 56 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2fxl h THR 57 N 2.37 1.09 -0.89 0.00 1.35 -1.94 0.32 112.91 115.22 2fxl h THR 57 Ca -0.44 -0.43 0.07 0.00 -0.55 0.00 0.00 66.41 65.06 2fxl h THR 57 Cb 1.30 1.20 -0.07 0.00 -1.73 0.00 0.00 68.15 68.85 2fxl h THR 57 CO 0.62 0.13 0.55 -0.78 -0.25 0.00 0.00 175.52 175.78 2fxl h ASP 58 N 0.03 0.85 0.46 5.36 3.58 -1.94 -1.14 116.42 123.62 2fxl h ASP 58 Ca 0.01 0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.41 2fxl h ASP 58 Cb 0.22 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 2fxl h ASP 58 CO 0.01 0.52 -0.33 0.28 -2.88 0.00 0.00 179.24 176.85 2fxl h SER 59 N 0.97 0.00 -0.39 2.28 0.02 -1.31 -2.16 113.55 112.96 2fxl h SER 59 Ca 0.40 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.32 2fxl h SER 59 Cb 0.24 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 2fxl h SER 59 CO -0.20 0.33 0.11 0.40 -1.14 0.00 0.00 176.83 176.33 2fxl h ILE 60 N 0.00 1.22 -0.30 3.27 2.04 -0.27 -0.12 117.51 123.36 2fxl h ILE 60 Ca -0.00 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.16 2fxl h ILE 60 Cb 0.64 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 2fxl h ILE 60 CO 0.04 0.25 0.11 0.50 0.00 0.00 0.00 178.15 179.05 2fxl h LYS 61 N 0.48 0.23 -0.68 2.37 3.64 -0.93 -0.83 116.57 120.85 2fxl h LYS 61 Ca 0.12 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.59 2fxl h LYS 61 Cb 0.28 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 2fxl h LYS 61 CO -0.00 0.15 0.30 -0.91 -2.27 0.00 0.00 179.45 176.72 2fxl h ASN 62 N 0.24 0.34 -0.63 4.20 2.35 -1.12 -1.40 115.58 119.57 2fxl h ASN 62 Ca 0.13 0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 2fxl h ASN 62 Cb 0.10 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 2fxl h ASN 62 CO -0.13 0.19 0.36 0.74 -1.65 0.00 0.00 177.43 176.94 2fxl h THR 63 N 0.50 1.19 -0.34 2.81 2.02 -0.36 -0.80 112.91 117.95 2fxl h THR 63 Ca 0.34 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 2fxl h THR 63 Cb 0.41 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 2fxl h THR 63 CO -0.30 0.21 0.18 0.40 0.37 0.00 0.00 175.52 176.38 2fxl h ILE 64 N 0.90 1.15 -0.55 3.11 2.04 -0.05 -0.20 117.51 123.91 2fxl h ILE 64 Ca 0.23 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 2fxl h ILE 64 Cb 0.01 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2fxl h ILE 64 CO -0.04 0.15 0.15 1.88 0.00 0.00 0.00 178.15 180.30 2fxl h TYR 65 N 0.42 0.90 -0.52 1.37 0.05 -1.09 -1.52 116.97 116.57 2fxl h TYR 65 Ca 0.12 -0.10 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 2fxl h TYR 65 Cb 0.08 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.54 2fxl h TYR 65 CO -0.02 0.77 0.25 0.82 -1.05 0.00 0.00 178.16 178.93 2fxl h ILE 66 N 0.77 1.20 -0.79 -2.88 2.04 -1.02 -0.38 117.51 116.45 2fxl h ILE 66 Ca 0.17 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 2fxl h ILE 66 Cb 0.31 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2fxl h ILE 66 CO -0.00 0.22 0.41 0.74 0.00 0.00 0.00 178.15 179.52 2fxl h THR 67 N 0.70 1.24 -0.08 -0.27 2.02 -0.92 -1.29 112.91 114.32 2fxl h THR 67 Ca 0.18 -0.64 -0.05 0.00 0.77 0.00 0.00 66.41 66.67 2fxl h THR 67 Cb 0.12 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 2fxl h THR 67 CO -0.02 0.28 -0.19 0.00 0.37 0.00 0.00 175.52 175.95 2fxl h ALA 68 N 1.21 1.54 -0.44 6.16 0.00 -0.96 -1.37 119.26 125.41 2fxl h ALA 68 Ca 0.27 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 2fxl h ALA 68 Cb 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2fxl h ALA 68 CO -0.04 0.34 -0.16 -0.22 0.00 0.00 0.00 179.25 179.16 2fxl h LYS 69 N 0.12 0.84 -0.02 0.00 1.63 0.04 -3.31 116.57 115.85 2fxl h LYS 69 Ca 0.02 -0.31 0.00 0.00 -0.85 0.00 0.00 60.65 59.51 2fxl h LYS 69 Cb 0.41 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 2fxl h LYS 69 CO 0.03 0.94 -0.19 1.04 -3.45 0.00 0.00 179.45 177.82 2fxl n GLN 70 N -4.14 1.73 -4.12 1.90 6.02 -0.73 -4.98 117.38 113.06 2fxl n GLN 70 Ca 0.01 -1.37 -0.09 0.00 -0.01 0.00 0.00 57.00 55.54 2fxl n GLN 70 Cb 0.41 -1.47 -0.10 0.00 1.02 0.00 0.00 30.24 30.10 2fxl n GLN 70 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2fxl s ASN 71 N -2.21 0.34 0.55 1.08 0.01 -0.55 -5.07 114.94 109.08 2fxl s ASN 71 Ca 0.25 -1.13 -0.20 0.00 -0.71 0.00 0.00 52.86 51.07 2fxl s ASN 71 Cb 0.19 0.28 -0.05 0.00 0.41 0.00 0.00 41.25 42.08 2fxl s ASN 71 CO 0.42 -0.70 1.21 -2.84 -1.51 0.00 0.00 177.10 173.68 2fxl s PRO 72 N -4.01 3.22 0.00 -0.60 0.02 -1.26 -4.72 135.00 127.64 2fxl s PRO 72 Ca 0.19 1.85 0.16 0.00 0.02 0.00 0.00 61.00 63.22 2fxl s PRO 72 Cb 0.07 -2.09 0.15 0.00 0.02 0.00 0.00 34.50 32.65 2fxl s PRO 72 CO -0.02 -1.01 1.03 1.33 -0.33 0.00 0.00 177.00 178.00 2fxl n VAL 73 N -1.23 0.07 -4.42 3.83 0.24 -1.26 -4.47 118.33 111.09 2fxl n VAL 73 Ca 0.12 -0.53 -0.20 0.00 -2.04 0.00 0.00 64.34 61.68 2fxl n VAL 73 Cb 0.49 1.28 -0.14 0.00 -1.47 0.00 0.00 33.84 34.00 2fxl n VAL 73 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2fxl s THR 74 N -1.32 1.07 0.66 3.34 -1.32 -1.26 -3.97 115.64 112.85 2fxl s THR 74 Ca 0.20 -0.86 -0.14 0.00 -1.21 0.00 0.00 61.69 59.68 2fxl s THR 74 Cb 0.14 -0.95 -0.00 0.00 -1.51 0.00 0.00 72.50 70.17 2fxl s THR 74 CO 0.20 0.09 1.09 -2.16 -2.21 0.00 0.00 174.62 171.64 2fxl s PRO 75 N -0.87 2.87 0.56 7.08 0.04 -1.26 -4.82 135.00 138.59 2fxl s PRO 75 Ca 0.03 1.31 0.24 0.00 0.04 0.00 0.00 61.00 62.62 2fxl s PRO 75 Cb -0.07 -1.97 1.56 0.00 0.04 0.00 0.00 34.50 34.07 2fxl s PRO 75 CO 0.01 -1.19 2.17 -1.00 0.04 0.00 0.00 177.00 177.03 2fxl h PRO 76 N -0.03 0.00 -0.71 0.56 0.13 -1.98 -1.06 132.00 128.91 2fxl h PRO 76 Ca -0.46 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 2fxl h PRO 76 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 2fxl h PRO 76 CO 0.55 0.00 0.29 0.93 -0.23 0.00 0.00 178.00 179.54 2fxl h GLU 77 N 0.00 1.04 0.03 0.86 3.07 -1.95 0.11 114.58 117.74 2fxl h GLU 77 Ca 0.04 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.36 58.73 2fxl h GLU 77 Cb 0.18 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 2fxl h GLU 77 CO -0.00 0.84 -0.02 1.25 -1.40 0.00 0.00 179.01 179.68 2fxl h LEU 78 N 1.02 -0.04 -0.98 1.33 5.85 -1.56 -2.76 115.31 118.17 2fxl h LEU 78 Ca 0.24 -0.49 0.04 0.00 0.84 0.00 0.00 57.88 58.51 2fxl h LEU 78 Cb 0.18 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 2fxl h LEU 78 CO -0.02 0.48 0.64 0.15 -0.34 0.00 0.00 178.44 179.35 2fxl h PHE 79 N -0.57 1.20 -0.50 1.25 3.57 -1.36 -0.04 116.94 120.49 2fxl h PHE 79 Ca -0.00 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 2fxl h PHE 79 Cb 0.53 -0.40 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 2fxl h PHE 79 CO 0.10 0.69 0.01 0.78 -2.23 0.00 0.00 178.31 177.67 2fxl h GLY 80 N 1.24 0.89 0.97 2.40 0.00 -1.03 -1.42 103.07 106.11 2fxl h GLY 80 Ca 0.39 -0.59 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 2fxl h GLY 80 CO -0.13 0.54 0.02 1.76 0.00 0.00 0.00 176.54 178.74 2fxl h SER 81 N 0.77 0.76 -0.42 0.19 0.02 -1.05 -0.34 113.55 113.48 2fxl h SER 81 Ca 0.15 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 2fxl h SER 81 Cb 0.44 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 2fxl h SER 81 CO 0.02 0.87 0.20 0.40 -1.14 0.00 0.00 176.83 177.17 2fxl h ILE 82 N 0.62 1.18 -0.60 3.27 2.04 -0.75 -0.94 117.51 122.33 2fxl h ILE 82 Ca 0.13 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 2fxl h ILE 82 Cb 0.47 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 2fxl h ILE 82 CO 0.02 0.20 0.36 0.25 0.00 0.00 0.00 178.15 178.98 2fxl h LEU 83 N 0.54 0.73 -0.38 1.44 5.85 -1.20 -1.92 115.31 120.37 2fxl h LEU 83 Ca 0.14 -0.06 -0.19 0.00 0.84 0.00 0.00 57.88 58.61 2fxl h LEU 83 Cb 0.13 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 2fxl h LEU 83 CO -0.02 0.58 -0.68 1.23 -0.34 0.00 0.00 178.44 179.21 2fxl h GLY 84 N 0.81 0.60 1.01 3.75 0.00 -0.83 -3.01 103.07 105.40 2fxl h GLY 84 Ca 0.22 -0.80 0.00 0.00 0.00 0.00 0.00 47.33 46.75 2fxl h GLY 84 CO -0.04 0.71 0.54 -0.84 0.00 0.00 0.00 176.54 176.91 2fxl h THR 85 N 0.39 1.22 -0.53 4.70 2.02 -1.11 -2.62 112.91 116.98 2fxl h THR 85 Ca -0.02 -0.43 0.11 0.00 0.77 0.00 0.00 66.41 66.83 2fxl h THR 85 Cb 1.26 0.01 -0.11 0.00 -1.74 0.00 0.00 68.15 67.57 2fxl h THR 85 CO 0.13 0.22 -0.23 -0.74 0.37 0.00 0.00 175.52 175.26 2fxl h HIS 86 N 1.14 -0.60 -0.68 3.16 6.17 -1.21 -0.95 115.15 122.18 2fxl h HIS 86 Ca 0.31 0.06 -0.04 0.00 0.71 0.00 0.00 60.37 61.40 2fxl h HIS 86 Cb -0.10 0.34 -0.03 0.00 2.52 0.00 0.00 27.41 30.14 2fxl h HIS 86 CO -0.01 -0.32 0.27 0.74 0.71 0.00 0.00 177.93 179.32 2fxl h PHE 87 N -0.11 1.02 0.00 5.26 0.04 -1.46 0.13 116.94 121.83 2fxl h PHE 87 Ca 0.24 -0.07 -0.17 0.00 2.80 0.00 0.00 57.97 60.77 2fxl h PHE 87 Cb 0.49 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 2fxl h PHE 87 CO -0.53 0.78 -0.95 -0.84 -0.60 0.00 0.00 178.31 176.17 2fxl h ILE 88 N 0.99 1.11 0.06 -0.55 3.07 -1.36 -2.33 117.51 118.50 2fxl h ILE 88 Ca 0.23 -2.67 -0.27 0.00 1.55 0.00 0.00 64.86 63.70 2fxl h ILE 88 Cb 0.20 2.51 0.02 0.00 -0.27 0.00 0.00 36.82 39.28 2fxl h ILE 88 CO -0.02 0.63 -1.11 -0.33 -1.05 0.00 0.00 178.15 176.27 2fxl h GLU 89 N 0.00 0.57 -0.20 0.16 5.08 -1.00 -3.36 114.58 115.83 2fxl h GLU 89 Ca -0.06 -0.68 -0.13 0.00 -1.00 0.00 0.00 59.36 57.49 2fxl h GLU 89 Cb 1.62 0.21 0.00 0.00 0.50 0.00 0.00 28.75 31.08 2fxl h GLU 89 CO 0.09 1.28 -0.37 -0.22 -1.00 0.00 0.00 179.01 178.79 2fxl h LYS 90 N 0.28 0.60 -5.08 2.33 1.63 -0.76 -3.42 116.57 112.14 2fxl h LYS 90 Ca -0.14 -0.38 -0.65 0.00 -0.85 0.00 0.00 60.65 58.63 2fxl h LYS 90 Cb 1.78 0.04 -0.25 0.00 -0.60 0.00 0.00 32.23 33.20 2fxl h LYS 90 CO 0.21 0.99 -0.68 0.71 -3.45 0.00 0.00 179.45 177.23 2fxl s TYR 91 N -4.08 3.01 0.40 1.91 2.02 -0.88 -4.98 117.35 114.75 2fxl s TYR 91 Ca -0.13 -0.60 0.11 0.00 -0.37 0.00 0.00 57.07 56.08 2fxl s TYR 91 Cb 0.07 -2.09 0.83 0.00 -0.40 0.00 0.00 41.96 40.38 2fxl s TYR 91 CO 0.82 -0.34 1.92 -0.91 -1.57 0.00 0.00 175.55 175.48 2fxl h ASN 92 N 7.68 0.12 0.18 2.29 2.35 -1.83 -2.88 115.58 123.50 2fxl h ASN 92 Ca -0.37 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2fxl h ASN 92 Cb 1.17 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.51 2fxl h ASN 92 CO 0.60 0.33 -0.26 0.00 -1.65 0.00 0.00 177.43 176.44 2fxl n HIS 93 N -4.26 0.00 -3.47 1.19 1.44 -1.26 -4.79 115.22 104.07 2fxl n HIS 93 Ca -0.01 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.30 2fxl n HIS 93 Cb 0.29 -0.10 -0.10 0.00 0.12 0.00 0.00 29.99 30.20 2fxl n HIS 93 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2fxl s ILE 94 N -2.46 5.23 -0.37 0.61 -1.09 -1.09 -0.32 121.20 121.71 2fxl s ILE 94 Ca 0.25 0.25 0.06 0.00 -2.23 0.00 0.00 60.65 58.97 2fxl s ILE 94 Cb 0.19 -3.67 -0.03 0.00 -1.58 0.00 0.00 42.46 37.37 2fxl s ILE 94 CO 0.51 0.12 0.33 1.41 -1.23 0.00 0.00 174.94 176.09 2fxl n HIS 95 N 5.23 0.00 -3.82 3.97 8.25 -0.39 -4.53 115.22 123.93 2fxl n HIS 95 Ca -0.11 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.23 2fxl n HIS 95 Cb 0.51 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.50 2fxl n HIS 95 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2fxl s ALA 96 N -1.29 -0.42 -0.04 -1.41 0.00 -0.96 -0.61 121.76 117.03 2fxl s ALA 96 Ca 0.03 0.37 0.04 0.00 0.00 0.00 0.00 51.96 52.40 2fxl s ALA 96 Cb 0.04 -0.20 -0.00 0.00 0.00 0.00 0.00 23.12 22.96 2fxl s ALA 96 CO 0.19 -0.11 -0.15 0.00 0.00 0.00 0.00 175.76 175.68 2fxl s ALA 97 N -0.24 1.38 -0.21 0.00 0.00 0.93 -1.07 121.76 122.55 2fxl s ALA 97 Ca -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.32 2fxl s ALA 97 Cb -0.03 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.66 2fxl s ALA 97 CO 0.01 0.25 -0.14 -1.01 0.00 0.00 0.00 175.76 174.87 2fxl s HIS 98 N 0.05 2.94 -0.17 0.00 3.76 0.62 -0.13 115.29 122.35 2fxl s HIS 98 Ca -0.03 -1.67 0.00 0.00 -0.15 0.00 0.00 55.06 53.21 2fxl s HIS 98 Cb -0.11 -1.97 0.01 0.00 1.11 0.00 0.00 32.58 31.62 2fxl s HIS 98 CO 0.02 -0.78 -0.16 0.08 -0.85 0.00 0.00 174.74 173.05 2fxl s VAL 99 N 1.29 2.45 -0.10 -0.90 1.01 0.03 -0.88 120.40 123.29 2fxl s VAL 99 Ca 0.02 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2fxl s VAL 99 Cb -0.15 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 2fxl s VAL 99 CO -0.09 0.51 -0.12 0.21 0.00 0.00 0.00 175.10 175.61 2fxl s ASN 100 N 1.13 4.13 -0.05 3.32 3.84 0.94 -0.34 114.94 127.92 2fxl s ASN 100 Ca 0.01 -0.24 0.03 0.00 0.21 0.00 0.00 52.86 52.86 2fxl s ASN 100 Cb -0.14 -1.33 0.01 0.00 -0.55 0.00 0.00 41.25 39.23 2fxl s ASN 100 CO -0.06 0.24 -0.12 -0.63 -2.79 0.00 0.00 177.10 173.74 2fxl s ILE 101 N -0.11 1.10 -0.22 -5.21 1.01 -0.60 -0.81 121.20 116.35 2fxl s ILE 101 Ca -0.01 -0.50 -0.06 0.00 0.00 0.00 0.00 60.65 60.09 2fxl s ILE 101 Cb -0.14 -0.98 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 2fxl s ILE 101 CO 0.03 0.34 0.02 -0.69 0.00 0.00 0.00 174.94 174.64 2fxl s VAL 102 N 0.40 3.95 -0.25 2.92 1.01 -0.04 -1.35 120.40 127.03 2fxl s VAL 102 Ca -0.09 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.46 2fxl s VAL 102 Cb -0.13 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 2fxl s VAL 102 CO 0.02 0.39 0.27 0.00 0.00 0.00 0.00 175.10 175.79 2fxl s HIS 104 N 1.49 3.61 -0.08 0.00 3.76 -0.43 -2.89 115.29 120.76 2fxl s HIS 104 Ca 0.12 0.74 -0.30 0.00 -0.15 0.00 0.00 55.06 55.47 2fxl s HIS 104 Cb -0.15 -2.11 -0.02 0.00 1.11 0.00 0.00 32.58 31.41 2fxl s HIS 104 CO 0.08 0.59 1.06 1.03 -0.85 0.00 0.00 174.74 176.65 2fxl s ARG 105 N -1.61 4.42 -0.41 1.40 0.52 -1.26 -4.49 118.95 117.52 2fxl s ARG 105 Ca 0.28 1.48 0.02 0.00 -0.52 0.00 0.00 55.73 56.98 2fxl s ARG 105 Cb -0.14 -3.53 0.13 0.00 0.52 0.00 0.00 34.95 31.92 2fxl s ARG 105 CO 0.15 -0.32 0.20 -1.58 0.02 0.00 0.00 175.30 173.77 2fxl s TRP 106 N 1.93 2.06 -0.05 -0.53 0.23 -1.26 -4.25 118.94 117.08 2fxl s TRP 106 Ca 0.51 -2.34 -0.18 0.00 -2.03 0.00 0.00 56.10 52.05 2fxl s TRP 106 Cb -0.21 -1.94 -0.05 0.00 0.03 0.00 0.00 33.47 31.30 2fxl s TRP 106 CO 0.20 -0.81 0.50 0.99 0.96 0.00 0.00 176.95 178.79 2fxl s THR 107 N 0.62 5.05 0.29 2.01 2.01 0.43 -4.79 115.64 121.25 2fxl s THR 107 Ca 0.16 1.02 -0.30 0.00 0.31 0.00 0.00 61.69 62.88 2fxl s THR 107 Cb -0.23 -3.83 -0.12 0.00 0.01 0.00 0.00 72.50 68.34 2fxl s THR 107 CO -0.05 0.42 1.63 -1.14 -0.69 0.00 0.00 174.62 174.79 2fxl n ARG 108 N 2.89 2.76 -2.50 4.92 0.63 -1.26 -0.59 116.66 123.50 2fxl n ARG 108 Ca -0.09 0.98 -0.37 0.00 -0.92 0.00 0.00 57.85 57.45 2fxl n ARG 108 Cb 0.52 -2.78 -0.04 0.00 0.45 0.00 0.00 32.46 30.60 2fxl n ARG 108 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 2fxl s MET 109 N -0.28 4.23 -0.24 -0.14 -1.94 0.07 -4.81 119.30 116.18 2fxl s MET 109 Ca 0.65 1.60 -0.07 0.00 -1.71 0.00 0.00 55.69 56.16 2fxl s MET 109 Cb -0.49 -2.66 -0.03 0.00 2.01 0.00 0.00 34.83 33.66 2fxl s MET 109 CO 0.46 -0.11 0.07 -0.51 -0.01 0.00 0.00 175.02 174.93 2fxl s ASP 110 N -1.40 5.25 -0.20 3.03 -0.00 -1.26 -0.05 116.67 122.04 2fxl s ASP 110 Ca 0.56 -0.15 -0.02 0.00 -0.00 0.00 0.00 52.55 52.94 2fxl s ASP 110 Cb -0.25 -1.94 0.00 0.00 -0.00 0.00 0.00 42.92 40.74 2fxl s ASP 110 CO 0.31 0.00 -0.10 -0.63 -0.00 0.00 0.00 175.17 174.75 2fxl s ILE 111 N 1.39 2.93 -1.36 0.77 -1.09 0.44 -4.63 121.20 119.65 2fxl s ILE 111 Ca 0.05 -0.65 -0.07 0.00 -2.23 0.00 0.00 60.65 57.75 2fxl s ILE 111 Cb -0.15 -2.30 0.02 0.00 -1.58 0.00 0.00 42.46 38.46 2fxl s ILE 111 CO 0.04 0.47 1.06 0.47 -1.23 0.00 0.00 174.94 175.75 2fxl n ASP 112 N 4.63 -4.67 0.00 3.58 8.00 -1.26 -1.58 116.55 125.26 2fxl n ASP 112 Ca -0.19 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 54.68 2fxl n ASP 112 Cb 0.51 -4.72 0.00 0.00 -0.02 0.00 0.00 41.12 36.88 2fxl n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2fxl n GLY 113 N -1.73 1.02 3.67 0.44 0.00 -1.26 -4.96 105.19 102.38 2fxl n GLY 113 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 2fxl n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fxl s LYS 114 N -0.13 4.07 0.20 1.61 -2.85 -0.61 -5.03 119.74 116.99 2fxl s LYS 114 Ca 0.00 -0.29 -0.32 0.00 -1.00 0.00 0.00 55.97 54.37 2fxl s LYS 114 Cb 0.00 -3.35 -0.11 0.00 -2.06 0.00 0.00 37.83 32.31 2fxl s LYS 114 CO 0.00 0.24 1.67 -2.14 0.10 0.00 0.00 175.35 175.22 2fxl s PRO 115 N 0.50 4.15 0.25 1.78 0.02 -1.26 -0.42 135.00 140.02 2fxl s PRO 115 Ca 0.06 2.53 -0.30 0.00 0.02 0.00 0.00 61.00 63.31 2fxl s PRO 115 Cb -0.12 -3.10 -0.09 0.00 0.02 0.00 0.00 34.50 31.21 2fxl s PRO 115 CO -0.00 -0.70 0.98 -1.58 -0.33 0.00 0.00 177.00 175.37 2fxl s HIS 116 N 1.11 3.89 0.35 6.54 2.46 0.92 -4.89 115.29 125.68 2fxl s HIS 116 Ca 0.73 1.87 0.30 0.00 0.47 0.00 0.00 55.06 58.42 2fxl s HIS 116 Cb -0.48 -3.05 1.47 0.00 -0.13 0.00 0.00 32.58 30.39 2fxl s HIS 116 CO 0.32 0.21 2.06 -1.00 -2.47 0.00 0.00 174.74 173.87 2fxl h PRO 117 N 4.10 0.00 0.00 2.88 0.13 -1.91 -3.38 132.00 133.82 2fxl h PRO 117 Ca -0.45 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.60 2fxl h PRO 117 Cb 1.20 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 2fxl h PRO 117 CO 0.68 0.10 -0.45 -2.39 -0.23 0.00 0.00 178.00 175.71 2fxl n HIS 118 N -3.46 0.00 -5.02 1.56 1.44 -1.26 0.30 115.22 108.78 2fxl n HIS 118 Ca -0.01 -0.24 -0.28 0.00 -2.01 0.00 0.00 57.72 55.18 2fxl n HIS 118 Cb 0.26 0.13 -0.16 0.00 0.12 0.00 0.00 29.99 30.34 2fxl n HIS 118 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2fxl s SER 119 N -0.98 2.53 0.12 4.39 0.01 -1.26 -5.04 113.70 113.46 2fxl s SER 119 Ca 0.08 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 56.97 2fxl s SER 119 Cb 0.09 -0.58 -0.04 0.00 0.21 0.00 0.00 66.02 65.71 2fxl s SER 119 CO -0.04 0.21 -0.10 -0.36 0.41 0.00 0.00 173.24 173.36 2fxl s PHE 120 N -0.18 1.14 0.00 2.43 0.40 -1.26 -0.75 117.98 119.76 2fxl s PHE 120 Ca -0.00 -0.72 0.03 0.00 -0.60 0.00 0.00 56.93 55.64 2fxl s PHE 120 Cb -0.11 -0.61 -0.01 0.00 0.51 0.00 0.00 43.02 42.80 2fxl s PHE 120 CO 0.02 0.03 -0.10 -1.50 0.70 0.00 0.00 175.22 174.36 2fxl s ILE 121 N -2.89 0.77 -0.95 0.64 2.07 0.24 -4.84 121.20 116.24 2fxl s ILE 121 Ca 0.11 -0.50 -0.23 0.00 -1.41 0.00 0.00 60.65 58.62 2fxl s ILE 121 Cb -0.00 -0.66 0.06 0.00 0.13 0.00 0.00 42.46 41.99 2fxl s ILE 121 CO -0.00 0.16 1.34 -0.60 -1.91 0.00 0.00 174.94 173.93 2fxl s ARG 122 N -0.39 3.52 0.26 3.50 6.06 -1.26 -0.43 118.95 130.21 2fxl s ARG 122 Ca 0.03 -1.11 0.26 0.00 -2.50 0.00 0.00 55.73 52.41 2fxl s ARG 122 Cb -0.04 -5.07 0.76 0.00 0.06 0.00 0.00 34.95 30.66 2fxl s ARG 122 CO -0.00 -2.10 1.75 0.38 -2.50 0.00 0.00 175.30 172.82 2fxl h ASP 123 N 9.64 0.00 -5.00 -2.12 2.03 -1.92 -3.46 116.42 115.60 2fxl h ASP 123 Ca 0.10 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.40 2fxl h ASP 123 Cb 1.02 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 39.42 2fxl h ASP 123 CO 1.34 0.00 0.21 -0.55 -1.03 0.00 0.00 179.24 179.21 2fxl s SER 124 N -4.80 -0.49 0.00 4.15 0.15 -1.26 -5.04 113.70 106.40 2fxl s SER 124 Ca 0.09 -0.15 0.18 0.00 0.70 0.00 0.00 55.95 56.76 2fxl s SER 124 Cb 0.11 0.63 0.65 0.00 -1.71 0.00 0.00 66.02 65.70 2fxl s SER 124 CO 0.59 -1.06 1.48 -0.62 1.20 0.00 0.00 173.24 174.83 2fxl n GLU 125 N -0.40 1.68 -1.96 5.44 4.71 -1.26 -4.63 120.64 124.23 2fxl n GLU 125 Ca -0.14 -1.04 -0.40 0.00 -0.01 0.00 0.00 57.16 55.57 2fxl n GLU 125 Cb 0.64 -1.35 -0.00 0.00 -1.01 0.00 0.00 31.44 29.71 2fxl n GLU 125 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 2fxl s GLU 126 N -1.75 4.03 0.16 3.49 2.12 -1.24 -4.78 118.70 120.73 2fxl s GLU 126 Ca 0.29 2.31 0.10 0.00 0.36 0.00 0.00 54.97 58.03 2fxl s GLU 126 Cb 0.15 -2.85 -0.04 0.00 0.26 0.00 0.00 34.13 31.65 2fxl s GLU 126 CO 0.23 -0.50 -0.16 0.15 -0.54 0.00 0.00 175.26 174.43 2fxl s LYS 127 N -2.15 1.81 -0.18 4.30 -0.14 -0.22 -4.46 119.74 118.69 2fxl s LYS 127 Ca 0.55 -1.31 -0.04 0.00 -1.36 0.00 0.00 55.97 53.82 2fxl s LYS 127 Cb -0.41 -2.06 -0.02 0.00 -1.68 0.00 0.00 37.83 33.66 2fxl s LYS 127 CO 0.54 0.44 -0.04 0.50 -0.76 0.00 0.00 175.35 176.04 2fxl s ARG 128 N -2.54 3.55 0.22 1.68 3.52 -1.14 -1.91 118.95 122.32 2fxl s ARG 128 Ca 0.21 -0.57 0.09 0.00 -0.13 0.00 0.00 55.73 55.34 2fxl s ARG 128 Cb -0.09 -2.97 -0.05 0.00 -1.56 0.00 0.00 34.95 30.29 2fxl s ARG 128 CO 0.12 0.05 -0.17 -0.80 -0.81 0.00 0.00 175.30 173.69 2fxl s ASN 129 N 0.87 2.86 0.01 -2.12 0.01 -0.05 -0.34 114.94 116.18 2fxl s ASN 129 Ca -0.01 -0.99 -0.00 0.00 -0.71 0.00 0.00 52.86 51.15 2fxl s ASN 129 Cb -0.15 -0.18 -0.01 0.00 0.41 0.00 0.00 41.25 41.32 2fxl s ASN 129 CO 0.01 -0.09 -0.02 0.68 -1.51 0.00 0.00 177.10 176.18 2fxl s VAL 130 N -2.67 0.06 -0.16 1.60 -7.23 -0.46 -1.47 120.40 110.07 2fxl s VAL 130 Ca 0.23 -0.52 0.01 0.00 -1.81 0.00 0.00 61.98 59.90 2fxl s VAL 130 Cb -0.03 -0.15 0.01 0.00 0.56 0.00 0.00 36.38 36.77 2fxl s VAL 130 CO 0.09 -0.28 -0.19 -1.58 -0.31 0.00 0.00 175.10 172.82 2fxl s GLN 131 N -0.83 3.09 -0.13 4.82 0.74 0.12 -1.55 119.66 125.91 2fxl s GLN 131 Ca -0.09 -0.81 0.02 0.00 0.05 0.00 0.00 55.36 54.53 2fxl s GLN 131 Cb -0.06 -2.54 0.01 0.00 1.10 0.00 0.00 33.01 31.53 2fxl s GLN 131 CO -0.01 -0.05 -0.18 0.08 -0.55 0.00 0.00 175.29 174.58 2fxl s VAL 132 N 0.94 1.76 -0.22 1.34 1.01 0.54 -1.55 120.40 124.21 2fxl s VAL 132 Ca -0.04 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 2fxl s VAL 132 Cb -0.15 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 2fxl s VAL 132 CO -0.04 0.49 -0.05 -1.81 0.00 0.00 0.00 175.10 173.70 2fxl s ASP 133 N 1.00 4.27 -0.26 3.32 1.01 0.96 -0.79 116.67 126.18 2fxl s ASP 133 Ca -0.05 -0.41 -0.05 0.00 0.71 0.00 0.00 52.55 52.76 2fxl s ASP 133 Cb -0.15 -1.73 0.01 0.00 1.01 0.00 0.00 42.92 42.06 2fxl s ASP 133 CO -0.04 -0.02 0.01 -0.69 0.21 0.00 0.00 175.17 174.64 2fxl s VAL 134 N 1.47 3.53 -0.11 -1.27 1.01 0.81 -1.45 120.40 124.40 2fxl s VAL 134 Ca 0.06 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.34 2fxl s VAL 134 Cb -0.14 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.50 2fxl s VAL 134 CO -0.04 0.21 -0.12 -0.69 0.00 0.00 0.00 175.10 174.46 2fxl s VAL 135 N 1.45 1.34 -0.15 2.92 1.01 -0.72 -0.05 120.40 126.20 2fxl s VAL 135 Ca 0.03 -0.52 -0.38 0.00 0.00 0.00 0.00 61.98 61.11 2fxl s VAL 135 Cb -0.16 -1.26 -0.14 0.00 0.00 0.00 0.00 36.38 34.81 2fxl s VAL 135 CO -0.01 0.41 1.73 1.21 0.00 0.00 0.00 175.10 178.44 2fxl n GLU 136 N 4.50 1.51 -0.97 2.72 2.13 0.22 -1.40 120.64 129.35 2fxl n GLU 136 Ca -0.17 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.20 2fxl n GLU 136 Cb 0.51 -2.29 0.00 0.00 0.27 0.00 0.00 31.44 29.93 2fxl n GLU 136 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2fxl n GLY 137 N 4.02 0.55 0.04 8.31 0.00 -1.26 -4.81 105.19 112.04 2fxl n GLY 137 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2fxl n GLY 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fxl n LYS 138 N -2.15 0.73 0.00 1.61 4.76 -0.50 -5.14 118.16 117.47 2fxl n LYS 138 Ca 0.00 -0.83 0.00 0.00 -2.87 0.00 0.00 58.31 54.61 2fxl n LYS 138 Cb 0.06 -0.64 0.00 0.00 -1.84 0.00 0.00 35.03 32.61 2fxl n LYS 138 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2fxl n GLY 139 N -0.16 -0.35 2.82 0.72 0.00 -0.99 -4.82 105.19 102.41 2fxl n GLY 139 Ca 0.00 -1.14 -0.25 0.00 0.00 0.00 0.00 46.02 44.63 2fxl n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fxl s ILE 140 N 0.00 0.62 -0.20 -0.61 1.01 -0.22 -1.76 121.20 120.04 2fxl s ILE 140 Ca 0.00 -0.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 2fxl s ILE 140 Cb 0.00 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 2fxl s ILE 140 CO 0.00 0.26 0.02 -1.81 0.00 0.00 0.00 174.94 173.41 2fxl s ASP 141 N 1.87 5.01 -0.11 3.58 1.01 -0.53 -1.25 116.67 126.25 2fxl s ASP 141 Ca 0.04 -0.15 0.02 0.00 0.71 0.00 0.00 52.55 53.17 2fxl s ASP 141 Cb -0.13 -1.86 0.01 0.00 1.01 0.00 0.00 42.92 41.96 2fxl s ASP 141 CO -0.06 0.07 -0.16 -0.63 0.21 0.00 0.00 175.17 174.60 2fxl s ILE 142 N 0.96 1.56 -0.22 0.77 1.01 -1.26 -0.03 121.20 123.99 2fxl s ILE 142 Ca 0.02 -0.68 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 2fxl s ILE 142 Cb -0.14 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 2fxl s ILE 142 CO 0.02 0.45 -0.05 -0.54 0.00 0.00 0.00 174.94 174.83 2fxl s LYS 143 N 0.95 3.38 0.02 2.79 1.02 -0.60 -0.92 119.74 126.38 2fxl s LYS 143 Ca -0.07 -0.62 0.01 0.00 0.02 0.00 0.00 55.97 55.30 2fxl s LYS 143 Cb -0.15 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.13 2fxl s LYS 143 CO -0.01 -0.17 0.07 -1.12 -0.92 0.00 0.00 175.35 173.20 2fxl s SER 144 N 1.41 5.57 0.17 2.83 0.01 -0.55 0.11 113.70 123.25 2fxl s SER 144 Ca 0.05 0.08 -0.17 0.00 1.31 0.00 0.00 55.95 57.22 2fxl s SER 144 Cb -0.14 -1.55 0.03 0.00 0.21 0.00 0.00 66.02 64.57 2fxl s SER 144 CO -0.03 0.24 0.49 -0.94 0.41 0.00 0.00 173.24 173.41 2fxl s SER 145 N -1.90 -0.27 0.09 2.44 1.04 -0.54 -0.35 113.70 114.20 2fxl s SER 145 Ca 0.24 -0.40 0.10 0.00 0.48 0.00 0.00 55.95 56.37 2fxl s SER 145 Cb -0.12 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 2fxl s SER 145 CO 0.16 -0.98 -0.25 -1.48 0.98 0.00 0.00 173.24 171.66 2fxl s LEU 146 N -2.85 2.26 0.07 2.42 0.05 -0.36 -0.87 118.68 119.40 2fxl s LEU 146 Ca 0.07 -0.67 -0.13 0.00 0.05 0.00 0.00 54.13 53.45 2fxl s LEU 146 Cb -0.00 -1.16 0.02 0.00 -2.05 0.00 0.00 46.19 43.00 2fxl s LEU 146 CO -0.06 0.18 0.30 -0.94 -0.55 0.00 0.00 176.35 175.28 2fxl s SER 147 N -1.70 -0.09 -0.74 1.48 1.04 -0.80 -1.40 113.70 111.49 2fxl s SER 147 Ca 0.11 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2fxl s SER 147 Cb -0.10 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.40 2fxl s SER 147 CO 0.04 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.18 2fxl n GLY 148 N 0.25 0.78 3.46 7.32 0.00 -1.11 -1.06 105.19 114.84 2fxl n GLY 148 Ca -0.17 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.71 2fxl n GLY 148 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2fxl s LEU 149 N -1.71 4.74 -0.22 0.99 2.96 -1.22 -3.71 118.68 120.51 2fxl s LEU 149 Ca 0.00 -0.80 -0.08 0.00 -0.22 0.00 0.00 54.13 53.02 2fxl s LEU 149 Cb 0.00 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 44.11 2fxl s LEU 149 CO 0.00 -1.02 0.10 -0.89 -1.32 0.00 0.00 176.35 173.21 2fxl s THR 150 N 3.05 4.87 0.10 3.68 2.01 -1.26 -0.33 115.64 127.76 2fxl s THR 150 Ca 0.19 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.22 2fxl s THR 150 Cb -0.18 -3.24 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 2fxl s THR 150 CO 0.13 0.39 -0.07 0.68 -0.69 0.00 0.00 174.62 175.07 2fxl s VAL 151 N 0.89 0.75 -0.14 3.82 -7.23 -0.48 -5.02 120.40 112.99 2fxl s VAL 151 Ca 0.05 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.16 2fxl s VAL 151 Cb -0.13 -1.71 0.04 0.00 0.56 0.00 0.00 36.38 35.14 2fxl s VAL 151 CO 0.03 -0.86 0.36 -0.22 -0.31 0.00 0.00 175.10 174.10 2fxl s LEU 152 N -3.06 0.42 0.01 1.32 0.20 -1.26 -1.72 118.68 114.59 2fxl s LEU 152 Ca 0.12 0.75 0.08 0.00 0.69 0.00 0.00 54.13 55.78 2fxl s LEU 152 Cb 0.05 1.23 -0.02 0.00 -0.43 0.00 0.00 46.19 47.01 2fxl s LEU 152 CO -0.04 -0.15 -0.25 -1.59 -0.29 0.00 0.00 176.35 174.04 2fxl s LYS 153 N 0.58 1.85 0.00 1.98 -2.85 0.20 -5.01 119.74 116.48 2fxl s LYS 153 Ca -0.03 -0.96 0.23 0.00 -1.00 0.00 0.00 55.97 54.21 2fxl s LYS 153 Cb -0.05 -1.89 0.13 0.00 -2.06 0.00 0.00 37.83 33.96 2fxl s LYS 153 CO -0.03 0.50 1.14 -1.13 0.10 0.00 0.00 175.35 175.93 2fxl n SER 154 N 2.17 0.73 -1.75 0.03 3.41 -1.26 -1.71 113.62 115.24 2fxl n SER 154 Ca -0.16 -0.59 -0.05 0.00 -0.26 0.00 0.00 58.87 57.81 2fxl n SER 154 Cb 0.52 0.65 -0.00 0.00 -0.26 0.00 0.00 64.21 65.11 2fxl n SER 154 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2fxl n THR 155 N -1.54 0.00 -3.54 6.66 5.66 -1.26 -4.39 114.28 115.87 2fxl n THR 155 Ca 0.04 -0.58 -0.22 0.00 -3.05 0.00 0.00 64.05 60.24 2fxl n THR 155 Cb 0.34 0.41 0.08 0.00 -1.55 0.00 0.00 70.33 69.61 2fxl n THR 155 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2fxl n ASN 156 N -1.67 -5.61 -3.99 1.09 5.03 -1.26 -4.87 115.26 103.98 2fxl n ASN 156 Ca -0.01 -0.54 -0.18 0.00 0.87 0.00 0.00 54.58 54.72 2fxl n ASN 156 Cb 0.23 -4.92 -0.15 0.00 -1.02 0.00 0.00 39.78 33.92 2fxl n ASN 156 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2fxl s SER 157 N -3.47 0.94 0.13 6.41 0.15 -1.25 -2.55 113.70 114.07 2fxl s SER 157 Ca 0.48 -0.14 0.05 0.00 0.70 0.00 0.00 55.95 57.03 2fxl s SER 157 Cb -0.21 -0.16 -0.04 0.00 -1.71 0.00 0.00 66.02 63.90 2fxl s SER 157 CO 0.71 0.08 -0.11 -1.10 1.20 0.00 0.00 173.24 174.02 2fxl s GLN 158 N -0.03 1.00 -0.33 5.44 -0.21 -0.16 -0.83 119.66 124.54 2fxl s GLN 158 Ca 0.01 -1.33 0.07 0.00 0.02 0.00 0.00 55.36 54.12 2fxl s GLN 158 Cb -0.05 -0.65 0.19 0.00 1.00 0.00 0.00 33.01 33.50 2fxl s GLN 158 CO -0.00 0.10 0.60 0.12 -2.12 0.00 0.00 175.29 173.99 2fxl s PHE 159 N -2.86 -1.81 0.17 0.91 5.36 -0.75 -3.77 117.98 115.22 2fxl s PHE 159 Ca 0.12 0.78 -0.01 0.00 -0.96 0.00 0.00 56.93 56.86 2fxl s PHE 159 Cb -0.00 0.31 -0.04 0.00 -0.34 0.00 0.00 43.02 42.95 2fxl s PHE 159 CO 0.01 -1.12 0.10 1.67 -1.46 0.00 0.00 175.22 174.42 2fxl s TRP 160 N 2.47 1.01 0.00 10.12 1.48 -1.25 -1.79 118.94 130.97 2fxl s TRP 160 Ca 0.12 -1.30 0.00 0.00 -1.06 0.00 0.00 56.10 53.86 2fxl s TRP 160 Cb -0.08 -0.51 0.00 0.00 -1.16 0.00 0.00 33.47 31.72 2fxl s TRP 160 CO -0.19 -0.59 0.00 0.41 -4.06 0.00 0.00 176.95 172.52 2fxl n GLY 161 N -0.19 0.65 3.89 3.67 0.00 -1.26 -5.04 105.19 106.92 2fxl n GLY 161 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2fxl n GLY 161 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2fxl s PHE 162 N -2.33 3.19 0.30 1.61 -0.71 -1.26 -5.00 117.98 113.78 2fxl s PHE 162 Ca 0.00 0.90 -0.30 0.00 -1.04 0.00 0.00 56.93 56.50 2fxl s PHE 162 Cb 0.00 -3.17 -0.12 0.00 -1.21 0.00 0.00 43.02 38.52 2fxl s PHE 162 CO 0.00 -1.33 1.59 -0.11 -1.34 0.00 0.00 175.22 174.03 2fxl n LEU 163 N -3.06 4.38 -3.95 -1.99 0.00 -1.26 -5.01 117.00 106.11 2fxl n LEU 163 Ca 0.07 1.15 -0.27 0.00 0.00 0.00 0.00 56.01 56.97 2fxl n LEU 163 Cb 0.58 -1.59 -0.17 0.00 0.00 0.00 0.00 43.42 42.24 2fxl n LEU 163 CO 0.57 0.15 -0.45 -0.13 0.00 0.00 0.00 177.39 177.52 2fxl s ARG 164 N -0.64 1.68 0.00 1.96 0.52 -1.26 -4.96 118.95 116.26 2fxl s ARG 164 Ca 0.63 -0.33 0.00 0.00 -0.52 0.00 0.00 55.73 55.51 2fxl s ARG 164 Cb -0.50 -1.62 0.00 0.00 0.52 0.00 0.00 34.95 33.35 2fxl s ARG 164 CO 0.50 -0.20 0.00 -0.40 0.02 0.00 0.00 175.30 175.22 2fxl n ASP 165 N 4.67 0.00 0.00 0.23 5.68 -1.26 -5.03 116.55 120.84 2fxl n ASP 165 Ca -0.15 -0.35 0.10 0.00 -0.50 0.00 0.00 54.79 53.89 2fxl n ASP 165 Cb 0.50 0.00 0.62 0.00 -1.14 0.00 0.00 41.12 41.10 2fxl n ASP 165 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 2fxl n GLU 166 N 0.00 0.92 0.00 0.11 0.00 -1.26 -1.97 120.64 118.44 2fxl n GLU 166 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.25 2fxl n GLU 166 Cb 0.00 -1.35 0.06 0.00 0.00 0.00 0.00 31.44 30.15 2fxl n GLU 166 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2fxl n TYR 167 N -0.85 0.00 -3.49 -1.84 4.01 -1.26 -4.97 117.16 108.75 2fxl n TYR 167 Ca 0.16 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.53 2fxl n TYR 167 Cb 0.07 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.03 2fxl n TYR 167 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2fxl s THR 168 N -1.70 5.28 0.00 -0.72 2.01 -0.83 -4.91 115.64 114.77 2fxl s THR 168 Ca 0.21 0.60 0.00 0.00 0.31 0.00 0.00 61.69 62.81 2fxl s THR 168 Cb 0.16 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 69.00 2fxl s THR 168 CO 0.29 0.36 0.00 0.35 -0.69 0.00 0.00 174.62 174.92 2fxl n THR 169 N 3.73 0.00 -1.73 -0.82 -2.24 -1.26 -4.86 114.28 107.10 2fxl n THR 169 Ca -0.11 -0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 2fxl n THR 169 Cb 0.52 0.55 -0.03 0.00 -2.10 0.00 0.00 70.33 69.27 2fxl n THR 169 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2fxl s LEU 170 N -2.43 4.37 0.17 3.22 2.96 -1.26 -4.99 118.68 120.72 2fxl s LEU 170 Ca 0.00 2.87 -0.24 0.00 -0.22 0.00 0.00 54.13 56.53 2fxl s LEU 170 Cb 0.00 -3.60 -0.08 0.00 0.50 0.00 0.00 46.19 43.01 2fxl s LEU 170 CO 0.00 -0.98 0.76 -0.54 -1.32 0.00 0.00 176.35 174.28 2fxl s LYS 171 N 1.25 4.52 0.54 1.98 -0.14 -1.26 -5.04 119.74 121.58 2fxl s LYS 171 Ca 0.75 1.11 -0.22 0.00 -1.36 0.00 0.00 55.97 56.26 2fxl s LYS 171 Cb -0.50 -3.22 -0.05 0.00 -1.68 0.00 0.00 37.83 32.39 2fxl s LYS 171 CO 0.32 0.55 1.35 -1.21 -0.76 0.00 0.00 175.35 175.60 2fxl s GLU 172 N -1.24 3.20 0.01 1.68 2.02 -1.26 -4.99 118.70 118.12 2fxl s GLU 172 Ca 0.36 2.21 -0.04 0.00 0.02 0.00 0.00 54.97 57.52 2fxl s GLU 172 Cb -0.22 -2.28 -0.01 0.00 0.10 0.00 0.00 34.13 31.72 2fxl s GLU 172 CO 0.25 -1.13 0.07 -0.08 0.02 0.00 0.00 175.26 174.39 2fxl s THR 173 N -1.31 0.10 -0.40 3.63 -1.32 -0.74 -5.00 115.64 110.59 2fxl s THR 173 Ca 0.71 -0.82 0.06 0.00 -1.21 0.00 0.00 61.69 60.43 2fxl s THR 173 Cb -0.40 -0.41 0.16 0.00 -1.51 0.00 0.00 72.50 70.35 2fxl s THR 173 CO 0.47 -0.45 1.13 0.79 -2.21 0.00 0.00 174.62 174.35 2fxl n TRP 174 N 1.44 0.23 -3.23 9.09 8.01 -1.26 -1.82 117.44 129.91 2fxl n TRP 174 Ca -0.23 -0.53 0.03 0.00 -1.31 0.00 0.00 57.50 55.46 2fxl n TRP 174 Cb 0.56 -0.05 -0.02 0.00 -2.01 0.00 0.00 31.31 29.78 2fxl n TRP 174 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 2fxl s ASP 175 N -1.11 -1.12 0.21 -0.99 2.15 -1.23 -4.70 116.67 109.88 2fxl s ASP 175 Ca 0.13 0.84 -0.08 0.00 0.43 0.00 0.00 52.55 53.87 2fxl s ASP 175 Cb 0.08 1.99 -0.02 0.00 -0.30 0.00 0.00 42.92 44.67 2fxl s ASP 175 CO 0.07 -0.21 0.31 0.00 -0.17 0.00 0.00 175.17 175.17 2fxl s ARG 176 N 2.86 1.32 0.28 4.34 1.70 -0.01 -4.99 118.95 124.45 2fxl s ARG 176 Ca 0.12 -1.35 -0.25 0.00 -0.47 0.00 0.00 55.73 53.77 2fxl s ARG 176 Cb -0.13 0.38 -0.09 0.00 -0.57 0.00 0.00 34.95 34.53 2fxl s ARG 176 CO -0.18 -0.50 0.89 0.42 -1.08 0.00 0.00 175.30 174.85 2fxl s ILE 177 N -4.05 4.26 -0.10 4.99 1.01 -1.26 -3.80 121.20 122.25 2fxl s ILE 177 Ca 0.26 1.76 -0.00 0.00 0.00 0.00 0.00 60.65 62.68 2fxl s ILE 177 Cb 0.03 -4.04 0.02 0.00 0.01 0.00 0.00 42.46 38.48 2fxl s ILE 177 CO 0.07 0.23 -0.07 -0.22 0.00 0.00 0.00 174.94 174.96 2fxl s LEU 178 N -1.85 1.14 0.00 2.97 2.96 -0.70 -4.84 118.68 118.37 2fxl s LEU 178 Ca 0.47 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 2fxl s LEU 178 Cb -0.20 -0.75 -0.01 0.00 0.50 0.00 0.00 46.19 45.74 2fxl s LEU 178 CO 0.25 -0.11 -0.07 -0.55 -1.32 0.00 0.00 176.35 174.54 2fxl s SER 179 N 1.60 0.86 0.21 3.68 0.15 -1.26 -0.63 113.70 118.31 2fxl s SER 179 Ca 0.02 -0.19 -0.13 0.00 0.70 0.00 0.00 55.95 56.35 2fxl s SER 179 Cb -0.13 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.11 2fxl s SER 179 CO -0.06 0.05 0.44 0.28 1.20 0.00 0.00 173.24 175.15 2fxl s THR 180 N -0.33 0.03 -0.30 6.45 -1.32 -0.70 -1.48 115.64 117.99 2fxl s THR 180 Ca 0.01 -1.21 -0.04 0.00 -1.21 0.00 0.00 61.69 59.24 2fxl s THR 180 Cb -0.04 -1.91 0.04 0.00 -1.51 0.00 0.00 72.50 69.08 2fxl s THR 180 CO -0.00 -0.12 0.03 -1.81 -2.21 0.00 0.00 174.62 170.50 2fxl s ASP 181 N -2.96 4.92 -0.06 8.08 1.01 -1.26 -1.38 116.67 125.02 2fxl s ASP 181 Ca 0.17 -1.06 -0.30 0.00 0.71 0.00 0.00 52.55 52.07 2fxl s ASP 181 Cb 0.00 -1.77 -0.02 0.00 1.01 0.00 0.00 42.92 42.14 2fxl s ASP 181 CO 0.03 -0.24 1.03 -0.69 0.21 0.00 0.00 175.17 175.51 2fxl s VAL 182 N 1.35 4.71 -0.25 -1.27 1.01 0.56 -4.31 120.40 122.19 2fxl s VAL 182 Ca -0.02 1.96 0.02 0.00 0.00 0.00 0.00 61.98 63.94 2fxl s VAL 182 Cb -0.19 -4.26 0.05 0.00 0.00 0.00 0.00 36.38 31.98 2fxl s VAL 182 CO -0.00 0.06 -0.11 -0.62 0.00 0.00 0.00 175.10 174.42 2fxl s ASP 183 N 1.11 4.25 -0.06 3.32 -1.08 -1.12 -2.73 116.67 120.36 2fxl s ASP 183 Ca 0.51 -1.23 0.02 0.00 -0.52 0.00 0.00 52.55 51.33 2fxl s ASP 183 Cb -0.21 -1.56 0.01 0.00 -1.46 0.00 0.00 42.92 39.71 2fxl s ASP 183 CO 0.22 -0.16 -0.11 0.00 0.52 0.00 0.00 175.17 175.64 2fxl s ALA 184 N 1.16 1.17 -0.06 3.66 0.00 -0.49 -1.01 121.76 126.18 2fxl s ALA 184 Ca -0.06 -0.37 0.05 0.00 0.00 0.00 0.00 51.96 51.58 2fxl s ALA 184 Cb -0.19 -0.53 -0.00 0.00 0.00 0.00 0.00 23.12 22.40 2fxl s ALA 184 CO -0.06 0.11 -0.21 0.99 0.00 0.00 0.00 175.76 176.59 2fxl s THR 185 N 0.65 1.77 -0.10 0.00 2.01 -0.06 -1.23 115.64 118.68 2fxl s THR 185 Ca -0.13 -0.89 0.04 0.00 0.31 0.00 0.00 61.69 61.01 2fxl s THR 185 Cb -0.15 -1.51 -0.00 0.00 0.01 0.00 0.00 72.50 70.84 2fxl s THR 185 CO 0.03 0.50 -0.22 -1.66 -0.69 0.00 0.00 174.62 172.57 2fxl s TRP 186 N 0.09 2.58 -0.24 4.92 -2.14 0.52 -0.08 118.94 124.59 2fxl s TRP 186 Ca -0.08 -0.92 -0.08 0.00 2.66 0.00 0.00 56.10 57.67 2fxl s TRP 186 Cb -0.14 -1.71 -0.04 0.00 -3.10 0.00 0.00 33.47 28.48 2fxl s TRP 186 CO 0.04 -0.35 0.11 -1.14 -2.66 0.00 0.00 176.95 172.95 2fxl s GLN 187 N 0.24 3.83 0.47 3.25 0.74 -0.30 -1.48 119.66 126.42 2fxl s GLN 187 Ca -0.15 -0.39 -0.18 0.00 0.05 0.00 0.00 55.36 54.69 2fxl s GLN 187 Cb -0.17 -3.40 -0.09 0.00 1.10 0.00 0.00 33.01 30.45 2fxl s GLN 187 CO 0.08 -0.07 0.95 -1.58 -0.55 0.00 0.00 175.29 174.12 2fxl s TRP 188 N 1.34 3.40 0.54 1.67 0.52 -0.10 -1.14 118.94 125.17 2fxl s TRP 188 Ca 0.06 1.50 -0.21 0.00 0.02 0.00 0.00 56.10 57.47 2fxl s TRP 188 Cb -0.15 -2.79 -0.06 0.00 -1.15 0.00 0.00 33.47 29.32 2fxl s TRP 188 CO 0.05 -0.24 1.05 1.17 0.02 0.00 0.00 176.95 178.99 2fxl n LYS 189 N -1.17 1.19 -1.63 4.98 4.81 0.41 -4.62 118.16 122.13 2fxl n LYS 189 Ca 0.06 0.44 -0.45 0.00 -0.87 0.00 0.00 58.31 57.49 2fxl n LYS 189 Cb 0.54 -2.21 -0.02 0.00 0.02 0.00 0.00 35.03 33.36 2fxl n LYS 189 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2fxl n ASN 190 N -0.43 1.96 -4.76 3.14 2.85 -1.26 -4.82 115.26 111.94 2fxl n ASN 190 Ca 0.12 1.16 -0.34 0.00 -0.11 0.00 0.00 54.58 55.41 2fxl n ASN 190 Cb 0.45 -1.34 -0.08 0.00 1.24 0.00 0.00 39.78 40.05 2fxl n ASN 190 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 2fxl s PHE 191 N -0.52 3.25 0.04 1.20 0.08 -0.38 -4.97 117.98 116.68 2fxl s PHE 191 Ca 0.65 0.21 0.25 0.00 0.12 0.00 0.00 56.93 58.16 2fxl s PHE 191 Cb -0.71 -1.75 0.88 0.00 -0.57 0.00 0.00 43.02 40.87 2fxl s PHE 191 CO 0.55 0.54 1.80 0.66 -0.10 0.00 0.00 175.22 178.67 2fxl h SER 192 N 4.39 0.00 0.00 1.36 4.64 -1.94 -0.56 113.55 121.44 2fxl h SER 192 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2fxl h SER 192 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2fxl h SER 192 CO 0.60 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 177.35 2fxl n GLY 193 N 0.32 -1.00 0.33 -0.77 0.00 -1.26 -4.47 105.19 98.34 2fxl n GLY 193 Ca 0.01 -0.98 -0.05 0.00 0.00 0.00 0.00 46.02 45.00 2fxl n GLY 193 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fxl h LEU 194 N 0.00 1.04 -0.70 0.99 3.38 -1.94 -1.90 115.31 116.18 2fxl h LEU 194 Ca 0.00 -0.13 0.07 0.00 0.09 0.00 0.00 57.88 57.91 2fxl h LEU 194 Cb 0.00 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.42 2fxl h LEU 194 CO 0.00 0.88 0.39 -0.61 0.09 0.00 0.00 178.44 179.19 2fxl h GLN 195 N 1.13 0.68 -0.36 1.13 4.15 -1.98 0.25 115.11 120.11 2fxl h GLN 195 Ca 0.28 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.59 2fxl h GLN 195 Cb 0.11 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 2fxl h GLN 195 CO -0.04 0.45 -0.04 1.49 -1.93 0.00 0.00 178.83 178.76 2fxl h GLU 196 N 0.70 0.67 -0.39 1.69 4.81 -1.80 -0.39 114.58 119.87 2fxl h GLU 196 Ca 0.32 -0.23 0.02 0.00 -0.13 0.00 0.00 59.36 59.34 2fxl h GLU 196 Cb 0.24 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 2fxl h GLU 196 CO -0.20 0.80 0.22 0.28 -0.73 0.00 0.00 179.01 179.37 2fxl h VAL 197 N 0.47 1.02 -0.05 0.32 2.07 -0.86 -1.60 116.25 117.62 2fxl h VAL 197 Ca 0.10 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.48 2fxl h VAL 197 Cb 0.53 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2fxl h VAL 197 CO 0.03 0.08 0.04 0.03 0.02 0.00 0.00 177.57 177.77 2fxl h ARG 198 N 0.44 0.00 0.00 1.57 3.08 -0.19 -1.47 114.38 117.81 2fxl h ARG 198 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2fxl h ARG 198 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 2fxl h ARG 198 CO -0.09 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.47 2fxl h SER 199 N 0.00 0.00 -0.53 7.04 4.64 -0.05 -3.10 113.55 121.56 2fxl h SER 199 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2fxl h SER 199 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2fxl h SER 199 CO -0.00 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.37 2fxl n HIS 200 N -2.88 0.70 -0.26 4.77 8.25 -0.57 -4.78 115.22 120.46 2fxl n HIS 200 Ca 0.02 -0.50 0.07 0.00 -0.26 0.00 0.00 57.72 57.04 2fxl n HIS 200 Cb 0.33 -0.01 0.20 0.00 1.12 0.00 0.00 29.99 31.62 2fxl n HIS 200 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2fxl h VAL 201 N 3.09 0.57 -0.02 1.59 2.07 -1.45 -0.27 116.25 121.83 2fxl h VAL 201 Ca 0.00 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.40 2fxl h VAL 201 Cb 0.85 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 2fxl h VAL 201 CO 0.00 0.07 0.02 -0.65 0.02 0.00 0.00 177.57 177.03 2fxl h PRO 202 N 0.37 0.00 0.00 1.57 0.11 -1.88 -2.25 132.00 129.92 2fxl h PRO 202 Ca 0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.54 2fxl h PRO 202 Cb 0.72 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.83 2fxl h PRO 202 CO -0.47 0.00 -0.01 0.87 -0.21 0.00 0.00 178.00 178.18 2fxl h LYS 203 N 0.00 0.00 -0.01 1.05 1.57 -1.42 -3.18 116.57 114.58 2fxl h LYS 203 Ca 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2fxl h LYS 203 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2fxl h LYS 203 CO -0.00 0.01 -0.04 0.74 -0.57 0.00 0.00 179.45 179.59 2fxl h PHE 204 N 0.00 0.06 -0.47 -1.35 0.04 -1.49 -1.10 116.94 112.63 2fxl h PHE 204 Ca -0.00 -0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.64 2fxl h PHE 204 Cb 0.50 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.63 2fxl h PHE 204 CO 0.00 0.67 -0.13 -0.44 -0.60 0.00 0.00 178.31 177.81 2fxl h ASP 205 N -0.57 0.86 -0.77 2.17 3.32 -1.75 -1.82 116.42 117.87 2fxl h ASP 205 Ca -0.00 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 56.74 2fxl h ASP 205 Cb 0.67 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.95 2fxl h ASP 205 CO 0.01 1.00 0.36 0.00 -1.72 0.00 0.00 179.24 178.88 2fxl h ALA 206 N 1.08 0.99 -0.15 3.45 0.00 -1.54 -1.54 119.26 121.56 2fxl h ALA 206 Ca 0.12 -0.16 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 2fxl h ALA 206 Cb 0.64 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 18.13 2fxl h ALA 206 CO 0.04 0.57 -0.76 1.15 0.00 0.00 0.00 179.25 180.25 2fxl h THR 207 N 1.09 1.29 -0.47 0.00 2.02 -1.08 -1.15 112.91 114.61 2fxl h THR 207 Ca 0.26 -1.98 0.06 0.00 0.77 0.00 0.00 66.41 65.52 2fxl h THR 207 Cb 0.13 1.98 -0.05 0.00 -1.74 0.00 0.00 68.15 68.47 2fxl h THR 207 CO -0.03 0.63 0.18 -0.25 0.37 0.00 0.00 175.52 176.41 2fxl h TRP 208 N 0.51 0.31 -0.93 3.16 7.01 -1.15 -0.02 115.95 124.85 2fxl h TRP 208 Ca -0.05 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.01 2fxl h TRP 208 Cb 1.38 -0.07 -0.05 0.00 -2.10 0.00 0.00 29.16 28.32 2fxl h TRP 208 CO 0.08 0.11 0.60 0.00 -2.79 0.00 0.00 178.44 176.45 2fxl h ALA 209 N 1.30 1.22 -0.21 2.65 0.00 -1.16 -1.12 119.26 121.94 2fxl h ALA 209 Ca 0.22 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2fxl h ALA 209 Cb 0.21 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2fxl h ALA 209 CO -0.22 0.49 -0.20 1.15 0.00 0.00 0.00 179.25 180.48 2fxl h THR 210 N 1.19 1.33 -0.97 0.00 2.02 -0.54 -0.85 112.91 115.08 2fxl h THR 210 Ca 0.36 -1.35 0.03 0.00 0.77 0.00 0.00 66.41 66.23 2fxl h THR 210 Cb -0.03 1.74 -0.06 0.00 -1.74 0.00 0.00 68.15 68.06 2fxl h THR 210 CO -0.11 0.41 0.63 0.00 0.37 0.00 0.00 175.52 176.83 2fxl h ALA 211 N 0.66 1.28 -0.09 6.16 0.00 -0.86 -0.10 119.26 126.30 2fxl h ALA 211 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2fxl h ALA 211 Cb 0.74 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2fxl h ALA 211 CO 0.05 0.53 0.01 -0.09 0.00 0.00 0.00 179.25 179.74 2fxl h ARG 212 N 1.23 0.15 -0.30 0.00 2.43 -1.04 -2.46 114.38 114.39 2fxl h ARG 212 Ca 0.38 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.50 2fxl h ARG 212 Cb -0.01 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 2fxl h ARG 212 CO -0.12 0.38 0.16 1.49 -1.51 0.00 0.00 179.97 180.37 2fxl h GLU 213 N -0.11 0.41 -0.80 0.20 4.81 -0.81 -1.18 114.58 117.11 2fxl h GLU 213 Ca 0.03 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2fxl h GLU 213 Cb 0.31 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.58 2fxl h GLU 213 CO 0.00 0.36 0.34 0.28 -0.73 0.00 0.00 179.01 179.27 2fxl h VAL 214 N 0.36 1.26 -0.04 0.32 2.07 -1.08 0.16 116.25 119.30 2fxl h VAL 214 Ca 0.10 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 2fxl h VAL 214 Cb 0.07 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2fxl h VAL 214 CO -0.02 0.32 0.02 0.74 0.02 0.00 0.00 177.57 178.66 2fxl h THR 215 N 1.15 1.04 0.01 2.57 2.02 -1.20 0.04 112.91 118.54 2fxl h THR 215 Ca 0.27 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.33 2fxl h THR 215 Cb 0.18 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2fxl h THR 215 CO -0.03 0.03 -0.01 -0.07 0.37 0.00 0.00 175.52 175.82 2fxl h LEU 216 N 0.02 -0.02 -0.59 2.58 -0.00 -0.89 -2.31 115.31 114.10 2fxl h LEU 216 Ca 0.01 -0.26 -0.14 0.00 -0.00 0.00 0.00 57.88 57.50 2fxl h LEU 216 Cb 0.04 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.69 2fxl h LEU 216 CO -0.00 0.25 -0.37 0.50 -0.00 0.00 0.00 178.44 178.82 2fxl h LYS 217 N -0.28 0.71 -0.53 1.13 3.64 -0.58 -1.60 116.57 119.07 2fxl h LYS 217 Ca -0.00 -0.35 -0.08 0.00 -1.27 0.00 0.00 60.65 58.95 2fxl h LYS 217 Cb 0.27 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 2fxl h LYS 217 CO 0.00 0.97 0.03 1.15 -2.27 0.00 0.00 179.45 179.33 2fxl h THR 218 N 0.59 1.26 -0.45 1.00 2.02 -1.03 -0.14 112.91 116.15 2fxl h THR 218 Ca 0.06 -1.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.18 2fxl h THR 218 Cb 0.90 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2fxl h THR 218 CO 0.08 0.38 0.28 0.15 0.37 0.00 0.00 175.52 176.78 2fxl h PHE 219 N 0.79 0.59 -0.14 3.16 3.57 -1.27 -0.47 116.94 123.17 2fxl h PHE 219 Ca 0.15 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.51 2fxl h PHE 219 Cb 0.49 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 2fxl h PHE 219 CO 0.04 0.40 -0.55 0.00 -2.23 0.00 0.00 178.31 175.97 2fxl h ALA 220 N 1.14 0.80 0.00 2.41 0.00 -1.06 -3.34 119.26 119.20 2fxl h ALA 220 Ca 0.16 -0.51 -0.16 0.00 0.00 0.00 0.00 54.91 54.41 2fxl h ALA 220 Cb -0.03 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2fxl h ALA 220 CO -0.03 0.69 -1.92 0.39 0.00 0.00 0.00 179.25 178.38 2fxl n GLU 221 N -3.94 0.66 -2.32 0.00 1.02 -0.09 -4.91 120.64 111.06 2fxl n GLU 221 Ca -0.03 -0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.68 2fxl n GLU 221 Cb 0.59 -1.61 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 2fxl n GLU 221 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2fxl s ASP 222 N -5.19 6.94 -1.10 1.62 2.15 -0.20 -4.90 116.67 115.99 2fxl s ASP 222 Ca -0.07 2.04 -0.20 0.00 0.43 0.00 0.00 52.55 54.75 2fxl s ASP 222 Cb 0.10 -2.57 0.08 0.00 -0.30 0.00 0.00 42.92 40.23 2fxl s ASP 222 CO 0.85 -0.63 1.48 0.21 -0.17 0.00 0.00 175.17 176.91 2fxl s ASN 223 N 1.56 6.67 0.07 -0.34 3.84 -1.26 -4.82 114.94 120.67 2fxl s ASN 223 Ca 0.61 -1.99 -0.31 0.00 0.21 0.00 0.00 52.86 51.39 2fxl s ASN 223 Cb -0.30 -2.53 -0.07 0.00 -0.55 0.00 0.00 41.25 37.80 2fxl s ASN 223 CO 0.26 -1.26 1.44 -0.55 -2.79 0.00 0.00 177.10 174.20 2fxl s SER 224 N 4.33 6.78 0.31 -4.21 0.15 -1.06 -4.88 113.70 115.14 2fxl s SER 224 Ca 0.46 2.30 0.17 0.00 0.70 0.00 0.00 55.95 59.57 2fxl s SER 224 Cb 0.00 -2.57 0.16 0.00 -1.71 0.00 0.00 66.02 61.90 2fxl s SER 224 CO -0.04 -0.72 1.49 0.00 1.20 0.00 0.00 173.24 175.17 2fxl h ALA 225 N 7.38 0.74 0.00 5.45 0.00 -1.92 -0.39 119.26 130.52 2fxl h ALA 225 Ca -0.41 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.12 2fxl h ALA 225 Cb 1.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2fxl h ALA 225 CO 0.89 0.52 0.00 -1.13 0.00 0.00 0.00 179.25 179.53 2fxl n SER 226 N -3.22 0.00 -0.17 0.00 3.41 -1.25 -4.27 113.62 108.12 2fxl n SER 226 Ca 0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.54 2fxl n SER 226 Cb 0.69 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 2fxl n SER 226 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2fxl h VAL 227 N 0.11 1.25 -0.53 -3.33 2.07 -1.93 -2.55 116.25 111.34 2fxl h VAL 227 Ca 0.00 -0.93 0.08 0.00 0.82 0.00 0.00 66.70 66.67 2fxl h VAL 227 Cb 0.00 0.93 -0.10 0.00 -1.52 0.00 0.00 31.29 30.59 2fxl h VAL 227 CO 0.00 0.33 -0.42 1.56 0.02 0.00 0.00 177.57 179.06 2fxl h GLN 228 N 0.67 -0.24 -0.48 1.57 7.50 -1.96 -1.24 115.11 120.93 2fxl h GLN 228 Ca 0.14 0.02 -0.05 0.00 0.50 0.00 0.00 58.65 59.26 2fxl h GLN 228 Cb 0.40 0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.97 2fxl h GLN 228 CO 0.01 -0.16 0.09 0.00 -1.50 0.00 0.00 178.83 177.27 2fxl h ALA 229 N 0.61 0.63 -0.22 3.87 0.00 -1.93 -2.19 119.26 120.03 2fxl h ALA 229 Ca 0.17 -0.22 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 2fxl h ALA 229 Cb 0.57 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2fxl h ALA 229 CO -0.66 0.35 -0.63 1.15 0.00 0.00 0.00 179.25 179.46 2fxl h THR 230 N 0.65 1.29 -0.06 0.00 2.02 -1.04 -2.93 112.91 112.85 2fxl h THR 230 Ca 0.15 -1.84 -0.14 0.00 0.77 0.00 0.00 66.41 65.34 2fxl h THR 230 Cb 0.37 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.56 2fxl h THR 230 CO 0.01 0.59 -0.59 0.00 0.37 0.00 0.00 175.52 175.90 2fxl h MET 231 N 0.57 0.18 -0.67 6.66 -0.00 -1.16 -2.60 114.93 117.91 2fxl h MET 231 Ca -0.01 -0.12 0.03 0.00 -0.00 0.00 0.00 59.70 59.60 2fxl h MET 231 Cb 1.24 0.02 -0.04 0.00 -0.00 0.00 0.00 31.60 32.81 2fxl h MET 231 CO 0.13 0.71 0.42 -0.92 -0.00 0.00 0.00 176.91 177.26 2fxl h TYR 232 N 0.14 0.79 -0.97 -0.10 3.20 -1.34 -2.19 116.97 116.49 2fxl h TYR 232 Ca -0.00 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2fxl h TYR 232 Cb 1.07 -0.26 -0.07 0.00 1.54 0.00 0.00 36.73 39.02 2fxl h TYR 232 CO 0.02 0.46 0.63 0.87 -1.64 0.00 0.00 178.16 178.49 2fxl h LYS 233 N 0.83 1.11 -0.15 1.82 1.57 -1.28 -1.00 116.57 119.47 2fxl h LYS 233 Ca 0.27 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2fxl h LYS 233 Cb 0.00 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 2fxl h LYS 233 CO -0.10 0.73 -0.02 0.52 -0.57 0.00 0.00 179.45 180.02 2fxl h MET 234 N 1.14 0.28 -0.67 3.15 2.86 -1.21 -2.98 114.93 117.50 2fxl h MET 234 Ca 0.42 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 2fxl h MET 234 Cb 0.16 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 2fxl h MET 234 CO -0.17 0.53 0.43 0.00 1.06 0.00 0.00 176.91 178.77 2fxl h ALA 235 N 0.74 0.85 -0.52 6.32 0.00 -1.10 -2.54 119.26 123.01 2fxl h ALA 235 Ca 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fxl h ALA 235 Cb 0.42 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2fxl h ALA 235 CO 0.01 0.30 0.34 1.49 0.00 0.00 0.00 179.25 181.38 2fxl h GLU 236 N 0.91 0.70 -0.59 0.00 4.81 -1.18 -2.38 114.58 116.84 2fxl h GLU 236 Ca 0.25 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 2fxl h GLU 236 Cb -0.08 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.12 2fxl h GLU 236 CO -0.05 0.47 0.29 1.96 -0.73 0.00 0.00 179.01 180.95 2fxl h GLN 237 N 0.71 0.85 -0.48 1.92 4.20 -1.34 -2.25 115.11 118.71 2fxl h GLN 237 Ca 0.19 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2fxl h GLN 237 Cb -0.06 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 2fxl h GLN 237 CO -0.04 0.69 0.23 0.82 -0.67 0.00 0.00 178.83 179.86 2fxl h ILE 238 N 0.81 1.19 -0.33 2.54 2.04 -1.18 -1.42 117.51 121.15 2fxl h ILE 238 Ca 0.20 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 2fxl h ILE 238 Cb 0.11 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 2fxl h ILE 238 CO -0.03 0.21 0.19 -0.07 0.00 0.00 0.00 178.15 178.46 2fxl h LEU 239 N 0.64 0.39 -1.10 1.44 3.38 -1.27 -1.18 115.31 117.61 2fxl h LEU 239 Ca 0.17 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 2fxl h LEU 239 Cb 0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2fxl h LEU 239 CO -0.02 0.31 -0.28 0.00 0.09 0.00 0.00 178.44 178.54 2fxl h ALA 240 N 1.75 1.04 -0.00 1.53 0.00 -0.69 -3.26 119.26 119.63 2fxl h ALA 240 Ca 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2fxl h ALA 240 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2fxl h ALA 240 CO -0.02 0.35 -0.81 0.54 0.00 0.00 0.00 179.25 179.31 2fxl n ARG 241 N -3.49 0.72 -3.54 0.00 1.74 -0.50 -4.84 116.66 106.75 2fxl n ARG 241 Ca -0.00 -0.21 -0.22 0.00 -0.77 0.00 0.00 57.85 56.64 2fxl n ARG 241 Cb 0.45 -1.42 -0.15 0.00 -1.02 0.00 0.00 32.46 30.32 2fxl n ARG 241 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2fxl s GLN 242 N -2.73 0.14 0.32 5.56 2.00 -0.87 -5.03 119.66 119.04 2fxl s GLN 242 Ca 0.10 0.01 0.16 0.00 -2.00 0.00 0.00 55.36 53.63 2fxl s GLN 242 Cb 0.15 -1.47 0.37 0.00 0.80 0.00 0.00 33.01 32.87 2fxl s GLN 242 CO 0.74 -0.70 1.59 0.37 -0.50 0.00 0.00 175.29 176.79 2fxl h GLN 243 N 8.37 0.00 0.00 1.67 5.75 -1.88 -2.94 115.11 126.07 2fxl h GLN 243 Ca -0.16 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.34 2fxl h GLN 243 Cb 1.14 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.69 2fxl h GLN 243 CO 0.30 0.48 0.00 1.28 -2.65 0.00 0.00 178.83 178.24 2fxl n LEU 244 N -3.41 0.00 -4.70 -2.39 7.99 -1.26 -4.69 117.00 108.55 2fxl n LEU 244 Ca 0.01 0.27 -0.41 0.00 -0.01 0.00 0.00 56.01 55.87 2fxl n LEU 244 Cb 0.63 -0.27 -0.04 0.00 -0.11 0.00 0.00 43.42 43.63 2fxl n LEU 244 CO 0.39 -0.13 0.54 -0.63 -1.51 0.00 0.00 177.39 176.05 2fxl s ILE 245 N -2.54 4.94 -0.15 -0.08 -1.09 -1.11 -0.45 121.20 120.72 2fxl s ILE 245 Ca 0.15 1.65 -0.04 0.00 -2.23 0.00 0.00 60.65 60.18 2fxl s ILE 245 Cb 0.11 -4.14 -0.24 0.00 -1.58 0.00 0.00 42.46 36.61 2fxl s ILE 245 CO 0.24 0.14 0.24 -0.62 -1.23 0.00 0.00 174.94 173.71 2fxl n GLU 246 N 4.39 0.73 -3.92 2.79 1.02 -0.29 -4.88 120.64 120.49 2fxl n GLU 246 Ca 0.03 0.24 -0.09 0.00 -0.02 0.00 0.00 57.16 57.31 2fxl n GLU 246 Cb 0.50 -1.67 -0.09 0.00 -0.02 0.00 0.00 31.44 30.16 2fxl n GLU 246 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2fxl s THR 247 N -2.55 0.14 -0.05 2.62 -4.23 -1.23 -3.76 115.64 106.57 2fxl s THR 247 Ca -0.25 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.17 2fxl s THR 247 Cb 0.07 -0.99 0.01 0.00 1.34 0.00 0.00 72.50 72.93 2fxl s THR 247 CO 0.73 -0.62 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.37 2fxl s VAL 248 N -2.83 1.18 -0.02 2.29 1.01 -0.20 -1.15 120.40 120.68 2fxl s VAL 248 Ca -0.03 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2fxl s VAL 248 Cb 0.00 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2fxl s VAL 248 CO -0.06 0.36 -0.23 -0.70 0.00 0.00 0.00 175.10 174.47 2fxl s GLU 249 N 0.37 1.89 0.01 2.72 2.12 0.89 -0.55 118.70 126.15 2fxl s GLU 249 Ca -0.09 -0.81 0.07 0.00 0.36 0.00 0.00 54.97 54.50 2fxl s GLU 249 Cb -0.13 -1.80 -0.02 0.00 0.26 0.00 0.00 34.13 32.44 2fxl s GLU 249 CO 0.03 0.47 -0.21 0.71 -0.54 0.00 0.00 175.26 175.72 2fxl s TYR 250 N -0.47 1.83 -0.18 5.30 2.02 0.17 -0.88 117.35 125.14 2fxl s TYR 250 Ca 0.07 -0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 56.40 2fxl s TYR 250 Cb -0.09 -1.13 0.05 0.00 -0.40 0.00 0.00 41.96 40.38 2fxl s TYR 250 CO -0.00 0.03 -0.02 0.45 -1.57 0.00 0.00 175.55 174.44 2fxl s SER 251 N -0.83 2.95 -0.18 2.29 0.15 -0.18 -1.55 113.70 116.34 2fxl s SER 251 Ca 0.08 -0.77 -0.01 0.00 0.70 0.00 0.00 55.95 55.95 2fxl s SER 251 Cb -0.08 -0.82 0.05 0.00 -1.71 0.00 0.00 66.02 63.45 2fxl s SER 251 CO 0.01 -0.24 -0.04 -0.76 1.20 0.00 0.00 173.24 173.41 2fxl s LEU 252 N 1.69 1.64 0.61 3.45 1.02 -0.41 -2.80 118.68 123.88 2fxl s LEU 252 Ca -0.01 -0.74 -0.16 0.00 0.02 0.00 0.00 54.13 53.25 2fxl s LEU 252 Cb -0.16 -0.88 -0.03 0.00 0.02 0.00 0.00 46.19 45.14 2fxl s LEU 252 CO -0.07 -0.21 1.07 -2.16 0.02 0.00 0.00 176.35 175.00 2fxl s PRO 253 N 1.65 3.20 -0.41 1.29 0.04 -1.26 -1.60 135.00 137.91 2fxl s PRO 253 Ca -0.00 1.24 -0.09 0.00 0.04 0.00 0.00 61.00 62.19 2fxl s PRO 253 Cb -0.16 -2.01 0.07 0.00 0.04 0.00 0.00 34.50 32.43 2fxl s PRO 253 CO -0.07 -0.91 0.24 1.21 0.04 0.00 0.00 177.00 177.51 2fxl s ASN 254 N -2.75 5.63 -0.54 6.66 3.84 0.55 -4.39 114.94 123.92 2fxl s ASN 254 Ca 0.64 -1.41 -0.20 0.00 0.21 0.00 0.00 52.86 52.11 2fxl s ASN 254 Cb -0.17 -1.98 0.07 0.00 -0.55 0.00 0.00 41.25 38.61 2fxl s ASN 254 CO 0.38 -0.50 0.72 -0.54 -2.79 0.00 0.00 177.10 174.37 2fxl s LYS 255 N 1.44 3.14 0.27 0.43 1.02 -0.55 -2.49 119.74 123.00 2fxl s LYS 255 Ca 0.02 -0.88 -0.29 0.00 0.02 0.00 0.00 55.97 54.84 2fxl s LYS 255 Cb -0.22 -4.14 -0.09 0.00 -0.52 0.00 0.00 37.83 32.86 2fxl s LYS 255 CO 0.03 -1.38 1.10 -1.01 -0.92 0.00 0.00 175.35 173.17 2fxl s HIS 256 N 2.96 3.59 -0.28 3.18 3.76 -1.26 -4.27 115.29 122.97 2fxl s HIS 256 Ca 0.17 1.70 -0.00 0.00 -0.15 0.00 0.00 55.06 56.78 2fxl s HIS 256 Cb -0.19 -3.28 0.05 0.00 1.11 0.00 0.00 32.58 30.27 2fxl s HIS 256 CO 0.12 -0.53 -0.05 0.71 -0.85 0.00 0.00 174.74 174.14 2fxl s TYR 257 N -1.12 3.23 0.01 1.40 1.51 -1.26 -0.86 117.35 120.25 2fxl s TYR 257 Ca 0.45 -1.96 -0.16 0.00 -1.01 0.00 0.00 57.07 54.39 2fxl s TYR 257 Cb -0.32 -2.04 -0.06 0.00 -0.11 0.00 0.00 41.96 39.43 2fxl s TYR 257 CO 0.41 -0.82 0.45 -0.06 -1.11 0.00 0.00 175.55 174.42 2fxl s PHE 258 N 1.22 3.74 0.78 2.71 0.08 -0.60 -4.86 117.98 121.04 2fxl s PHE 258 Ca -0.05 1.05 -0.14 0.00 0.12 0.00 0.00 56.93 57.91 2fxl s PHE 258 Cb -0.19 -2.35 0.07 0.00 -0.57 0.00 0.00 43.02 39.97 2fxl s PHE 258 CO -0.03 0.60 1.20 -1.21 -0.10 0.00 0.00 175.22 175.68 2fxl s GLU 259 N -0.99 1.82 -0.14 0.44 2.02 -1.26 -1.10 118.70 119.49 2fxl s GLU 259 Ca 0.25 1.72 0.00 0.00 0.02 0.00 0.00 54.97 56.97 2fxl s GLU 259 Cb -0.17 -1.80 0.02 0.00 0.10 0.00 0.00 34.13 32.28 2fxl s GLU 259 CO 0.14 -2.07 -0.14 0.42 0.02 0.00 0.00 175.26 173.64 2fxl s ILE 260 N -2.14 1.52 -0.31 -1.63 1.01 -1.25 -4.77 121.20 113.62 2fxl s ILE 260 Ca 0.73 -0.60 -0.25 0.00 0.00 0.00 0.00 60.65 60.52 2fxl s ILE 260 Cb -0.28 -1.43 0.01 0.00 0.01 0.00 0.00 42.46 40.77 2fxl s ILE 260 CO 0.49 0.45 0.88 -0.62 0.00 0.00 0.00 174.94 176.14 2fxl s ASP 261 N 1.45 6.75 0.00 3.58 -1.08 -1.26 -4.55 116.67 121.55 2fxl s ASP 261 Ca 0.04 0.77 0.06 0.00 -0.52 0.00 0.00 52.55 52.90 2fxl s ASP 261 Cb -0.13 -2.45 0.17 0.00 -1.46 0.00 0.00 42.92 39.05 2fxl s ASP 261 CO -0.09 -0.71 1.13 0.18 0.52 0.00 0.00 175.17 176.19 2fxl n LEU 262 N 6.43 2.48 0.24 -1.34 4.77 -1.26 -4.66 117.00 123.67 2fxl n LEU 262 Ca 0.06 -1.96 0.09 0.00 -0.03 0.00 0.00 56.01 54.17 2fxl n LEU 262 Cb 0.48 -0.12 0.62 0.00 -2.33 0.00 0.00 43.42 42.06 2fxl n LEU 262 CO 0.53 0.62 0.94 0.77 -1.33 0.00 0.00 177.39 178.92 2fxl h SER 263 N 1.13 0.00 0.00 -1.43 4.64 -1.68 -0.86 113.55 115.35 2fxl h SER 263 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2fxl h SER 263 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2fxl h SER 263 CO 0.00 0.15 0.01 4.11 -0.87 0.00 0.00 176.83 180.23 2fxl h TRP 264 N 0.00 0.00 -3.43 4.77 5.08 -1.85 -2.75 115.95 117.77 2fxl h TRP 264 Ca -0.00 0.00 -0.70 0.00 1.08 0.00 0.00 58.89 59.27 2fxl h TRP 264 Cb 0.32 0.00 -0.33 0.00 -3.00 0.00 0.00 29.16 26.15 2fxl h TRP 264 CO 0.00 0.00 -0.50 -1.58 -1.28 0.00 0.00 178.44 175.08 2fxl s HIS 265 N -3.88 3.54 -1.47 0.12 5.04 -0.33 -4.71 115.29 113.61 2fxl s HIS 265 Ca -0.04 -2.27 -0.02 0.00 -1.54 0.00 0.00 55.06 51.20 2fxl s HIS 265 Cb 0.10 -3.30 0.01 0.00 0.04 0.00 0.00 32.58 29.43 2fxl s HIS 265 CO 0.31 -0.98 0.18 1.63 -2.34 0.00 0.00 174.74 173.54 2fxl n LYS 266 N 4.68 -2.72 -1.56 2.88 5.02 -1.26 -1.40 118.16 123.80 2fxl n LYS 266 Ca -0.04 0.81 -0.19 0.00 -2.02 0.00 0.00 58.31 56.87 2fxl n LYS 266 Cb 0.41 -5.51 -0.08 0.00 -0.02 0.00 0.00 35.03 29.83 2fxl n LYS 266 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fxl n GLY 267 N -1.08 1.85 3.65 0.72 0.00 -1.04 -4.92 105.19 104.38 2fxl n GLY 267 Ca -0.16 -0.01 -0.47 0.00 0.00 0.00 0.00 46.02 45.38 2fxl n GLY 267 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2fxl n LEU 268 N -2.20 2.81 -4.34 0.99 7.94 -0.49 -4.78 117.00 116.92 2fxl n LEU 268 Ca -0.19 1.11 -0.41 0.00 -1.11 0.00 0.00 56.01 55.40 2fxl n LEU 268 Cb 0.67 -1.38 -0.10 0.00 0.53 0.00 0.00 43.42 43.14 2fxl n LEU 268 CO 0.30 -0.50 -0.10 -1.10 -1.11 0.00 0.00 177.39 174.88 2fxl s GLN 269 N 0.46 2.77 -0.03 1.96 -1.52 -1.26 -1.89 119.66 120.14 2fxl s GLN 269 Ca 0.77 -1.29 0.07 0.00 -1.95 0.00 0.00 55.36 52.96 2fxl s GLN 269 Cb -0.72 -3.84 0.12 0.00 -0.22 0.00 0.00 33.01 28.35 2fxl s GLN 269 CO 0.43 -0.87 1.06 -1.71 -0.25 0.00 0.00 175.29 173.94 2fxl n ASN 270 N 5.01 0.64 -4.55 5.90 5.15 -1.26 -4.68 115.26 121.47 2fxl n ASN 270 Ca -0.11 -2.28 -0.26 0.00 -0.60 0.00 0.00 54.58 51.33 2fxl n ASN 270 Cb 0.44 -0.27 -0.11 0.00 -0.53 0.00 0.00 39.78 39.32 2fxl n ASN 270 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2fxl s THR 271 N -0.69 2.04 0.00 -0.44 -4.23 -1.26 -3.84 115.64 107.22 2fxl s THR 271 Ca 0.12 -2.12 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2fxl s THR 271 Cb 0.11 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2fxl s THR 271 CO -0.02 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 2fxl n GLY 272 N -0.82 3.21 0.02 3.99 0.00 -1.26 -0.68 105.19 109.65 2fxl n GLY 272 Ca -0.05 0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2fxl n GLY 272 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2fxl n LYS 273 N 14.00 0.03 -0.16 1.61 5.02 -1.26 -1.83 118.16 135.57 2fxl n LYS 273 Ca 0.00 0.26 0.12 0.00 -2.02 0.00 0.00 58.31 56.67 2fxl n LYS 273 Cb 0.00 -1.55 0.21 0.00 -0.02 0.00 0.00 35.03 33.67 2fxl n LYS 273 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2fxl n ASN 274 N -1.60 3.29 -4.64 4.39 5.03 0.14 -4.96 115.26 116.91 2fxl n ASN 274 Ca 0.04 -1.98 -0.43 0.00 0.87 0.00 0.00 54.58 53.08 2fxl n ASN 274 Cb 0.19 -0.21 -0.03 0.00 -1.02 0.00 0.00 39.78 38.72 2fxl n ASN 274 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2fxl s ALA 275 N -1.59 3.32 0.00 5.41 0.00 -0.76 -4.24 121.76 123.91 2fxl s ALA 275 Ca 0.37 0.82 0.00 0.00 0.00 0.00 0.00 51.96 53.15 2fxl s ALA 275 Cb 0.22 -3.87 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2fxl s ALA 275 CO 0.31 -1.90 0.00 0.39 0.00 0.00 0.00 175.76 174.56 2fxl n GLU 276 N 7.72 0.18 -4.08 0.00 1.02 -1.26 -4.97 120.64 119.26 2fxl n GLU 276 Ca 0.21 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 57.00 2fxl n GLU 276 Cb 0.44 -0.85 -0.11 0.00 -0.02 0.00 0.00 31.44 30.90 2fxl n GLU 276 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2fxl s VAL 277 N -1.70 4.34 0.17 2.62 1.01 -1.26 -5.11 120.40 120.47 2fxl s VAL 277 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2fxl s VAL 277 Cb 0.00 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2fxl s VAL 277 CO 0.00 0.44 -0.18 -0.36 0.00 0.00 0.00 175.10 175.00 2fxl s PHE 278 N 0.70 1.82 -0.41 5.22 0.40 -1.26 -3.95 117.98 120.50 2fxl s PHE 278 Ca 0.01 -0.48 -0.11 0.00 -0.60 0.00 0.00 56.93 55.75 2fxl s PHE 278 Cb -0.14 -0.90 0.05 0.00 0.51 0.00 0.00 43.02 42.55 2fxl s PHE 278 CO 0.02 0.35 0.26 0.00 0.70 0.00 0.00 175.22 176.55 2fxl s ALA 279 N -2.17 3.34 0.30 5.36 0.00 -0.26 -4.93 121.76 123.40 2fxl s ALA 279 Ca 0.17 -1.94 -0.29 0.00 0.00 0.00 0.00 51.96 49.90 2fxl s ALA 279 Cb -0.05 -2.71 -0.11 0.00 0.00 0.00 0.00 23.12 20.25 2fxl s ALA 279 CO 0.07 -1.55 1.49 -2.14 0.00 0.00 0.00 175.76 173.63 2fxl s PRO 280 N 1.53 4.19 -0.20 0.00 0.02 -1.26 -1.56 135.00 137.71 2fxl s PRO 280 Ca 0.03 2.45 -0.07 0.00 0.02 0.00 0.00 61.00 63.43 2fxl s PRO 280 Cb -0.21 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 31.23 2fxl s PRO 280 CO 0.05 -0.49 0.07 -0.65 -0.33 0.00 0.00 177.00 175.65 2fxl s GLN 281 N -1.01 3.88 0.17 5.54 -1.52 -0.04 -4.93 119.66 121.75 2fxl s GLN 281 Ca 0.58 -0.38 -0.00 0.00 -1.95 0.00 0.00 55.36 53.60 2fxl s GLN 281 Cb -0.45 -3.25 0.04 0.00 -0.22 0.00 0.00 33.01 29.13 2fxl s GLN 281 CO 0.51 0.13 1.41 0.77 -0.25 0.00 0.00 175.29 177.86 2fxl h SER 282 N 7.18 0.42 -4.99 5.90 0.02 -1.94 -3.40 113.55 116.74 2fxl h SER 282 Ca -0.37 -0.30 0.00 0.00 -0.84 0.00 0.00 61.79 60.29 2fxl h SER 282 Cb 1.17 -0.13 -0.11 0.00 0.14 0.00 0.00 62.40 63.48 2fxl h SER 282 CO 0.66 1.05 0.23 1.51 -1.14 0.00 0.00 176.83 179.13 2fxl s ASP 283 N -6.97 -0.51 1.14 3.07 1.47 -1.26 -4.82 116.67 108.79 2fxl s ASP 283 Ca -0.05 -0.10 -0.19 0.00 1.18 0.00 0.00 52.55 53.40 2fxl s ASP 283 Cb 0.10 0.61 0.27 0.00 -0.34 0.00 0.00 42.92 43.56 2fxl s ASP 283 CO 0.84 -1.02 1.18 -2.16 0.68 0.00 0.00 175.17 174.69 2fxl s PRO 284 N -3.75 -0.76 0.03 2.11 0.04 -1.26 -5.10 135.00 126.31 2fxl s PRO 284 Ca 0.03 -0.22 0.02 0.00 0.04 0.00 0.00 61.00 60.86 2fxl s PRO 284 Cb -0.02 -1.67 -0.02 0.00 0.04 0.00 0.00 34.50 32.84 2fxl s PRO 284 CO -0.10 -3.38 -0.06 0.54 0.04 0.00 0.00 177.00 174.04 2fxl s ASN 285 N -4.25 0.69 0.61 6.66 4.22 -1.26 -4.72 114.94 116.90 2fxl s ASN 285 Ca 0.72 -0.45 -0.18 0.00 -2.14 0.00 0.00 52.86 50.82 2fxl s ASN 285 Cb -0.07 0.03 -0.02 0.00 1.28 0.00 0.00 41.25 42.46 2fxl s ASN 285 CO 0.55 -0.17 1.17 -0.83 -2.04 0.00 0.00 177.10 175.78 2fxl s GLY 286 N -1.28 2.54 -0.05 0.45 0.00 -1.04 -4.83 107.32 103.12 2fxl s GLY 286 Ca -0.09 0.85 -0.02 0.00 0.00 0.00 0.00 44.72 45.47 2fxl s GLY 286 CO 0.00 1.23 0.04 -2.27 0.00 0.00 0.00 173.10 172.10 2fxl s LEU 287 N -4.31 0.29 -0.11 0.66 2.96 -1.26 -0.33 118.68 116.58 2fxl s LEU 287 Ca 0.74 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.69 2fxl s LEU 287 Cb -0.27 -0.24 0.01 0.00 0.50 0.00 0.00 46.19 46.19 2fxl s LEU 287 CO 0.35 -0.23 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.35 2fxl s ILE 288 N 2.10 1.59 0.07 6.68 1.09 -0.63 -5.01 121.20 127.09 2fxl s ILE 288 Ca 0.05 -0.70 0.08 0.00 -1.10 0.00 0.00 60.65 58.97 2fxl s ILE 288 Cb -0.12 -1.43 -0.03 0.00 -1.06 0.00 0.00 42.46 39.82 2fxl s ILE 288 CO -0.04 0.46 -0.21 -0.54 -0.10 0.00 0.00 174.94 174.51 2fxl s LYS 289 N 0.87 1.29 -0.07 2.79 1.02 -1.26 -1.29 119.74 123.08 2fxl s LYS 289 Ca -0.09 -1.03 -0.05 0.00 0.02 0.00 0.00 55.97 54.82 2fxl s LYS 289 Cb -0.15 -1.47 0.03 0.00 -0.52 0.00 0.00 37.83 35.71 2fxl s LYS 289 CO -0.00 0.36 0.17 0.00 -0.92 0.00 0.00 175.35 174.96 2fxl s THR 291 N 0.49 2.67 -0.12 0.00 2.01 -1.26 -0.65 115.64 118.77 2fxl s THR 291 Ca -0.03 -0.73 -0.00 0.00 0.31 0.00 0.00 61.69 61.23 2fxl s THR 291 Cb -0.05 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 70.27 2fxl s THR 291 CO -0.02 0.49 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.60 2fxl s VAL 292 N 1.36 3.27 0.16 3.82 1.01 0.29 -4.97 120.40 125.33 2fxl s VAL 292 Ca 0.05 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.45 2fxl s VAL 292 Cb -0.14 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 2fxl s VAL 292 CO -0.08 0.53 0.05 0.61 0.00 0.00 0.00 175.10 176.21 2fxl n GLY 293 N 3.30 3.78 3.78 4.51 0.00 -1.26 -1.04 105.19 118.26 2fxl n GLY 293 Ca -0.18 -2.00 -0.39 0.00 0.00 0.00 0.00 46.02 43.45 2fxl n GLY 293 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fxl s ARG 294 N -2.59 4.35 0.00 1.61 0.52 -1.25 -5.03 118.95 116.56 2fxl s ARG 294 Ca 0.08 0.87 0.29 0.00 -0.52 0.00 0.00 55.73 56.45 2fxl s ARG 294 Cb 0.00 -3.28 1.74 0.00 0.52 0.00 0.00 34.95 33.93 2fxl s ARG 294 CO 0.05 0.52 2.07 0.43 0.02 0.00 0.00 175.30 178.40