#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fxr s VAL 17 N 0.00 3.83 -0.78 1.39 1.01 0.13 -3.95 120.40 122.03 2fxr s VAL 17 Ca 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 2fxr s VAL 17 Cb 0.00 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.68 2fxr s VAL 17 CO 0.00 0.46 0.07 0.61 0.00 0.00 0.00 175.10 176.24 2fxr n GLY 18 N 3.96 0.02 0.00 4.51 0.00 -1.24 -2.15 105.19 110.28 2fxr n GLY 18 Ca -0.17 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2fxr n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fxr n GLY 19 N -1.03 3.06 3.37 -0.02 0.00 -1.26 -4.81 105.19 104.50 2fxr n GLY 19 Ca -0.10 -1.81 -0.10 0.00 0.00 0.00 0.00 46.02 44.01 2fxr n GLY 19 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2fxr s GLN 20 N 3.81 1.16 0.34 1.61 2.00 -0.99 -4.99 119.66 122.60 2fxr s GLN 20 Ca 0.00 -0.97 -0.28 0.00 -2.00 0.00 0.00 55.36 52.10 2fxr s GLN 20 Cb 0.00 0.43 -0.10 0.00 0.80 0.00 0.00 33.01 34.14 2fxr s GLN 20 CO 0.00 -0.45 1.29 -2.00 -0.50 0.00 0.00 175.29 173.64 2fxr s GLU 21 N -3.90 4.34 0.17 1.67 2.12 -1.26 -2.35 118.70 119.49 2fxr s GLU 21 Ca 0.11 2.18 -0.19 0.00 0.36 0.00 0.00 54.97 57.43 2fxr s GLU 21 Cb 0.02 -3.04 -0.08 0.00 0.26 0.00 0.00 34.13 31.29 2fxr s GLU 21 CO -0.05 -0.19 0.66 0.00 -0.54 0.00 0.00 175.26 175.14 2fxr s ALA 22 N -1.16 3.49 0.73 6.30 0.00 -0.25 -4.84 121.76 126.03 2fxr s ALA 22 Ca 0.49 0.09 -0.14 0.00 0.00 0.00 0.00 51.96 52.41 2fxr s ALA 22 Cb -0.39 -2.73 0.04 0.00 0.00 0.00 0.00 23.12 20.04 2fxr s ALA 22 CO 0.52 0.37 1.16 -2.14 0.00 0.00 0.00 175.76 175.67 2fxr s PRO 23 N -1.71 2.25 0.52 0.00 0.02 -1.26 -4.88 135.00 129.95 2fxr s PRO 23 Ca 0.38 1.59 0.27 0.00 0.02 0.00 0.00 61.00 63.26 2fxr s PRO 23 Cb -0.18 -1.86 1.42 0.00 0.02 0.00 0.00 34.50 33.90 2fxr s PRO 23 CO 0.21 -1.71 2.06 0.00 -0.33 0.00 0.00 177.00 177.23 2fxr h ARG 24 N -0.38 0.00 -0.11 5.54 3.08 -2.00 -2.92 114.38 117.58 2fxr h ARG 24 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2fxr h ARG 24 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.32 2fxr h ARG 24 CO 0.50 0.12 0.00 -1.13 -1.07 0.00 0.00 179.97 178.40 2fxr n SER 25 N -3.67 1.58 -4.69 7.04 3.41 -1.26 -4.91 113.62 111.11 2fxr n SER 25 Ca -0.02 -1.62 -0.28 0.00 -0.26 0.00 0.00 58.87 56.69 2fxr n SER 25 Cb 0.24 -0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.05 2fxr n SER 25 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2fxr s LYS 26 N -1.87 2.53 -1.03 4.33 1.02 -1.11 -4.75 119.74 118.87 2fxr s LYS 26 Ca 0.34 -0.98 -0.05 0.00 0.02 0.00 0.00 55.97 55.31 2fxr s LYS 26 Cb 0.19 -2.47 -0.05 0.00 -0.52 0.00 0.00 37.83 34.98 2fxr s LYS 26 CO 0.29 0.49 0.89 0.91 -0.92 0.00 0.00 175.35 177.01 2fxr n TRP 27 N 0.06 -2.29 0.30 3.18 5.03 -1.26 -4.90 117.44 117.57 2fxr n TRP 27 Ca -0.10 0.83 0.16 0.00 3.03 0.00 0.00 57.50 61.43 2fxr n TRP 27 Cb 0.54 -4.23 0.75 0.00 -1.03 0.00 0.00 31.31 27.34 2fxr n TRP 27 CO 0.00 0.00 0.00 -1.35 -0.03 0.00 0.00 177.69 176.31 2fxr h PRO 28 N -1.19 0.00 0.00 -0.99 0.11 -1.85 -2.84 132.00 125.25 2fxr h PRO 28 Ca -0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.53 2fxr h PRO 28 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2fxr h PRO 28 CO 0.43 0.00 -0.85 -2.67 -0.21 0.00 0.00 178.00 174.70 2fxr n TRP 29 N -2.76 0.47 -1.81 0.65 2.14 -1.18 -3.23 117.44 111.73 2fxr n TRP 29 Ca -0.00 0.14 -0.42 0.00 2.07 0.00 0.00 57.50 59.28 2fxr n TRP 29 Cb 0.19 -0.59 -0.03 0.00 -0.81 0.00 0.00 31.31 30.07 2fxr n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2fxr s GLN 30 N -3.21 4.16 0.31 -2.67 2.00 -1.07 -1.31 119.66 117.88 2fxr s GLN 30 Ca 0.04 2.50 0.03 0.00 -2.00 0.00 0.00 55.36 55.93 2fxr s GLN 30 Cb 0.13 -3.35 -0.05 0.00 0.80 0.00 0.00 33.01 30.54 2fxr s GLN 30 CO 0.76 -0.75 0.08 0.14 -0.50 0.00 0.00 175.29 175.03 2fxr s VAL 31 N 1.93 0.90 -0.05 1.34 -7.23 -0.62 -2.51 120.40 114.17 2fxr s VAL 31 Ca 0.75 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.96 2fxr s VAL 31 Cb -0.45 -2.69 0.00 0.00 0.56 0.00 0.00 36.38 33.80 2fxr s VAL 31 CO 0.33 0.00 -0.14 -0.55 -0.31 0.00 0.00 175.10 174.43 2fxr s SER 32 N -3.45 1.85 -0.17 4.85 0.15 -0.32 -2.21 113.70 114.40 2fxr s SER 32 Ca 0.35 -0.30 -0.12 0.00 0.70 0.00 0.00 55.95 56.58 2fxr s SER 32 Cb 0.08 -0.61 -0.05 0.00 -1.71 0.00 0.00 66.02 63.73 2fxr s SER 32 CO 0.15 0.10 0.22 -0.76 1.20 0.00 0.00 173.24 174.15 2fxr s LEU 33 N 0.24 4.24 0.02 3.45 1.43 -0.16 -0.46 118.68 127.45 2fxr s LEU 33 Ca -0.07 0.39 0.08 0.00 -1.03 0.00 0.00 54.13 53.50 2fxr s LEU 33 Cb -0.12 -2.24 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 2fxr s LEU 33 CO 0.02 0.15 -0.22 -0.13 0.23 0.00 0.00 176.35 176.41 2fxr s ARG 34 N 0.32 2.03 -0.06 1.70 1.81 0.14 -1.94 118.95 122.96 2fxr s ARG 34 Ca 0.13 -0.99 0.04 0.00 -1.72 0.00 0.00 55.73 53.19 2fxr s ARG 34 Cb -0.12 -2.12 -0.02 0.00 -0.45 0.00 0.00 34.95 32.24 2fxr s ARG 34 CO 0.01 0.54 -0.17 0.54 -0.68 0.00 0.00 175.30 175.55 2fxr s VAL 35 N -0.82 2.79 0.56 3.52 0.11 -0.39 -0.94 120.40 125.24 2fxr s VAL 35 Ca 0.13 -0.81 -0.21 0.00 -2.93 0.00 0.00 61.98 58.16 2fxr s VAL 35 Cb -0.10 -2.08 -0.04 0.00 -1.53 0.00 0.00 36.38 32.62 2fxr s VAL 35 CO 0.03 0.58 1.30 -2.28 -3.33 0.00 0.00 175.10 171.40 2fxr s HIS 36 N -0.51 2.32 -1.58 1.54 2.46 -0.24 -2.50 115.29 116.78 2fxr s HIS 36 Ca 0.07 1.43 0.00 0.00 0.47 0.00 0.00 55.06 57.03 2fxr s HIS 36 Cb -0.12 -3.69 0.00 0.00 -0.13 0.00 0.00 32.58 28.64 2fxr s HIS 36 CO 0.01 -2.66 0.00 0.41 -2.47 0.00 0.00 174.74 170.03 2fxr n GLY 37 N 0.70 -0.71 0.37 1.59 0.00 -1.26 -4.92 105.19 100.96 2fxr n GLY 37 Ca 0.12 -0.42 0.19 0.00 0.00 0.00 0.00 46.02 45.90 2fxr n GLY 37 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2fxr h PRO 37 N 0.00 0.00 -3.15 1.61 0.11 -2.04 -3.42 132.00 125.10 2fxr h PRO 37 Ca 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 2fxr h PRO 37 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.01 2fxr h PRO 37 CO 0.00 0.00 0.12 1.52 -0.21 0.00 0.00 178.00 179.43 2fxr s TYR 37 N -4.61 -0.26 -1.00 0.65 1.13 -1.26 -5.08 117.35 106.92 2fxr s TYR 37 Ca -0.04 -0.07 -0.23 0.00 -1.41 0.00 0.00 57.07 55.31 2fxr s TYR 37 Cb 0.15 0.50 0.03 0.00 -1.10 0.00 0.00 41.96 41.55 2fxr s TYR 37 CO 0.54 -0.96 1.55 -1.58 -2.51 0.00 0.00 175.55 172.59 2fxr s TRP 38 N -3.85 2.40 0.28 -3.49 0.52 -1.26 -4.68 118.94 108.86 2fxr s TRP 38 Ca 0.07 -0.57 -0.25 0.00 0.02 0.00 0.00 56.10 55.37 2fxr s TRP 38 Cb -0.02 -4.58 -0.09 0.00 -1.15 0.00 0.00 33.47 27.63 2fxr s TRP 38 CO -0.04 -1.90 0.88 1.41 0.02 0.00 0.00 176.95 177.32 2fxr s MET 39 N 5.35 4.53 -0.10 4.98 1.75 -1.04 -4.74 119.30 130.02 2fxr s MET 39 Ca 0.51 1.22 -0.30 0.00 -1.25 0.00 0.00 55.69 55.87 2fxr s MET 39 Cb -0.01 -2.89 -0.02 0.00 2.84 0.00 0.00 34.83 34.75 2fxr s MET 39 CO -0.08 0.35 1.10 -1.58 -0.65 0.00 0.00 175.02 174.15 2fxr s HIS 40 N -1.53 3.33 0.00 4.11 2.46 -1.26 -1.26 115.29 121.15 2fxr s HIS 40 Ca 0.47 1.40 0.00 0.00 0.47 0.00 0.00 55.06 57.40 2fxr s HIS 40 Cb -0.19 -3.30 0.00 0.00 -0.13 0.00 0.00 32.58 28.96 2fxr s HIS 40 CO 0.24 -0.75 0.00 1.97 -2.47 0.00 0.00 174.74 173.73 2fxr n PHE 41 N 5.32 0.00 -3.94 3.88 -1.74 -0.82 -4.98 117.46 115.18 2fxr n PHE 41 Ca 0.10 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.90 2fxr n PHE 41 Cb 0.47 0.00 -0.05 0.00 1.52 0.00 0.00 39.48 41.42 2fxr n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2fxr s GLY 43 N -2.98 1.98 0.14 0.00 0.00 0.10 -0.99 107.32 105.57 2fxr s GLY 43 Ca 0.19 -1.82 -0.14 0.00 0.00 0.00 0.00 44.72 42.95 2fxr s GLY 43 CO 0.06 -1.68 0.68 0.61 0.00 0.00 0.00 173.10 172.77 2fxr n GLY 44 N -1.91 0.88 3.25 0.20 0.00 -0.94 -3.64 105.19 103.03 2fxr n GLY 44 Ca 0.08 -1.09 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 2fxr n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fxr s SER 45 N -2.63 -0.35 -0.32 1.61 1.04 0.00 -1.58 113.70 111.46 2fxr s SER 45 Ca 0.15 0.62 -0.24 0.00 0.48 0.00 0.00 55.95 56.96 2fxr s SER 45 Cb -0.02 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.77 2fxr s SER 45 CO 0.04 -0.18 0.83 -0.22 0.98 0.00 0.00 173.24 174.69 2fxr s LEU 46 N -0.05 4.07 0.00 2.42 2.96 -0.43 -0.12 118.68 127.53 2fxr s LEU 46 Ca -0.02 0.64 0.14 0.00 -0.22 0.00 0.00 54.13 54.66 2fxr s LEU 46 Cb -0.03 -3.13 -0.02 0.00 0.50 0.00 0.00 46.19 43.51 2fxr s LEU 46 CO 0.01 -0.68 0.74 2.30 -1.32 0.00 0.00 176.35 177.40 2fxr n ILE 47 N 5.65 0.00 -3.57 6.68 -5.35 -0.88 -0.98 119.36 120.91 2fxr n ILE 47 Ca 0.05 -0.34 -0.13 0.00 -0.27 0.00 0.00 62.75 62.07 2fxr n ILE 47 Cb 0.48 1.14 -0.06 0.00 -1.74 0.00 0.00 39.64 39.46 2fxr n ILE 47 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 2fxr s HIS 48 N -1.76 -0.48 0.66 4.28 5.04 -1.18 -4.75 115.29 117.10 2fxr s HIS 48 Ca 0.11 0.88 0.18 0.00 -1.54 0.00 0.00 55.06 54.68 2fxr s HIS 48 Cb 0.11 0.42 0.94 0.00 0.04 0.00 0.00 32.58 34.09 2fxr s HIS 48 CO 0.37 -0.40 1.52 -1.35 -2.34 0.00 0.00 174.74 172.54 2fxr h PRO 49 N 2.96 0.00 0.00 2.88 0.11 -1.94 0.33 132.00 136.33 2fxr h PRO 49 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2fxr h PRO 49 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2fxr h PRO 49 CO 0.30 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.13 2fxr n GLN 50 N -2.80 0.88 -4.42 1.05 6.02 -1.26 0.49 117.38 117.34 2fxr n GLN 50 Ca 0.01 -0.91 -0.21 0.00 -0.01 0.00 0.00 57.00 55.87 2fxr n GLN 50 Cb 0.70 -0.94 -0.14 0.00 1.02 0.00 0.00 30.24 30.88 2fxr n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2fxr s TRP 51 N -0.44 1.26 -0.06 1.08 0.52 0.10 -1.05 118.94 120.35 2fxr s TRP 51 Ca 0.00 -0.33 0.03 0.00 0.02 0.00 0.00 56.10 55.82 2fxr s TRP 51 Cb 0.00 -0.76 0.01 0.00 -1.15 0.00 0.00 33.47 31.57 2fxr s TRP 51 CO 0.00 0.03 -0.16 0.08 0.02 0.00 0.00 176.95 176.92 2fxr s VAL 52 N -0.75 1.37 -0.13 4.03 1.01 -0.09 -2.08 120.40 123.76 2fxr s VAL 52 Ca 0.03 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.28 2fxr s VAL 52 Cb -0.07 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 2fxr s VAL 52 CO 0.01 0.40 0.18 -0.22 0.00 0.00 0.00 175.10 175.48 2fxr s LEU 53 N 0.43 4.35 0.00 3.92 2.96 0.82 -0.82 118.68 130.34 2fxr s LEU 53 Ca -0.12 0.48 -0.08 0.00 -0.22 0.00 0.00 54.13 54.19 2fxr s LEU 53 Cb -0.15 -2.16 0.03 0.00 0.50 0.00 0.00 46.19 44.41 2fxr s LEU 53 CO 0.04 0.32 0.54 1.07 -1.32 0.00 0.00 176.35 177.00 2fxr n THR 54 N 2.46 0.00 -2.77 3.68 5.66 -0.74 -0.82 114.28 121.75 2fxr n THR 54 Ca -0.18 -1.09 -0.39 0.00 -3.05 0.00 0.00 64.05 59.34 2fxr n THR 54 Cb 0.54 0.85 -0.06 0.00 -1.55 0.00 0.00 70.33 70.11 2fxr n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2fxr s ALA 55 N -2.17 3.32 0.39 1.79 0.00 -1.26 -0.55 121.76 123.28 2fxr s ALA 55 Ca 0.18 0.59 0.12 0.00 0.00 0.00 0.00 51.96 52.84 2fxr s ALA 55 Cb -0.03 -3.19 0.78 0.00 0.00 0.00 0.00 23.12 20.68 2fxr s ALA 55 CO 0.13 0.21 1.88 0.00 0.00 0.00 0.00 175.76 177.98 2fxr h ALA 56 N 3.99 1.47 0.00 0.00 0.00 -1.65 -2.56 119.26 120.51 2fxr h ALA 56 Ca -0.45 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2fxr h ALA 56 Cb 1.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2fxr h ALA 56 CO 0.67 0.38 0.00 1.12 0.00 0.00 0.00 179.25 181.43 2fxr h HIS 57 N 0.09 0.00 -0.45 0.00 2.07 -1.87 0.85 115.15 115.84 2fxr h HIS 57 Ca 0.01 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.45 2fxr h HIS 57 Cb 0.51 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.47 2fxr h HIS 57 CO 0.00 0.00 -0.05 0.00 -3.07 0.00 0.00 177.93 174.82 2fxr n VAL 59 N -4.20 0.11 -3.57 0.00 0.24 -1.07 -5.01 118.33 104.84 2fxr n VAL 59 Ca 0.02 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 2fxr n VAL 59 Cb 0.32 0.97 0.00 0.00 -1.47 0.00 0.00 33.84 33.66 2fxr n VAL 59 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2fxr n GLY 60 N 0.02 4.50 0.25 7.63 0.00 0.27 -4.63 105.19 113.23 2fxr n GLY 60 Ca 0.01 -1.55 0.16 0.00 0.00 0.00 0.00 46.02 44.64 2fxr n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fxr h PRO 60 N 0.00 0.00 -6.71 1.61 0.13 -1.80 -3.41 132.00 121.81 2fxr h PRO 60 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2fxr h PRO 60 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2fxr h PRO 60 CO 0.00 0.00 0.25 -0.51 -0.23 0.00 0.00 178.00 177.51 2fxr s ASP 60 N -5.36 7.31 0.27 1.44 1.01 -1.26 -5.02 116.67 115.06 2fxr s ASP 60 Ca 0.02 1.70 -0.30 0.00 0.71 0.00 0.00 52.55 54.68 2fxr s ASP 60 Cb 0.09 -2.53 -0.10 0.00 1.01 0.00 0.00 42.92 41.39 2fxr s ASP 60 CO 0.51 0.04 1.42 -0.69 0.21 0.00 0.00 175.17 176.65 2fxr s VAL 60 N -1.45 2.65 0.33 -1.27 1.01 -1.26 -5.02 120.40 115.40 2fxr s VAL 60 Ca 0.44 0.57 0.09 0.00 0.00 0.00 0.00 61.98 63.08 2fxr s VAL 60 Cb -0.20 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 2fxr s VAL 60 CO 0.25 0.10 0.01 -0.54 0.00 0.00 0.00 175.10 174.92 2fxr s LYS 60 N -0.69 2.09 -0.35 2.72 -0.14 -1.26 -5.08 119.74 117.04 2fxr s LYS 60 Ca 0.57 -1.72 -0.29 0.00 -1.36 0.00 0.00 55.97 53.17 2fxr s LYS 60 Cb -0.42 -1.95 0.01 0.00 -1.68 0.00 0.00 37.83 33.79 2fxr s LYS 60 CO 0.46 0.15 1.24 0.34 -0.76 0.00 0.00 175.35 176.77 2fxr s ASP 60 N -3.72 6.69 0.21 2.83 -1.08 -1.26 -4.92 116.67 115.43 2fxr s ASP 60 Ca 0.35 1.01 -0.09 0.00 -0.52 0.00 0.00 52.55 53.30 2fxr s ASP 60 Cb -0.01 -2.54 0.26 0.00 -1.46 0.00 0.00 42.92 39.17 2fxr s ASP 60 CO 0.19 -1.10 1.79 -0.07 0.52 0.00 0.00 175.17 176.51 2fxr h LEU 61 N 10.90 0.50 -1.85 -1.34 3.38 -1.95 -2.16 115.31 122.78 2fxr h LEU 61 Ca -0.24 0.04 0.19 0.00 0.09 0.00 0.00 57.88 57.96 2fxr h LEU 61 Cb 1.08 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.74 2fxr h LEU 61 CO 1.05 0.31 0.51 0.00 0.09 0.00 0.00 178.44 180.41 2fxr h ALA 62 N 1.37 2.49 0.00 1.53 0.00 -1.91 0.24 119.26 122.98 2fxr h ALA 62 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2fxr h ALA 62 Cb 0.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2fxr h ALA 62 CO -0.21 -0.70 0.00 0.00 0.00 0.00 0.00 179.25 178.34 2fxr n ALA 63 N -2.62 2.50 -2.42 0.00 0.00 -0.81 -4.79 120.51 112.36 2fxr n ALA 63 Ca 0.14 -0.16 -0.31 0.00 0.00 0.00 0.00 53.44 53.12 2fxr n ALA 63 Cb 0.71 -1.41 -0.13 0.00 0.00 0.00 0.00 19.45 18.61 2fxr n ALA 63 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2fxr s LEU 64 N -1.94 2.47 0.05 0.00 2.96 0.86 -1.08 118.68 122.00 2fxr s LEU 64 Ca 0.38 -0.47 -0.09 0.00 -0.22 0.00 0.00 54.13 53.73 2fxr s LEU 64 Cb 0.18 -1.44 0.00 0.00 0.50 0.00 0.00 46.19 45.42 2fxr s LEU 64 CO 0.29 0.26 0.19 -0.13 -1.32 0.00 0.00 176.35 175.65 2fxr s ARG 65 N -1.33 0.72 -0.05 1.98 1.81 -0.12 -4.26 118.95 117.70 2fxr s ARG 65 Ca 0.13 -0.70 0.05 0.00 -1.72 0.00 0.00 55.73 53.49 2fxr s ARG 65 Cb -0.10 0.30 -0.00 0.00 -0.45 0.00 0.00 34.95 34.69 2fxr s ARG 65 CO 0.04 -0.21 -0.19 0.54 -0.68 0.00 0.00 175.30 174.79 2fxr s VAL 66 N -2.84 1.62 -0.14 3.52 0.11 -0.53 0.27 120.40 122.42 2fxr s VAL 66 Ca -0.03 -0.82 -0.01 0.00 -2.93 0.00 0.00 61.98 58.19 2fxr s VAL 66 Cb 0.00 -1.39 -0.02 0.00 -1.53 0.00 0.00 36.38 33.44 2fxr s VAL 66 CO -0.05 0.46 -0.09 -1.58 -3.33 0.00 0.00 175.10 170.50 2fxr s GLN 67 N 0.06 3.46 0.95 1.54 2.00 0.39 -0.53 119.66 127.53 2fxr s GLN 67 Ca -0.06 -0.62 -0.14 0.00 -2.00 0.00 0.00 55.36 52.54 2fxr s GLN 67 Cb -0.13 -2.73 0.16 0.00 0.80 0.00 0.00 33.01 31.12 2fxr s GLN 67 CO 0.03 0.25 1.18 -0.51 -0.50 0.00 0.00 175.29 175.74 2fxr s LEU 68 N 0.29 2.04 0.04 3.68 1.02 -1.26 -1.17 118.68 123.33 2fxr s LEU 68 Ca -0.07 0.74 -0.36 0.00 0.02 0.00 0.00 54.13 54.46 2fxr s LEU 68 Cb -0.15 -2.94 -0.19 0.00 0.02 0.00 0.00 46.19 42.93 2fxr s LEU 68 CO 0.04 -2.73 0.91 -1.14 0.02 0.00 0.00 176.35 173.46 2fxr n ARG 69 N -3.85 0.00 -3.87 1.70 0.63 -1.04 -4.72 116.66 105.51 2fxr n ARG 69 Ca 0.10 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.91 2fxr n ARG 69 Cb 0.60 -1.33 -0.13 0.00 0.45 0.00 0.00 32.46 32.04 2fxr n ARG 69 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 2fxr s GLU 70 N -0.21 0.07 0.12 -0.14 2.12 -1.26 -5.05 118.70 114.34 2fxr s GLU 70 Ca 0.82 -0.00 -0.07 0.00 0.36 0.00 0.00 54.97 56.07 2fxr s GLU 70 Cb -1.15 0.03 -0.10 0.00 0.26 0.00 0.00 34.13 33.17 2fxr s GLU 70 CO 0.54 -0.01 1.31 0.37 -0.54 0.00 0.00 175.26 176.94 2fxr h GLN 71 N 5.97 0.55 -3.61 4.30 5.75 -1.94 -3.43 115.11 122.70 2fxr h GLN 71 Ca -0.25 -0.53 -0.45 0.00 -0.15 0.00 0.00 58.65 57.28 2fxr h GLN 71 Cb 1.21 0.13 -0.39 0.00 1.07 0.00 0.00 27.48 29.50 2fxr h GLN 71 CO 0.48 1.15 -0.76 -1.01 -2.65 0.00 0.00 178.83 176.04 2fxr s HIS 72 N -3.46 0.66 0.15 3.99 3.76 -1.26 -2.54 115.29 116.59 2fxr s HIS 72 Ca -0.07 -0.27 -0.34 0.00 -0.15 0.00 0.00 55.06 54.23 2fxr s HIS 72 Cb 0.09 -0.81 -0.16 0.00 1.11 0.00 0.00 32.58 32.80 2fxr s HIS 72 CO 0.88 -0.38 1.14 1.28 -0.85 0.00 0.00 174.74 176.81 2fxr n LEU 73 N 5.15 1.27 0.00 0.89 4.77 -0.78 -2.27 117.00 126.02 2fxr n LEU 73 Ca -0.07 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.05 2fxr n LEU 73 Cb 0.49 -1.17 0.00 0.00 -2.33 0.00 0.00 43.42 40.41 2fxr n LEU 73 CO 0.11 -1.41 0.00 -1.22 -1.33 0.00 0.00 177.39 173.53 2fxr n TYR 74 N 1.52 0.00 0.35 -1.77 4.01 -1.26 -4.83 117.16 115.18 2fxr n TYR 74 Ca 0.16 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.72 2fxr n TYR 74 Cb 0.23 -0.08 -0.09 0.00 -0.31 0.00 0.00 39.34 39.09 2fxr n TYR 74 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 2fxr h TYR 75 N 0.00 -0.90 -2.00 -0.72 3.20 -1.81 -3.34 116.97 111.40 2fxr h TYR 75 Ca 0.00 -0.01 -0.58 0.00 3.14 0.00 0.00 58.73 61.28 2fxr h TYR 75 Cb 0.00 0.31 -0.42 0.00 1.54 0.00 0.00 36.73 38.16 2fxr h TYR 75 CO 0.00 -0.54 -0.71 1.04 -1.64 0.00 0.00 178.16 176.32 2fxr n GLN 79 N -5.49 3.14 -2.06 1.82 1.13 -1.26 -5.09 117.38 109.57 2fxr n GLN 79 Ca -0.13 -4.64 -0.41 0.00 -1.94 0.00 0.00 57.00 49.87 2fxr n GLN 79 Cb 0.38 -2.19 -0.02 0.00 0.11 0.00 0.00 30.24 28.51 2fxr n GLN 79 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2fxr s ASP 80 N -3.44 6.71 -0.38 1.08 1.11 -1.26 -4.96 116.67 115.54 2fxr s ASP 80 Ca 0.48 2.63 0.11 0.00 0.18 0.00 0.00 52.55 55.94 2fxr s ASP 80 Cb 0.33 -2.62 0.33 0.00 1.07 0.00 0.00 42.92 42.02 2fxr s ASP 80 CO -0.15 -0.65 0.70 0.00 1.18 0.00 0.00 175.17 176.25 2fxr n GLN 81 N 2.16 0.92 -1.63 8.23 6.02 -1.26 -5.12 117.38 126.70 2fxr n GLN 81 Ca 0.06 -3.32 -0.47 0.00 -0.01 0.00 0.00 57.00 53.26 2fxr n GLN 81 Cb 0.41 -1.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.03 2fxr n GLN 81 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2fxr n LEU 82 N 0.50 2.43 -4.39 1.08 4.77 -1.26 -4.77 117.00 115.37 2fxr n LEU 82 Ca 0.24 1.14 -0.34 0.00 -0.03 0.00 0.00 56.01 57.02 2fxr n LEU 82 Cb 0.64 -1.34 -0.14 0.00 -2.33 0.00 0.00 43.42 40.25 2fxr n LEU 82 CO 0.20 -0.81 -0.40 -0.76 -1.33 0.00 0.00 177.39 174.29 2fxr s LEU 83 N 0.39 2.94 0.77 2.23 1.43 0.31 -4.93 118.68 121.81 2fxr s LEU 83 Ca 0.72 -0.29 -0.12 0.00 -1.03 0.00 0.00 54.13 53.41 2fxr s LEU 83 Cb -0.74 -1.71 0.06 0.00 0.03 0.00 0.00 46.19 43.83 2fxr s LEU 83 CO 0.50 0.10 1.11 -2.16 0.23 0.00 0.00 176.35 176.13 2fxr s PRO 84 N 0.74 2.19 -0.05 1.29 0.04 -1.26 -1.46 135.00 136.49 2fxr s PRO 84 Ca -0.03 1.31 0.05 0.00 0.04 0.00 0.00 61.00 62.37 2fxr s PRO 84 Cb -0.15 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 2fxr s PRO 84 CO 0.02 -1.71 -0.21 0.08 0.04 0.00 0.00 177.00 175.21 2fxr s VAL 85 N -2.69 2.44 -0.09 -0.36 1.01 -1.26 -2.92 120.40 116.52 2fxr s VAL 85 Ca 0.64 -0.94 0.20 0.00 0.00 0.00 0.00 61.98 61.88 2fxr s VAL 85 Cb -0.19 -1.91 -0.30 0.00 0.00 0.00 0.00 36.38 33.97 2fxr s VAL 85 CO 0.53 0.57 0.33 -1.54 0.00 0.00 0.00 175.10 174.99 2fxr n SER 86 N 2.68 0.08 -3.75 3.32 3.41 -0.34 -4.79 113.62 114.23 2fxr n SER 86 Ca -0.17 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.31 2fxr n SER 86 Cb 0.52 1.64 -0.11 0.00 -0.26 0.00 0.00 64.21 66.00 2fxr n SER 86 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2fxr s ARG 87 N -3.15 0.40 -0.24 4.33 3.52 -1.15 -5.00 118.95 117.67 2fxr s ARG 87 Ca -0.09 0.52 -0.03 0.00 -0.13 0.00 0.00 55.73 56.00 2fxr s ARG 87 Cb 0.11 0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.68 2fxr s ARG 87 CO 0.87 -0.06 -0.04 0.42 -0.81 0.00 0.00 175.30 175.67 2fxr s ILE 88 N 0.33 3.17 -0.27 4.11 -1.09 -1.26 -1.22 121.20 124.96 2fxr s ILE 88 Ca -0.01 -0.75 0.02 0.00 -2.23 0.00 0.00 60.65 57.67 2fxr s ILE 88 Cb -0.03 -2.53 0.06 0.00 -1.58 0.00 0.00 42.46 38.38 2fxr s ILE 88 CO -0.01 0.30 -0.09 -0.63 -1.23 0.00 0.00 174.94 173.28 2fxr s ILE 89 N 1.41 2.32 -0.12 2.92 1.01 0.14 -4.99 121.20 123.89 2fxr s ILE 89 Ca 0.03 -1.59 -0.03 0.00 0.00 0.00 0.00 60.65 59.07 2fxr s ILE 89 Cb -0.15 -2.36 -0.03 0.00 0.01 0.00 0.00 42.46 39.93 2fxr s ILE 89 CO -0.04 -0.04 -0.01 -0.69 0.00 0.00 0.00 174.94 174.17 2fxr s VAL 90 N 1.13 4.19 -0.08 2.92 1.01 -1.26 0.10 120.40 128.41 2fxr s VAL 90 Ca -0.08 -0.27 -0.33 0.00 0.00 0.00 0.00 61.98 61.30 2fxr s VAL 90 Cb -0.20 -2.80 -0.11 0.00 0.00 0.00 0.00 36.38 33.28 2fxr s VAL 90 CO -0.04 0.55 1.95 1.57 0.00 0.00 0.00 175.10 179.12 2fxr n HIS 91 N 2.78 2.32 0.31 5.22 -0.00 -1.08 -4.81 115.22 119.97 2fxr n HIS 91 Ca -0.18 -0.09 0.10 0.00 0.46 0.00 0.00 57.72 58.00 2fxr n HIS 91 Cb 0.53 -2.70 0.52 0.00 -0.12 0.00 0.00 29.99 28.23 2fxr n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2fxr h PRO 92 N 10.13 0.00 0.00 1.57 0.13 -1.94 0.46 132.00 142.35 2fxr h PRO 92 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2fxr h PRO 92 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2fxr h PRO 92 CO 0.95 0.00 -0.29 1.04 -0.23 0.00 0.00 178.00 179.47 2fxr n GLN 93 N -2.67 0.15 -2.63 0.86 1.13 -1.26 -4.92 117.38 108.04 2fxr n GLN 93 Ca -0.01 0.08 -0.39 0.00 -1.94 0.00 0.00 57.00 54.74 2fxr n GLN 93 Cb 0.56 -1.63 -0.05 0.00 0.11 0.00 0.00 30.24 29.23 2fxr n GLN 93 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 2fxr s PHE 94 N -3.07 3.66 0.00 1.08 5.36 0.15 -4.84 117.98 120.32 2fxr s PHE 94 Ca 0.10 1.77 0.00 0.00 -0.96 0.00 0.00 56.93 57.84 2fxr s PHE 94 Cb 0.15 -3.09 0.00 0.00 -0.34 0.00 0.00 43.02 39.74 2fxr s PHE 94 CO 0.64 -0.11 0.00 0.98 -1.46 0.00 0.00 175.22 175.27 2fxr n TYR 95 N 0.90 -0.91 -4.12 10.12 9.36 -1.26 -4.92 117.16 126.34 2fxr n TYR 95 Ca 0.00 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.12 2fxr n TYR 95 Cb 0.47 0.49 -0.10 0.00 -0.63 0.00 0.00 39.34 39.57 2fxr n TYR 95 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 2fxr s THR 96 N -1.99 0.57 0.18 2.97 -4.23 -1.26 -4.54 115.64 107.34 2fxr s THR 96 Ca 0.00 -1.62 -0.04 0.00 -1.18 0.00 0.00 61.69 58.85 2fxr s THR 96 Cb 0.00 -1.28 -0.06 0.00 1.34 0.00 0.00 72.50 72.50 2fxr s THR 96 CO 0.00 -0.72 1.49 0.00 -0.54 0.00 0.00 174.62 174.85 2fxr h ALA 97 N 3.52 0.67 -0.38 3.99 0.00 -1.98 -2.54 119.26 122.55 2fxr h ALA 97 Ca -0.35 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.02 2fxr h ALA 97 Cb 1.18 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2fxr h ALA 97 CO 0.57 0.69 0.16 1.96 0.00 0.00 0.00 179.25 182.63 2fxr h GLN 98 N 0.43 0.52 -0.01 0.00 7.50 -1.97 -2.84 115.11 118.74 2fxr h GLN 98 Ca 0.00 -0.06 -0.02 0.00 0.50 0.00 0.00 58.65 59.08 2fxr h GLN 98 Cb 1.11 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 28.54 2fxr h GLN 98 CO 0.11 0.42 -0.06 0.82 -1.50 0.00 0.00 178.83 178.62 2fxr h ILE 99 N 0.52 1.51 0.00 2.54 2.04 -1.92 -3.47 117.51 118.73 2fxr h ILE 99 Ca 0.13 -1.58 0.00 0.00 1.00 0.00 0.00 64.86 64.41 2fxr h ILE 99 Cb 0.09 2.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 2fxr h ILE 99 CO -0.02 0.42 0.00 0.61 0.00 0.00 0.00 178.15 179.16 2fxr n GLY 100 N 0.69 1.30 3.17 5.37 0.00 -0.97 -4.99 105.19 109.76 2fxr n GLY 100 Ca -0.09 -1.98 -0.20 0.00 0.00 0.00 0.00 46.02 43.75 2fxr n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fxr n ALA 101 N -1.12 -1.04 -1.89 4.61 0.00 -1.26 -4.37 120.51 115.43 2fxr n ALA 101 Ca 0.00 0.32 -0.42 0.00 0.00 0.00 0.00 53.44 53.34 2fxr n ALA 101 Cb 0.00 -4.44 -0.00 0.00 0.00 0.00 0.00 19.45 15.00 2fxr n ALA 101 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2fxr n ASP 102 N -2.25 4.04 -3.86 0.00 2.03 -1.26 -4.35 116.55 110.90 2fxr n ASP 102 Ca -0.02 -2.85 -0.11 0.00 0.52 0.00 0.00 54.79 52.32 2fxr n ASP 102 Cb 0.57 -1.66 -0.10 0.00 -0.72 0.00 0.00 41.12 39.20 2fxr n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2fxr s ILE 103 N 3.56 0.07 0.15 5.18 2.07 -1.26 -3.67 121.20 127.30 2fxr s ILE 103 Ca 0.49 -0.57 -0.19 0.00 -1.41 0.00 0.00 60.65 58.97 2fxr s ILE 103 Cb 0.12 -0.41 0.05 0.00 0.13 0.00 0.00 42.46 42.34 2fxr s ILE 103 CO -0.04 -0.31 0.51 0.00 -1.91 0.00 0.00 174.94 173.18 2fxr s ALA 104 N -1.14 -1.23 0.00 1.50 0.00 0.29 -2.62 121.76 118.56 2fxr s ALA 104 Ca -0.12 0.16 0.06 0.00 0.00 0.00 0.00 51.96 52.06 2fxr s ALA 104 Cb -0.06 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.84 2fxr s ALA 104 CO 0.01 -0.73 -0.20 -0.51 0.00 0.00 0.00 175.76 174.34 2fxr s LEU 105 N -2.79 2.08 -0.15 0.00 1.43 0.29 -1.79 118.68 117.74 2fxr s LEU 105 Ca 0.03 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2fxr s LEU 105 Cb 0.00 -0.99 0.02 0.00 0.03 0.00 0.00 46.19 45.25 2fxr s LEU 105 CO -0.11 0.21 -0.18 -0.76 0.23 0.00 0.00 176.35 175.74 2fxr s LEU 106 N -0.68 1.94 -0.19 1.79 1.02 0.00 0.26 118.68 122.83 2fxr s LEU 106 Ca 0.07 -0.56 -0.11 0.00 0.02 0.00 0.00 54.13 53.55 2fxr s LEU 106 Cb -0.08 -1.34 -0.05 0.00 0.02 0.00 0.00 46.19 44.75 2fxr s LEU 106 CO 0.00 0.00 0.16 -0.70 0.02 0.00 0.00 176.35 175.83 2fxr s GLU 107 N 1.22 4.18 0.56 1.70 2.12 -0.36 -0.91 118.70 127.21 2fxr s GLU 107 Ca 0.01 -0.16 -0.14 0.00 0.36 0.00 0.00 54.97 55.04 2fxr s GLU 107 Cb -0.14 -3.42 -0.06 0.00 0.26 0.00 0.00 34.13 30.78 2fxr s GLU 107 CO -0.09 0.30 1.00 -0.51 -0.54 0.00 0.00 175.26 175.42 2fxr s LEU 108 N 0.35 3.44 0.47 2.70 1.43 -0.21 -1.20 118.68 125.65 2fxr s LEU 108 Ca 0.10 1.48 0.27 0.00 -1.03 0.00 0.00 54.13 54.94 2fxr s LEU 108 Cb -0.11 -4.47 0.86 0.00 0.03 0.00 0.00 46.19 42.49 2fxr s LEU 108 CO -0.01 -0.71 1.79 -0.33 0.23 0.00 0.00 176.35 177.32 2fxr h GLU 109 N 0.34 0.00 -3.77 1.70 5.08 -1.85 -3.41 114.58 112.67 2fxr h GLU 109 Ca -0.45 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 57.71 2fxr h GLU 109 Cb 1.19 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 30.19 2fxr h GLU 109 CO 0.62 0.10 -0.68 -2.00 -1.00 0.00 0.00 179.01 176.05 2fxr s GLU 110 N -3.48 0.17 0.56 2.33 2.56 -1.26 -5.02 118.70 114.56 2fxr s GLU 110 Ca 0.03 -0.24 -0.18 0.00 0.00 0.00 0.00 54.97 54.58 2fxr s GLU 110 Cb 0.08 0.07 -0.05 0.00 2.00 0.00 0.00 34.13 36.23 2fxr s GLU 110 CO 0.62 -0.03 1.10 -1.25 -0.56 0.00 0.00 175.26 175.14 2fxr s PRO 111 N -0.64 3.33 -0.02 4.30 0.04 -1.26 -4.79 135.00 135.96 2fxr s PRO 111 Ca -0.07 1.48 -0.11 0.00 0.04 0.00 0.00 61.00 62.33 2fxr s PRO 111 Cb -0.04 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.43 2fxr s PRO 111 CO -0.00 -0.84 0.33 0.08 0.04 0.00 0.00 177.00 176.60 2fxr s VAL 112 N -1.99 5.19 -0.27 -0.36 1.01 0.18 -4.97 120.40 119.18 2fxr s VAL 112 Ca 0.70 0.56 -0.25 0.00 0.00 0.00 0.00 61.98 62.98 2fxr s VAL 112 Cb -0.21 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2fxr s VAL 112 CO 0.29 0.53 0.87 -0.54 0.00 0.00 0.00 175.10 176.25 2fxr s LYS 113 N -1.25 4.13 0.30 2.72 3.01 -1.26 -4.75 119.74 122.63 2fxr s LYS 113 Ca 0.23 0.92 -0.10 0.00 -1.01 0.00 0.00 55.97 56.01 2fxr s LYS 113 Cb -0.15 -3.68 -0.07 0.00 -1.01 0.00 0.00 37.83 32.93 2fxr s LYS 113 CO 0.12 -0.61 0.65 0.14 0.51 0.00 0.00 175.35 176.16 2fxr s VAL 114 N 3.01 4.85 0.31 3.17 -7.23 -1.26 -4.95 120.40 118.30 2fxr s VAL 114 Ca 0.37 0.56 -0.05 0.00 -1.81 0.00 0.00 61.98 61.05 2fxr s VAL 114 Cb -0.15 -3.66 0.02 0.00 0.56 0.00 0.00 36.38 33.15 2fxr s VAL 114 CO 0.09 -0.25 0.49 -1.54 -0.31 0.00 0.00 175.10 173.59 2fxr n SER 115 N -0.60 -1.39 0.00 4.85 3.41 -0.64 -4.98 113.62 114.27 2fxr n SER 115 Ca 0.01 -2.53 0.06 0.00 -0.26 0.00 0.00 58.87 56.15 2fxr n SER 115 Cb 0.53 2.49 0.28 0.00 -0.26 0.00 0.00 64.21 67.25 2fxr n SER 115 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2fxr n SER 116 N -1.62 0.00 -0.03 4.04 3.41 -1.26 -1.89 113.62 116.27 2fxr n SER 116 Ca -0.02 0.49 0.04 0.00 -0.26 0.00 0.00 58.87 59.13 2fxr n SER 116 Cb 0.50 -0.49 -0.16 0.00 -0.26 0.00 0.00 64.21 63.80 2fxr n SER 116 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 2fxr n HIS 117 N -1.49 0.00 -3.43 7.33 -0.00 -1.26 -4.82 115.22 111.55 2fxr n HIS 117 Ca 0.03 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.49 2fxr n HIS 117 Cb 0.15 -0.61 -0.11 0.00 -0.00 0.00 0.00 29.99 29.43 2fxr n HIS 117 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 2fxr s VAL 118 N -3.14 0.02 0.27 3.57 1.01 -0.79 -4.52 120.40 116.82 2fxr s VAL 118 Ca -0.08 -1.56 0.02 0.00 0.00 0.00 0.00 61.98 60.36 2fxr s VAL 118 Cb 0.11 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.44 2fxr s VAL 118 CO 0.83 -0.90 0.10 -1.38 0.00 0.00 0.00 175.10 173.76 2fxr s HIS 119 N 1.13 1.56 0.86 5.22 -3.43 -1.19 -1.62 115.29 117.81 2fxr s HIS 119 Ca 0.18 -1.20 -0.12 0.00 -0.80 0.00 0.00 55.06 53.12 2fxr s HIS 119 Cb -0.20 -0.91 0.11 0.00 -1.43 0.00 0.00 32.58 30.15 2fxr s HIS 119 CO -0.00 -0.35 1.10 0.95 -2.00 0.00 0.00 174.74 174.44 2fxr s THR 120 N -3.72 2.68 0.04 -5.38 -4.23 -1.26 -3.08 115.64 100.69 2fxr s THR 120 Ca 0.37 0.22 0.01 0.00 -1.18 0.00 0.00 61.69 61.12 2fxr s THR 120 Cb 0.07 -2.90 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 2fxr s THR 120 CO 0.14 -0.29 0.08 0.54 -0.54 0.00 0.00 174.62 174.55 2fxr s VAL 121 N -3.12 4.63 -0.05 2.29 0.11 -0.15 -4.79 120.40 119.31 2fxr s VAL 121 Ca 0.62 -0.59 -0.27 0.00 -2.93 0.00 0.00 61.98 58.82 2fxr s VAL 121 Cb -0.15 -3.17 -0.03 0.00 -1.53 0.00 0.00 36.38 31.49 2fxr s VAL 121 CO 0.55 0.24 0.85 -0.89 -3.33 0.00 0.00 175.10 172.51 2fxr s THR 122 N -1.29 4.95 0.30 5.04 2.01 -1.25 -4.71 115.64 120.68 2fxr s THR 122 Ca 0.26 1.76 -0.16 0.00 0.31 0.00 0.00 61.69 63.86 2fxr s THR 122 Cb -0.12 -4.18 -0.09 0.00 0.01 0.00 0.00 72.50 68.12 2fxr s THR 122 CO 0.18 0.18 0.73 -0.76 -0.69 0.00 0.00 174.62 174.27 2fxr s LEU 123 N 1.04 4.14 0.58 4.42 1.43 -1.26 -1.47 118.68 127.55 2fxr s LEU 123 Ca 0.44 1.32 -0.15 0.00 -1.03 0.00 0.00 54.13 54.72 2fxr s LEU 123 Cb -0.19 -3.95 -0.05 0.00 0.03 0.00 0.00 46.19 42.03 2fxr s LEU 123 CO 0.22 -0.14 1.02 -2.16 0.23 0.00 0.00 176.35 175.52 2fxr s PRO 124 N -2.71 3.62 0.43 1.29 0.04 -1.26 -4.85 135.00 131.56 2fxr s PRO 124 Ca 0.51 0.97 -0.24 0.00 0.04 0.00 0.00 61.00 62.28 2fxr s PRO 124 Cb -0.12 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.26 2fxr s PRO 124 CO 0.18 -0.55 1.17 -1.25 0.04 0.00 0.00 177.00 176.59 2fxr s PRO 125 N -4.41 3.89 0.64 0.56 0.04 -1.26 -4.87 135.00 129.58 2fxr s PRO 125 Ca 0.59 1.80 0.21 0.00 0.04 0.00 0.00 61.00 63.64 2fxr s PRO 125 Cb -0.12 -2.52 1.00 0.00 0.04 0.00 0.00 34.50 32.91 2fxr s PRO 125 CO 0.40 -0.45 1.53 0.00 0.04 0.00 0.00 177.00 178.52 2fxr h ALA 126 N 2.30 2.05 -0.02 8.56 0.00 -1.96 0.24 119.26 130.42 2fxr h ALA 126 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2fxr h ALA 126 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2fxr h ALA 126 CO 0.61 -0.90 -0.13 -1.13 0.00 0.00 0.00 179.25 177.70 2fxr n SER 127 N -3.04 2.23 -4.77 0.00 3.41 -1.26 -4.92 113.62 105.27 2fxr n SER 127 Ca 0.06 -1.66 -0.40 0.00 -0.26 0.00 0.00 58.87 56.61 2fxr n SER 127 Cb 0.86 0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.90 2fxr n SER 127 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2fxr s GLU 128 N -2.16 4.31 -0.07 4.33 2.56 0.07 -4.97 118.70 122.77 2fxr s GLU 128 Ca 0.28 2.16 0.01 0.00 0.00 0.00 0.00 54.97 57.42 2fxr s GLU 128 Cb 0.20 -3.02 -0.05 0.00 2.00 0.00 0.00 34.13 33.26 2fxr s GLU 128 CO 0.39 -0.21 -0.05 -2.37 -0.56 0.00 0.00 175.26 172.46 2fxr n THR 129 N 0.70 0.42 -2.70 -1.70 5.66 -1.26 -4.94 114.28 110.46 2fxr n THR 129 Ca 0.01 -0.17 -0.04 0.00 -3.05 0.00 0.00 64.05 60.79 2fxr n THR 129 Cb 0.42 -0.77 0.02 0.00 -1.55 0.00 0.00 70.33 68.45 2fxr n THR 129 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2fxr n PHE 130 N -2.65 -2.05 -1.68 1.09 3.72 -1.26 -5.00 117.46 109.64 2fxr n PHE 130 Ca -0.13 0.76 -0.30 0.00 -0.05 0.00 0.00 57.45 57.73 2fxr n PHE 130 Cb 0.65 -3.53 0.07 0.00 -0.94 0.00 0.00 39.48 35.73 2fxr n PHE 130 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2fxr s PRO 131 N -3.39 2.50 0.98 -1.08 0.04 -1.26 -4.94 135.00 127.85 2fxr s PRO 131 Ca 0.13 0.62 -0.15 0.00 0.04 0.00 0.00 61.00 61.65 2fxr s PRO 131 Cb -0.02 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 2fxr s PRO 131 CO 0.55 -1.32 0.03 -2.30 0.04 0.00 0.00 177.00 174.00 2fxr n PRO 132 N -3.23 -0.35 -1.04 0.56 -0.02 -1.26 -2.94 135.00 126.71 2fxr n PRO 132 Ca 0.07 -0.07 -0.01 0.00 -2.02 0.00 0.00 63.50 61.46 2fxr n PRO 132 Cb 0.56 -1.62 -0.01 0.00 -0.02 0.00 0.00 33.50 32.41 2fxr n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2fxr n GLY 133 N 2.06 0.51 3.91 -1.23 0.00 -1.26 -5.03 105.19 104.16 2fxr n GLY 133 Ca 0.04 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 2fxr n GLY 133 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2fxr s MET 134 N -1.34 3.41 -0.59 1.61 0.00 -1.15 -5.05 119.30 116.18 2fxr s MET 134 Ca 0.00 -0.46 -0.25 0.00 0.00 0.00 0.00 55.69 54.98 2fxr s MET 134 Cb 0.00 -3.02 0.04 0.00 0.00 0.00 0.00 34.83 31.85 2fxr s MET 134 CO 0.00 0.60 1.03 -2.14 0.00 0.00 0.00 175.02 174.51 2fxr s PRO 135 N -2.55 3.32 0.06 4.11 0.02 -1.26 -4.64 135.00 134.05 2fxr s PRO 135 Ca 0.35 -0.24 0.07 0.00 0.02 0.00 0.00 61.00 61.20 2fxr s PRO 135 Cb -0.13 -4.08 -0.03 0.00 0.02 0.00 0.00 34.50 30.28 2fxr s PRO 135 CO 0.28 -1.65 -0.18 0.00 -0.33 0.00 0.00 177.00 175.12 2fxr s TRP 137 N -0.97 1.28 -0.03 0.00 0.52 0.20 -1.89 118.94 118.05 2fxr s TRP 137 Ca 0.05 -0.47 0.04 0.00 0.02 0.00 0.00 56.10 55.73 2fxr s TRP 137 Cb -0.09 -0.71 -0.00 0.00 -1.15 0.00 0.00 33.47 31.52 2fxr s TRP 137 CO 0.02 0.08 -0.13 0.54 0.02 0.00 0.00 176.95 177.48 2fxr s VAL 138 N -1.38 1.11 0.20 4.03 0.11 -0.82 -0.20 120.40 123.45 2fxr s VAL 138 Ca -0.00 -0.55 0.07 0.00 -2.93 0.00 0.00 61.98 58.57 2fxr s VAL 138 Cb -0.09 -0.96 -0.05 0.00 -1.53 0.00 0.00 36.38 33.75 2fxr s VAL 138 CO 0.02 0.33 -0.13 0.42 -3.33 0.00 0.00 175.10 172.41 2fxr s THR 139 N 0.05 1.61 0.00 5.04 -4.23 -1.22 -2.00 115.64 114.88 2fxr s THR 139 Ca -0.02 -2.18 0.00 0.00 -1.18 0.00 0.00 61.69 58.31 2fxr s THR 139 Cb -0.09 -2.03 0.00 0.00 1.34 0.00 0.00 72.50 71.72 2fxr s THR 139 CO 0.01 -0.61 0.00 0.61 -0.54 0.00 0.00 174.62 174.09 2fxr n GLY 140 N -0.35 0.19 1.24 3.99 0.00 -0.79 -4.52 105.19 104.94 2fxr n GLY 140 Ca -0.08 -1.24 0.08 0.00 0.00 0.00 0.00 46.02 44.78 2fxr n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2fxr n TRP 141 N -0.99 1.30 -1.31 1.61 8.01 -1.26 -2.06 117.44 122.74 2fxr n TRP 141 Ca 0.00 -0.77 -0.29 0.00 -1.31 0.00 0.00 57.50 55.13 2fxr n TRP 141 Cb 0.00 -0.34 0.23 0.00 -2.01 0.00 0.00 31.31 29.19 2fxr n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2fxr n GLY 142 N 0.08 -2.36 3.63 6.99 0.00 -1.26 -4.64 105.19 107.64 2fxr n GLY 142 Ca 0.23 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 2fxr n GLY 142 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fxr n ASP 143 N -4.49 1.32 -0.47 1.61 8.00 0.59 -2.69 116.55 120.42 2fxr n ASP 143 Ca 0.15 0.97 0.11 0.00 0.71 0.00 0.00 54.79 56.74 2fxr n ASP 143 Cb 0.56 -1.39 0.44 0.00 -0.02 0.00 0.00 41.12 40.72 2fxr n ASP 143 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2fxr n VAL 144 N -0.83 0.14 0.00 2.53 0.24 -0.16 -2.14 118.33 118.10 2fxr n VAL 144 Ca 0.10 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 2fxr n VAL 144 Cb 0.42 0.32 0.00 0.00 -1.47 0.00 0.00 33.84 33.11 2fxr n VAL 144 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2fxr n ASP 145 N 0.15 0.00 -4.66 -1.34 -0.08 -1.23 -4.48 116.55 104.91 2fxr n ASP 145 Ca 0.17 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 53.02 2fxr n ASP 145 Cb 0.31 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.73 2fxr n ASP 145 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2fxr n ASN 146 N 0.00 4.08 -3.57 1.67 3.02 -1.26 -2.39 115.26 116.81 2fxr n ASN 146 Ca 0.00 0.91 -0.22 0.00 -0.03 0.00 0.00 54.58 55.25 2fxr n ASN 146 Cb 0.00 -1.51 0.05 0.00 -0.61 0.00 0.00 39.78 37.71 2fxr n ASN 146 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2fxr n ASP 147 N 7.33 -3.30 -3.28 6.41 -0.08 -1.26 -4.98 116.55 117.40 2fxr n ASP 147 Ca 0.20 -0.82 -0.07 0.00 -1.51 0.00 0.00 54.79 52.60 2fxr n ASP 147 Cb 0.39 -4.28 -0.04 0.00 2.34 0.00 0.00 41.12 39.53 2fxr n ASP 147 CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2fxr s GLU 149 N -5.57 0.72 0.77 -0.67 2.12 -1.01 -5.10 118.70 109.96 2fxr s GLU 149 Ca 0.20 -0.48 -0.13 0.00 0.36 0.00 0.00 54.97 54.92 2fxr s GLU 149 Cb -0.05 -0.26 0.06 0.00 0.26 0.00 0.00 34.13 34.14 2fxr s GLU 149 CO 0.80 -1.18 1.17 1.03 -0.54 0.00 0.00 175.26 176.53 2fxr s ARG 150 N 1.72 1.98 0.00 4.30 1.81 -1.26 -0.99 118.95 126.52 2fxr s ARG 150 Ca 0.16 1.60 0.00 0.00 -1.72 0.00 0.00 55.73 55.77 2fxr s ARG 150 Cb -0.09 -1.83 0.00 0.00 -0.45 0.00 0.00 34.95 32.58 2fxr s ARG 150 CO -0.07 -1.92 0.00 -0.11 -0.68 0.00 0.00 175.30 172.52 2fxr n LEU 151 N -3.12 0.00 -0.02 2.53 7.94 -1.26 -4.54 117.00 118.54 2fxr n LEU 151 Ca 0.12 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 2fxr n LEU 151 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 2fxr n LEU 151 CO 0.49 -0.36 0.00 -0.81 -1.11 0.00 0.00 177.39 175.60 2fxr n PRO 152 N -0.21 0.00 -2.80 1.96 -0.04 -1.26 -4.99 135.00 127.67 2fxr n PRO 152 Ca 0.00 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2fxr n PRO 152 Cb 0.00 -0.37 0.00 0.00 -0.04 0.00 0.00 33.50 33.09 2fxr n PRO 152 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2fxr n PHE 153 N 0.00 -2.46 -2.87 0.54 3.72 -1.26 -3.94 117.46 111.19 2fxr n PHE 153 Ca 0.00 0.94 -0.32 0.00 -0.05 0.00 0.00 57.45 58.02 2fxr n PHE 153 Cb 0.00 -3.68 -0.05 0.00 -0.94 0.00 0.00 39.48 34.81 2fxr n PHE 153 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2fxr s PRO 154 N -3.03 3.98 0.14 -1.08 0.04 -1.26 -1.87 135.00 131.91 2fxr s PRO 154 Ca 0.01 0.76 -0.31 0.00 0.04 0.00 0.00 61.00 61.51 2fxr s PRO 154 Cb -0.00 -2.31 -0.08 0.00 0.04 0.00 0.00 34.50 32.14 2fxr s PRO 154 CO 0.62 -0.01 1.38 -1.17 0.04 0.00 0.00 177.00 177.86 2fxr s LEU 155 N -3.44 4.38 0.31 -3.56 2.96 -1.05 -4.78 118.68 113.50 2fxr s LEU 155 Ca 0.56 2.36 0.09 0.00 -0.22 0.00 0.00 54.13 56.92 2fxr s LEU 155 Cb -0.10 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2fxr s LEU 155 CO 0.23 -0.64 0.03 -0.54 -1.32 0.00 0.00 176.35 174.11 2fxr s LYS 156 N 0.81 2.20 0.04 1.98 1.02 -0.88 -1.09 119.74 123.83 2fxr s LYS 156 Ca 0.63 -1.58 -0.02 0.00 0.02 0.00 0.00 55.97 55.01 2fxr s LYS 156 Cb -0.37 -2.06 -0.02 0.00 -0.52 0.00 0.00 37.83 34.85 2fxr s LYS 156 CO 0.32 0.22 0.01 1.14 -0.92 0.00 0.00 175.35 176.13 2fxr s GLN 157 N -3.72 0.52 -0.26 1.68 -2.07 -0.99 -1.89 119.66 112.93 2fxr s GLN 157 Ca 0.34 -0.90 -0.21 0.00 -1.82 0.00 0.00 55.36 52.76 2fxr s GLN 157 Cb -0.03 0.19 0.07 0.00 -1.09 0.00 0.00 33.01 32.15 2fxr s GLN 157 CO 0.20 -0.11 0.68 0.54 -1.32 0.00 0.00 175.29 175.28 2fxr s VAL 158 N -2.84 -0.00 -0.18 3.63 0.11 -0.85 -2.34 120.40 117.94 2fxr s VAL 158 Ca -0.03 0.00 -0.26 0.00 -2.93 0.00 0.00 61.98 58.76 2fxr s VAL 158 Cb 0.00 -0.95 -0.01 0.00 -1.53 0.00 0.00 36.38 33.89 2fxr s VAL 158 CO -0.06 0.00 0.89 -0.75 -3.33 0.00 0.00 175.10 171.85 2fxr s LYS 159 N 0.70 4.29 -0.10 1.54 2.20 -1.26 -1.95 119.74 125.17 2fxr s LYS 159 Ca -0.03 1.11 0.02 0.00 -0.36 0.00 0.00 55.97 56.71 2fxr s LYS 159 Cb -0.05 -3.59 -0.02 0.00 -1.51 0.00 0.00 37.83 32.66 2fxr s LYS 159 CO -0.05 -0.40 -0.15 0.14 -0.36 0.00 0.00 175.35 174.53 2fxr s VAL 160 N 2.39 2.89 0.03 4.02 -7.23 -0.79 -4.92 120.40 116.79 2fxr s VAL 160 Ca 0.40 -0.74 -0.30 0.00 -1.81 0.00 0.00 61.98 59.52 2fxr s VAL 160 Cb -0.16 -2.17 -0.06 0.00 0.56 0.00 0.00 36.38 34.55 2fxr s VAL 160 CO 0.11 0.55 1.32 -2.16 -0.31 0.00 0.00 175.10 174.62 2fxr s PRO 161 N -0.03 4.33 0.05 4.82 0.04 -1.26 -4.40 135.00 138.56 2fxr s PRO 161 Ca -0.04 1.90 -0.18 0.00 0.04 0.00 0.00 61.00 62.72 2fxr s PRO 161 Cb -0.14 -3.45 -0.06 0.00 0.04 0.00 0.00 34.50 30.88 2fxr s PRO 161 CO 0.04 -0.46 0.53 0.42 0.04 0.00 0.00 177.00 177.58 2fxr s ILE 162 N 1.80 4.81 0.11 0.56 1.01 -1.26 -1.09 121.20 127.14 2fxr s ILE 162 Ca 0.62 1.14 0.05 0.00 0.00 0.00 0.00 60.65 62.46 2fxr s ILE 162 Cb -0.31 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 2fxr s ILE 162 CO 0.27 0.56 -0.13 -0.04 0.00 0.00 0.00 174.94 175.59 2fxr s MET 163 N -1.07 0.98 0.45 2.79 -1.94 -1.09 -4.12 119.30 115.30 2fxr s MET 163 Ca 0.28 -1.21 -0.24 0.00 -1.71 0.00 0.00 55.69 52.81 2fxr s MET 163 Cb -0.19 -0.84 -0.07 0.00 2.01 0.00 0.00 34.83 35.74 2fxr s MET 163 CO 0.18 0.16 1.29 -1.21 -0.01 0.00 0.00 175.02 175.42 2fxr s GLU 164 N -2.63 3.71 0.22 2.03 2.02 -1.26 -4.40 118.70 118.39 2fxr s GLU 164 Ca 0.08 2.10 -0.09 0.00 0.02 0.00 0.00 54.97 57.07 2fxr s GLU 164 Cb -0.05 -2.55 0.35 0.00 0.10 0.00 0.00 34.13 31.98 2fxr s GLU 164 CO 0.02 -0.68 1.67 -0.91 0.02 0.00 0.00 175.26 175.38 2fxr h ASN 165 N 2.23 -0.21 0.37 -0.19 -0.26 -1.93 -0.80 115.58 114.80 2fxr h ASN 165 Ca -0.50 0.16 -0.01 0.00 -0.56 0.00 0.00 56.30 55.38 2fxr h ASN 165 Cb 1.26 0.26 -0.00 0.00 -1.06 0.00 0.00 38.32 38.78 2fxr h ASN 165 CO 0.61 -0.10 -0.06 1.12 -1.06 0.00 0.00 177.43 177.93 2fxr h HIS 166 N 0.15 0.00 -0.07 1.19 2.07 -1.91 0.83 115.15 117.41 2fxr h HIS 166 Ca 0.36 0.00 -0.23 0.00 -2.85 0.00 0.00 60.37 57.64 2fxr h HIS 166 Cb 0.59 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.58 2fxr h HIS 166 CO -0.35 0.06 -0.88 0.82 -3.07 0.00 0.00 177.93 174.52 2fxr h ILE 167 N 0.00 1.31 0.02 6.12 1.08 -1.52 -2.54 117.51 121.98 2fxr h ILE 167 Ca -0.00 -2.16 -0.23 0.00 -0.39 0.00 0.00 64.86 62.09 2fxr h ILE 167 Cb 0.27 2.19 -0.00 0.00 -3.07 0.00 0.00 36.82 36.21 2fxr h ILE 167 CO 0.01 0.67 -0.97 0.00 -0.69 0.00 0.00 178.15 177.17 2fxr h ASP 169 N 0.17 0.96 0.17 0.00 3.58 -0.86 -1.04 116.42 119.40 2fxr h ASP 169 Ca -0.08 -0.10 -0.14 0.00 0.42 0.00 0.00 57.03 57.13 2fxr h ASP 169 Cb 1.62 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 42.41 2fxr h ASP 169 CO 0.16 0.81 -0.50 0.00 -2.88 0.00 0.00 179.24 176.83 2fxr h ALA 170 N 1.34 0.88 -0.24 -0.78 0.00 -1.44 -2.99 119.26 116.04 2fxr h ALA 170 Ca 0.26 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 2fxr h ALA 170 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2fxr h ALA 170 CO -0.03 0.66 -0.16 0.87 0.00 0.00 0.00 179.25 180.59 2fxr h LYS 171 N 0.30 0.53 0.00 0.00 1.57 -1.13 -2.65 116.57 115.19 2fxr h LYS 171 Ca 0.01 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2fxr h LYS 171 Cb 0.98 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2fxr h LYS 171 CO 0.08 0.82 0.00 1.88 -0.57 0.00 0.00 179.45 181.66 2fxr h TYR 172 N 0.24 0.00 0.00 -1.35 -1.99 -1.16 0.26 116.97 112.97 2fxr h TYR 172 Ca 0.05 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.78 2fxr h TYR 172 Cb 0.68 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.41 2fxr h TYR 172 CO 0.07 0.00 -0.40 0.45 -0.00 0.00 0.00 178.16 178.28 2fxr h HIS 173 N 0.00 0.00 -3.57 4.88 3.86 -1.32 -3.44 115.15 115.56 2fxr h HIS 173 Ca 0.00 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.69 2fxr h HIS 173 Cb 0.05 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.54 2fxr h HIS 173 CO 0.00 0.00 0.55 -0.51 0.86 0.00 0.00 177.93 178.83 2fxr s LEU 173 N -5.13 4.47 -1.01 2.43 1.43 0.08 -2.55 118.68 118.39 2fxr s LEU 173 Ca 0.06 2.28 0.00 0.00 -1.03 0.00 0.00 54.13 55.44 2fxr s LEU 173 Cb 0.10 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2fxr s LEU 173 CO 0.70 -0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.54 2fxr n GLY 173 N 1.90 0.31 3.02 -3.19 0.00 -1.26 -5.01 105.19 100.95 2fxr n GLY 173 Ca 0.03 -0.46 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 2fxr n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fxr s ALA 173 N -2.51 0.45 -0.46 4.61 0.00 -1.06 -5.04 121.76 117.76 2fxr s ALA 173 Ca 0.00 -0.60 0.26 0.00 0.00 0.00 0.00 51.96 51.62 2fxr s ALA 173 Cb 0.00 0.03 0.71 0.00 0.00 0.00 0.00 23.12 23.86 2fxr s ALA 173 CO 0.00 -0.02 1.73 1.88 0.00 0.00 0.00 175.76 179.35 2fxr h TYR 173 N 4.89 0.00 -3.02 0.00 0.05 -1.95 -3.46 116.97 113.47 2fxr h TYR 173 Ca -0.33 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 57.92 2fxr h TYR 173 Cb 1.20 0.00 0.07 0.00 1.01 0.00 0.00 36.73 39.02 2fxr h TYR 173 CO 0.59 0.00 0.95 0.99 -1.05 0.00 0.00 178.16 179.65 2fxr s THR 173 N -3.25 2.01 0.00 -2.88 2.01 -1.26 -5.19 115.64 107.08 2fxr s THR 173 Ca 0.07 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.08 2fxr s THR 173 Cb 0.08 -3.01 0.00 0.00 0.01 0.00 0.00 72.50 69.59 2fxr s THR 173 CO 0.60 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.14 2fxr n GLY 173 N 3.00 -3.41 0.00 4.40 0.00 -1.26 -4.94 105.19 102.97 2fxr n GLY 173 Ca 0.12 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2fxr n GLY 173 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fxr n ASP 173 N 0.00 0.00 -4.29 1.61 10.43 -1.26 -4.72 116.55 118.32 2fxr n ASP 173 Ca 0.00 0.00 -0.45 0.00 2.57 0.00 0.00 54.79 56.91 2fxr n ASP 173 Cb 0.00 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 42.91 2fxr n ASP 173 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2fxr s VAL 173 N 0.00 5.08 0.20 2.53 1.01 -1.26 -5.05 120.40 122.91 2fxr s VAL 173 Ca 0.00 -1.70 -0.32 0.00 0.00 0.00 0.00 61.98 59.95 2fxr s VAL 173 Cb 0.00 -4.25 -0.14 0.00 0.00 0.00 0.00 36.38 31.99 2fxr s VAL 173 CO 0.00 -0.88 1.33 0.54 0.00 0.00 0.00 175.10 176.09 2fxr n ARG 174 N 4.99 1.66 -0.04 2.72 5.12 -1.26 -4.93 116.66 124.92 2fxr n ARG 174 Ca -0.09 0.59 -0.09 0.00 -1.93 0.00 0.00 57.85 56.34 2fxr n ARG 174 Cb 0.41 -2.20 -0.03 0.00 -1.16 0.00 0.00 32.46 29.48 2fxr n ARG 174 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2fxr n ILE 175 N 1.94 1.05 -2.89 0.55 5.41 -1.26 -4.87 119.36 119.29 2fxr n ILE 175 Ca 0.14 0.06 -0.43 0.00 1.00 0.00 0.00 62.75 63.52 2fxr n ILE 175 Cb 0.28 -1.81 -0.05 0.00 -0.71 0.00 0.00 39.64 37.35 2fxr n ILE 175 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2fxr s VAL 176 N -2.33 4.54 0.61 1.39 1.01 -1.26 -5.00 120.40 119.36 2fxr s VAL 176 Ca -0.16 0.56 -0.05 0.00 0.00 0.00 0.00 61.98 62.33 2fxr s VAL 176 Cb 0.04 -4.40 0.02 0.00 0.00 0.00 0.00 36.38 32.05 2fxr s VAL 176 CO 0.21 -0.81 0.91 -0.13 0.00 0.00 0.00 175.10 175.28 2fxr s ARG 177 N 3.57 2.75 0.49 2.72 0.52 -1.26 -4.83 118.95 122.90 2fxr s ARG 177 Ca 0.33 -0.12 0.16 0.00 -0.52 0.00 0.00 55.73 55.57 2fxr s ARG 177 Cb -0.11 -2.28 1.18 0.00 0.52 0.00 0.00 34.95 34.26 2fxr s ARG 177 CO 0.24 -0.80 2.08 -0.44 0.02 0.00 0.00 175.30 176.40 2fxr h ASP 178 N -0.23 0.15 -0.33 0.23 3.32 -1.98 -0.35 116.42 117.24 2fxr h ASP 178 Ca -0.45 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.47 2fxr h ASP 178 Cb 1.27 -0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.71 2fxr h ASP 178 CO 0.60 0.10 0.16 -0.90 -1.72 0.00 0.00 179.24 177.48 2fxr n ASP 179 N -4.49 3.13 -4.29 6.45 5.75 -1.26 -4.84 116.55 117.00 2fxr n ASP 179 Ca 0.03 -2.53 -0.16 0.00 -0.01 0.00 0.00 54.79 52.12 2fxr n ASP 179 Cb 0.23 -0.61 -0.10 0.00 -1.03 0.00 0.00 41.12 39.61 2fxr n ASP 179 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2fxr s MET 180 N -1.41 1.19 -0.01 0.11 -1.94 -0.14 -1.67 119.30 115.42 2fxr s MET 180 Ca 0.22 -1.54 -0.03 0.00 -1.71 0.00 0.00 55.69 52.63 2fxr s MET 180 Cb 0.18 -0.72 -0.00 0.00 2.01 0.00 0.00 34.83 36.30 2fxr s MET 180 CO 0.05 0.05 0.06 -1.17 -0.01 0.00 0.00 175.02 174.00 2fxr s LEU 181 N -3.23 1.82 0.04 -0.03 0.20 0.32 -4.59 118.68 113.22 2fxr s LEU 181 Ca 0.21 -0.07 0.08 0.00 0.69 0.00 0.00 54.13 55.04 2fxr s LEU 181 Cb 0.03 0.28 -0.03 0.00 -0.43 0.00 0.00 46.19 46.04 2fxr s LEU 181 CO 0.04 -0.15 -0.23 0.00 -0.29 0.00 0.00 176.35 175.72 2fxr s ALA 183 N -0.80 -0.85 0.00 0.00 0.00 -0.75 -2.68 121.76 116.67 2fxr s ALA 183 Ca 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2fxr s ALA 183 Cb -0.09 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.76 2fxr s ALA 183 CO 0.02 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.52 2fxr n GLY 184 N -0.24 1.75 0.00 0.00 0.00 -0.25 -1.36 105.19 105.09 2fxr n GLY 184 Ca -0.14 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2fxr n GLY 184 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2fxr n ASN 185 N -0.20 0.15 0.00 1.61 0.23 0.07 -4.56 115.26 112.57 2fxr n ASN 185 Ca 0.00 -0.57 0.08 0.00 -0.53 0.00 0.00 54.58 53.55 2fxr n ASN 185 Cb 0.00 0.00 0.43 0.00 -2.08 0.00 0.00 39.78 38.13 2fxr n ASN 185 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2fxr n THR 186 N 0.00 0.21 0.00 5.53 -2.24 -1.26 -2.89 114.28 113.63 2fxr n THR 186 Ca 0.00 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 2fxr n THR 186 Cb 0.00 -0.81 0.00 0.00 -2.10 0.00 0.00 70.33 67.42 2fxr n THR 186 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2fxr n ARG 187 N -1.10 0.89 -3.93 -0.78 1.74 -1.26 -4.85 116.66 107.36 2fxr n ARG 187 Ca 0.10 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.93 2fxr n ARG 187 Cb 0.08 -0.93 -0.17 0.00 -1.02 0.00 0.00 32.46 30.42 2fxr n ARG 187 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2fxr s ARG 188 N -1.71 1.16 0.17 5.56 0.52 -1.14 -3.66 118.95 119.85 2fxr s ARG 188 Ca 0.00 -0.13 -0.23 0.00 -0.52 0.00 0.00 55.73 54.85 2fxr s ARG 188 Cb 0.00 -1.30 0.07 0.00 0.52 0.00 0.00 34.95 34.25 2fxr s ARG 188 CO 0.00 -0.24 1.02 0.34 0.02 0.00 0.00 175.30 176.43 2fxr s ASP 189 N 1.65 -0.06 0.21 0.23 -1.08 -0.91 -0.75 116.67 115.96 2fxr s ASP 189 Ca 0.02 -0.57 0.07 0.00 -0.52 0.00 0.00 52.55 51.55 2fxr s ASP 189 Cb -0.13 0.49 -0.04 0.00 -1.46 0.00 0.00 42.92 41.78 2fxr s ASP 189 CO -0.06 -0.95 0.10 -0.94 0.52 0.00 0.00 175.17 173.84 2fxr s SER 190 N -3.21 5.17 0.15 -0.34 1.04 -1.26 0.19 113.70 115.44 2fxr s SER 190 Ca 0.18 -0.32 0.02 0.00 0.48 0.00 0.00 55.95 56.31 2fxr s SER 190 Cb -0.02 -1.22 -0.01 0.00 0.10 0.00 0.00 66.02 64.87 2fxr s SER 190 CO 0.04 0.03 0.08 0.00 0.98 0.00 0.00 173.24 174.37 2fxr n GLN 192 N -0.32 1.50 0.00 0.00 3.00 -1.26 -1.32 117.38 118.98 2fxr n GLN 192 Ca 0.00 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.53 2fxr n GLN 192 Cb 0.24 -2.19 0.00 0.00 0.00 0.00 0.00 30.24 28.30 2fxr n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2fxr n GLY 193 N 2.60 2.55 0.11 1.08 0.00 -1.26 -0.30 105.19 109.98 2fxr n GLY 193 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2fxr n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2fxr h ASP 194 N 0.35 0.00 -1.21 1.61 3.32 -1.53 -3.34 116.42 115.62 2fxr h ASP 194 Ca 0.00 -0.08 -0.76 0.00 0.02 0.00 0.00 57.03 56.21 2fxr h ASP 194 Cb 0.00 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.60 2fxr h ASP 194 CO 0.00 0.04 0.24 -1.20 -1.72 0.00 0.00 179.24 176.60 2fxr n SER 195 N -2.46 0.61 0.00 6.45 7.64 -1.26 -1.30 113.62 123.30 2fxr n SER 195 Ca 0.03 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.06 2fxr n SER 195 Cb 0.48 -1.00 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 2fxr n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2fxr n GLY 196 N 2.04 1.86 3.73 0.23 0.00 0.10 0.01 105.19 113.16 2fxr n GLY 196 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2fxr n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fxr s GLY 197 N -2.11 1.67 0.42 -0.02 0.00 -0.42 -3.44 107.32 103.42 2fxr s GLY 197 Ca 0.00 -1.09 -0.02 0.00 0.00 0.00 0.00 44.72 43.61 2fxr s GLY 197 CO 0.00 -0.24 0.67 2.56 0.00 0.00 0.00 173.10 176.10 2fxr s PRO 198 N -5.63 3.51 -0.26 2.90 0.04 -1.26 -2.10 135.00 132.20 2fxr s PRO 198 Ca 0.73 -0.06 -0.01 0.00 0.04 0.00 0.00 61.00 61.70 2fxr s PRO 198 Cb -0.07 -2.51 0.08 0.00 0.04 0.00 0.00 34.50 32.04 2fxr s PRO 198 CO 0.55 -0.04 0.05 -1.17 0.04 0.00 0.00 177.00 176.43 2fxr s LEU 199 N -4.54 2.08 0.00 -3.56 0.20 -0.75 -3.40 118.68 108.72 2fxr s LEU 199 Ca 0.44 -1.34 0.01 0.00 0.69 0.00 0.00 54.13 53.93 2fxr s LEU 199 Cb -0.10 -0.87 -0.04 0.00 -0.43 0.00 0.00 46.19 44.75 2fxr s LEU 199 CO 0.41 -0.35 0.02 0.68 -0.29 0.00 0.00 176.35 176.81 2fxr s VAL 200 N 1.62 4.28 -0.03 1.68 -7.23 0.71 -0.75 120.40 120.69 2fxr s VAL 200 Ca 0.04 -0.57 0.02 0.00 -1.81 0.00 0.00 61.98 59.66 2fxr s VAL 200 Cb -0.18 -2.93 0.01 0.00 0.56 0.00 0.00 36.38 33.84 2fxr s VAL 200 CO -0.16 0.36 -0.08 0.00 -0.31 0.00 0.00 175.10 174.90 2fxr s LYS 202 N 0.28 4.26 -0.22 0.00 2.47 -1.00 -1.56 119.74 123.96 2fxr s LYS 202 Ca -0.04 1.21 0.00 0.00 -1.56 0.00 0.00 55.97 55.58 2fxr s LYS 202 Cb -0.09 -3.63 0.06 0.00 -1.46 0.00 0.00 37.83 32.71 2fxr s LYS 202 CO 0.00 -0.54 -0.04 0.08 0.16 0.00 0.00 175.35 175.02 2fxr s VAL 203 N 2.88 1.34 -1.22 4.02 1.01 0.18 -4.68 120.40 123.93 2fxr s VAL 203 Ca 0.41 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 2fxr s VAL 203 Cb -0.16 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2fxr s VAL 203 CO 0.08 -0.10 0.78 0.59 0.00 0.00 0.00 175.10 176.45 2fxr n ASN 204 N 4.75 -2.99 0.00 3.32 3.02 -1.26 -2.34 115.26 119.76 2fxr n ASN 204 Ca -0.12 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 2fxr n ASN 204 Cb 0.45 -4.20 0.00 0.00 -0.61 0.00 0.00 39.78 35.42 2fxr n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fxr n GLY 205 N -1.50 1.86 3.45 7.41 0.00 -1.26 -5.00 105.19 110.15 2fxr n GLY 205 Ca -0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.52 2fxr n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2fxr s THR 206 N -2.98 2.61 -0.14 2.61 2.01 -0.99 -5.12 115.64 113.64 2fxr s THR 206 Ca 0.00 -1.71 -0.13 0.00 0.31 0.00 0.00 61.69 60.16 2fxr s THR 206 Cb 0.00 -2.21 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 2fxr s THR 206 CO 0.00 0.03 0.30 0.26 -0.69 0.00 0.00 174.62 174.52 2fxr s TRP 207 N -1.29 3.50 -0.02 4.92 0.52 -1.26 0.50 118.94 125.81 2fxr s TRP 207 Ca 0.18 0.64 0.06 0.00 0.02 0.00 0.00 56.10 57.00 2fxr s TRP 207 Cb -0.10 -2.31 -0.01 0.00 -1.15 0.00 0.00 33.47 29.90 2fxr s TRP 207 CO 0.09 0.32 -0.19 -0.51 0.02 0.00 0.00 176.95 176.69 2fxr s LEU 208 N 0.17 2.02 -0.60 2.99 1.43 -0.60 -3.86 118.68 120.23 2fxr s LEU 208 Ca 0.17 -0.35 -0.26 0.00 -1.03 0.00 0.00 54.13 52.66 2fxr s LEU 208 Cb -0.13 -0.98 0.04 0.00 0.03 0.00 0.00 46.19 45.14 2fxr s LEU 208 CO 0.05 0.22 1.12 -1.58 0.23 0.00 0.00 176.35 176.39 2fxr s GLN 209 N -0.36 3.39 0.03 1.70 0.74 -0.54 -1.77 119.66 122.85 2fxr s GLN 209 Ca 0.05 -0.04 -0.20 0.00 0.05 0.00 0.00 55.36 55.23 2fxr s GLN 209 Cb -0.08 -4.06 -0.16 0.00 1.10 0.00 0.00 33.01 29.80 2fxr s GLN 209 CO -0.00 -1.70 1.27 0.00 -0.55 0.00 0.00 175.29 174.31 2fxr h ALA 210 N 9.54 0.19 -2.97 1.58 0.00 -1.30 -3.39 119.26 122.92 2fxr h ALA 210 Ca -0.26 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.08 2fxr h ALA 210 Cb 1.06 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 2fxr h ALA 210 CO 1.17 0.19 0.03 0.20 0.00 0.00 0.00 179.25 180.84 2fxr s GLY 211 N -3.64 1.03 -0.12 0.00 0.00 -1.12 -1.56 107.32 101.91 2fxr s GLY 211 Ca -0.14 -1.20 0.03 0.00 0.00 0.00 0.00 44.72 43.41 2fxr s GLY 211 CO 0.77 -0.69 -0.21 0.14 0.00 0.00 0.00 173.10 173.11 2fxr s VAL 212 N -2.58 2.27 -0.10 1.40 1.01 -0.84 -1.81 120.40 119.75 2fxr s VAL 212 Ca 0.24 -0.93 -0.36 0.00 0.00 0.00 0.00 61.98 60.93 2fxr s VAL 212 Cb -0.03 -1.90 -0.13 0.00 0.00 0.00 0.00 36.38 34.32 2fxr s VAL 212 CO 0.17 0.55 1.78 0.52 0.00 0.00 0.00 175.10 178.12 2fxr n VAL 213 N 3.65 0.41 0.00 2.92 0.31 -0.89 -1.24 118.33 123.49 2fxr n VAL 213 Ca -0.19 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2fxr n VAL 213 Cb 0.53 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 2fxr n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2fxr n SER 214 N 5.73 0.00 -2.59 4.52 2.88 -1.07 -0.72 113.62 122.37 2fxr n SER 214 Ca 0.23 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.65 2fxr n SER 214 Cb 0.25 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.68 2fxr n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2fxr n TRP 215 N -0.99 -1.23 0.00 0.66 4.27 -0.98 -4.87 117.44 114.31 2fxr n TRP 215 Ca 0.00 -1.88 0.00 0.00 -3.89 0.00 0.00 57.50 51.73 2fxr n TRP 215 Cb 0.00 0.43 0.00 0.00 -1.36 0.00 0.00 31.31 30.38 2fxr n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2fxr n GLY 216 N -0.46 1.47 3.47 -1.67 0.00 -1.26 -1.12 105.19 105.62 2fxr n GLY 216 Ca 0.01 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 2fxr n GLY 216 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2fxr s GLU 217 N -2.00 3.16 2.84 1.61 2.12 -1.26 -4.87 118.70 120.29 2fxr s GLU 217 Ca 0.00 -0.72 0.00 0.00 0.36 0.00 0.00 54.97 54.61 2fxr s GLU 217 Cb 0.00 -4.18 0.00 0.00 0.26 0.00 0.00 34.13 30.21 2fxr s GLU 217 CO 0.00 -1.71 0.00 0.41 -0.54 0.00 0.00 175.26 173.42 2fxr n GLY 219 N 5.27 -0.20 2.75 -1.50 0.00 -1.26 -4.62 105.19 105.62 2fxr n GLY 219 Ca -0.03 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.79 2fxr n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fxr n ALA 221 N 4.56 -0.50 -1.86 0.00 0.00 -1.26 -4.75 120.51 116.69 2fxr n ALA 221 Ca -0.19 0.21 -0.36 0.00 0.00 0.00 0.00 53.44 53.10 2fxr n ALA 221 Cb 0.50 -1.94 -0.06 0.00 0.00 0.00 0.00 19.45 17.95 2fxr n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2fxr s GLN 221 N -4.42 4.47 0.17 0.00 -1.52 -1.26 -4.13 119.66 112.97 2fxr s GLN 221 Ca 0.00 1.20 -0.34 0.00 -1.95 0.00 0.00 55.36 54.27 2fxr s GLN 221 Cb 0.00 -2.77 -0.14 0.00 -0.22 0.00 0.00 33.01 29.88 2fxr s GLN 221 CO 0.00 0.28 1.47 -2.30 -0.25 0.00 0.00 175.29 174.50 2fxr n PRO 222 N 0.50 1.90 -1.99 2.91 -0.02 -1.26 -1.63 135.00 135.41 2fxr n PRO 222 Ca 0.01 0.68 -0.20 0.00 -2.02 0.00 0.00 63.50 61.98 2fxr n PRO 222 Cb 0.51 -2.39 -0.05 0.00 -0.02 0.00 0.00 33.50 31.55 2fxr n PRO 222 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2fxr n ASN 223 N 2.87 -5.55 -3.18 2.55 5.03 -1.26 -4.92 115.26 110.79 2fxr n ASN 223 Ca 0.16 0.23 -0.22 0.00 0.87 0.00 0.00 54.58 55.62 2fxr n ASN 223 Cb 0.28 -4.69 -0.06 0.00 -1.02 0.00 0.00 39.78 34.29 2fxr n ASN 223 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2fxr n ARG 224 N -2.68 0.79 -1.58 3.52 5.12 -0.64 -3.56 116.66 117.62 2fxr n ARG 224 Ca -0.22 -3.24 -0.34 0.00 -1.93 0.00 0.00 57.85 52.13 2fxr n ARG 224 Cb 0.67 -1.36 0.07 0.00 -1.16 0.00 0.00 32.46 30.68 2fxr n ARG 224 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2fxr s PRO 225 N -1.51 2.43 0.55 5.56 0.04 -1.26 -4.25 135.00 136.57 2fxr s PRO 225 Ca 0.36 1.59 -0.21 0.00 0.04 0.00 0.00 61.00 62.78 2fxr s PRO 225 Cb 0.22 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.83 2fxr s PRO 225 CO -0.10 -1.57 1.32 0.20 0.04 0.00 0.00 177.00 176.89 2fxr s GLY 226 N -2.27 2.86 -0.11 0.56 0.00 -0.46 -4.78 107.32 103.11 2fxr s GLY 226 Ca 0.71 1.26 0.04 0.00 0.00 0.00 0.00 44.72 46.72 2fxr s GLY 226 CO 0.43 1.75 -0.23 -0.42 0.00 0.00 0.00 173.10 174.63 2fxr s ILE 227 N -1.36 2.05 0.08 0.90 -1.09 -0.28 -1.81 121.20 119.70 2fxr s ILE 227 Ca 0.72 -1.01 0.09 0.00 -2.23 0.00 0.00 60.65 58.23 2fxr s ILE 227 Cb -0.38 -1.79 -0.03 0.00 -1.58 0.00 0.00 42.46 38.68 2fxr s ILE 227 CO 0.44 0.56 -0.25 -0.31 -1.23 0.00 0.00 174.94 174.15 2fxr s TYR 228 N 0.46 2.19 0.09 3.97 1.51 0.48 -2.31 117.35 123.75 2fxr s TYR 228 Ca -0.16 -0.40 -0.31 0.00 -1.01 0.00 0.00 57.07 55.20 2fxr s TYR 228 Cb -0.17 -1.26 -0.08 0.00 -0.11 0.00 0.00 41.96 40.34 2fxr s TYR 228 CO 0.06 0.20 1.46 0.99 -1.11 0.00 0.00 175.55 177.15 2fxr s THR 229 N -0.92 3.24 -0.42 -0.71 2.01 -0.37 0.12 115.64 118.58 2fxr s THR 229 Ca 0.11 0.82 -0.29 0.00 0.31 0.00 0.00 61.69 62.64 2fxr s THR 229 Cb -0.10 -3.53 0.01 0.00 0.01 0.00 0.00 72.50 68.90 2fxr s THR 229 CO 0.03 0.04 1.39 -0.60 -0.69 0.00 0.00 174.62 174.80 2fxr s ARG 230 N 1.64 3.57 0.19 4.92 3.52 -0.67 -1.99 118.95 130.13 2fxr s ARG 230 Ca 0.67 0.89 -0.12 0.00 -0.13 0.00 0.00 55.73 57.04 2fxr s ARG 230 Cb -0.37 -4.02 0.10 0.00 -1.56 0.00 0.00 34.95 29.10 2fxr s ARG 230 CO 0.30 -1.57 1.83 0.28 -0.81 0.00 0.00 175.30 175.33 2fxr h VAL 231 N 6.45 1.18 -0.57 7.11 2.07 -1.57 -2.50 116.25 128.42 2fxr h VAL 231 Ca -0.27 -0.39 0.17 0.00 0.82 0.00 0.00 66.70 67.03 2fxr h VAL 231 Cb 1.10 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 2fxr h VAL 231 CO 1.09 0.18 0.50 0.71 0.02 0.00 0.00 177.57 180.08 2fxr h THR 232 N 0.85 0.48 0.00 2.57 1.35 -1.87 0.66 112.91 116.96 2fxr h THR 232 Ca 0.23 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 66.05 2fxr h THR 232 Cb -0.04 0.63 -0.01 0.00 -1.73 0.00 0.00 68.15 67.01 2fxr h THR 232 CO -0.04 0.00 -0.19 0.22 -0.25 0.00 0.00 175.52 175.26 2fxr h TYR 233 N 0.00 0.00 -0.23 4.73 5.03 -1.80 -3.28 116.97 121.41 2fxr h TYR 233 Ca 0.27 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.58 2fxr h TYR 233 Cb 1.27 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.55 2fxr h TYR 233 CO 0.00 0.19 0.00 0.66 -1.32 0.00 0.00 178.16 177.69 2fxr n TYR 234 N -3.38 0.37 -0.23 -3.82 4.01 0.21 -4.76 117.16 109.57 2fxr n TYR 234 Ca -0.00 -0.56 0.03 0.00 -0.16 0.00 0.00 57.90 57.21 2fxr n TYR 234 Cb 0.39 -0.07 0.13 0.00 -0.31 0.00 0.00 39.34 39.49 2fxr n TYR 234 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2fxr h LEU 235 N 1.38 -0.22 -0.84 7.72 3.38 -1.60 -0.89 115.31 124.23 2fxr h LEU 235 Ca 0.00 0.16 0.10 0.00 0.09 0.00 0.00 57.88 58.23 2fxr h LEU 235 Cb 0.76 0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.70 2fxr h LEU 235 CO 0.02 -0.11 0.48 0.44 0.09 0.00 0.00 178.44 179.36 2fxr h ASP 236 N 0.15 0.68 0.22 -0.43 3.45 -1.88 -0.25 116.42 118.36 2fxr h ASP 236 Ca 0.37 0.05 -0.01 0.00 0.43 0.00 0.00 57.03 57.87 2fxr h ASP 236 Cb 0.61 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.31 2fxr h ASP 236 CO -0.56 0.38 -0.10 -0.25 -1.57 0.00 0.00 179.24 177.14 2fxr h TRP 237 N 0.79 -0.27 -0.90 4.55 7.01 -1.56 -3.02 115.95 122.56 2fxr h TRP 237 Ca 0.41 -0.01 0.18 0.00 2.11 0.00 0.00 58.89 61.59 2fxr h TRP 237 Cb 0.39 0.09 -0.11 0.00 -2.10 0.00 0.00 29.16 27.43 2fxr h TRP 237 CO -0.06 0.05 0.47 0.82 -2.79 0.00 0.00 178.44 176.92 2fxr h ILE 238 N -0.60 0.63 0.00 2.65 2.04 -0.91 -0.47 117.51 120.84 2fxr h ILE 238 Ca -0.03 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2fxr h ILE 238 Cb 0.44 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2fxr h ILE 238 CO 0.05 0.11 0.00 1.41 0.00 0.00 0.00 178.15 179.71 2fxr n HIS 239 N -4.91 0.00 1.55 1.37 8.25 -0.14 -0.76 115.22 120.58 2fxr n HIS 239 Ca 0.20 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.81 2fxr n HIS 239 Cb 0.55 -0.09 0.62 0.00 1.12 0.00 0.00 29.99 32.19 2fxr n HIS 239 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2fxr n HIS 240 N -1.09 0.00 0.00 4.41 8.25 -0.19 -4.36 115.22 122.24 2fxr n HIS 240 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 2fxr n HIS 240 Cb 0.12 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.16 2fxr n HIS 240 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2fxr n TYR 241 N -0.53 0.00 -3.21 4.41 4.01 -0.89 -5.03 117.16 115.93 2fxr n TYR 241 Ca 0.18 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.50 2fxr n TYR 241 Cb 0.28 0.18 -0.08 0.00 -0.31 0.00 0.00 39.34 39.42 2fxr n TYR 241 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2fxr s VAL 242 N -1.82 4.96 0.39 -0.72 1.01 0.07 -5.03 120.40 119.25 2fxr s VAL 242 Ca 0.00 0.21 -0.26 0.00 0.00 0.00 0.00 61.98 61.93 2fxr s VAL 242 Cb 0.00 -4.05 -0.11 0.00 0.00 0.00 0.00 36.38 32.22 2fxr s VAL 242 CO 0.00 -0.35 1.25 -0.81 0.00 0.00 0.00 175.10 175.18 2fxr n PRO 243 N 5.89 1.94 0.00 2.72 -0.04 -1.26 -4.41 135.00 139.83 2fxr n PRO 243 Ca -0.04 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.11 2fxr n PRO 243 Cb 0.48 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 2fxr n PRO 243 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09