#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 4.60 -0.69 1.39 1.01 0.13 -4.01 120.40 122.83 2fxr s VAL 17 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 2fxr s VAL 17 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.33 2fxr s VAL 17 CO 0.00 0.47 0.60 0.61 0.00 0.00 0.00 175.10 176.78 2fxr n GLY 18 N 3.47 0.17 0.00 4.51 0.00 -1.22 -2.31 105.19 109.81 2fxr n GLY 18 Ca -0.17 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.26 5.49 3.31 -0.02 0.00 -1.26 -4.79 105.19 106.66 2fxr n GLY 19 Ca -0.01 -2.00 -0.16 0.00 0.00 0.00 0.00 46.02 43.85 2fxr n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2fxr s GLN 20 N -0.71 1.33 0.24 1.61 -2.07 -1.03 -4.96 119.66 114.07 2fxr s GLN 20 Ca 0.00 -1.70 -0.30 0.00 -1.82 0.00 0.00 55.36 51.54 2fxr s GLN 20 Cb 0.00 -0.37 -0.10 0.00 -1.09 0.00 0.00 33.01 31.45 2fxr s GLN 20 CO 0.00 -0.21 1.40 -2.00 -1.32 0.00 0.00 175.29 173.16 2fxr s GLU 21 N -3.96 4.31 0.23 9.60 2.12 -1.26 -2.12 118.70 127.62 2fxr s GLU 21 Ca 0.32 2.23 -0.25 0.00 0.36 0.00 0.00 54.97 57.63 2fxr s GLU 21 Cb 0.07 -3.13 -0.09 0.00 0.26 0.00 0.00 34.13 31.24 2fxr s GLU 21 CO 0.10 -0.36 0.84 0.00 -0.54 0.00 0.00 175.26 175.30 2fxr s ALA 22 N -0.02 3.36 0.60 6.30 0.00 0.18 -4.84 121.76 127.34 2fxr s ALA 22 Ca 0.58 0.40 -0.18 0.00 0.00 0.00 0.00 51.96 52.77 2fxr s ALA 22 Cb -0.40 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 2fxr s ALA 22 CO 0.42 0.26 1.13 -1.25 0.00 0.00 0.00 175.76 176.32 2fxr s PRO 23 N -1.59 3.07 0.55 0.00 0.04 -1.26 -4.88 135.00 130.93 2fxr s PRO 23 Ca 0.42 1.55 0.27 0.00 0.04 0.00 0.00 61.00 63.28 2fxr s PRO 23 Cb -0.21 -1.97 1.46 0.00 0.04 0.00 0.00 34.50 33.82 2fxr s PRO 23 CO 0.25 -1.06 1.99 0.00 0.04 0.00 0.00 177.00 178.22 2fxr h ARG 24 N 0.67 0.00 -0.11 4.56 3.08 -2.00 -2.03 114.38 118.56 2fxr h ARG 24 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2fxr h ARG 24 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 2fxr h ARG 24 CO 0.55 0.00 0.00 -1.13 -1.07 0.00 0.00 179.97 178.32 2fxr n SER 25 N -4.16 1.24 -4.61 7.04 3.41 -1.26 -4.91 113.62 110.37 2fxr n SER 25 Ca 0.08 -1.60 -0.27 0.00 -0.26 0.00 0.00 58.87 56.82 2fxr n SER 25 Cb 0.58 -0.07 -0.09 0.00 -0.26 0.00 0.00 64.21 64.38 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 -1.86 2.23 -1.17 4.33 1.02 -0.76 -4.75 119.74 118.77 2fxr s LYS 26 Ca 0.32 -1.16 -0.09 0.00 0.02 0.00 0.00 55.97 55.06 2fxr s LYS 26 Cb 0.17 -2.27 -0.02 0.00 -0.52 0.00 0.00 37.83 35.19 2fxr s LYS 26 CO 0.26 0.45 0.81 0.91 -0.92 0.00 0.00 175.35 176.87 2fxr n TRP 27 N 0.06 -2.09 0.32 3.18 7.02 -1.26 -4.88 117.44 119.78 2fxr n TRP 27 Ca -0.11 0.72 0.10 0.00 -1.02 0.00 0.00 57.50 57.20 2fxr n TRP 27 Cb 0.55 -4.02 0.47 0.00 -2.42 0.00 0.00 31.31 25.89 2fxr n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 2fxr n PRO 28 N -3.92 0.15 0.00 -0.99 -0.04 -1.26 -2.53 135.00 126.41 2fxr n PRO 28 Ca -0.16 0.47 0.12 0.00 -0.04 0.00 0.00 63.50 63.88 2fxr n PRO 28 Cb 0.63 -1.83 0.15 0.00 -0.04 0.00 0.00 33.50 32.40 2fxr n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2fxr n TRP 29 N -2.12 0.00 -1.94 0.54 2.14 -1.19 -3.08 117.44 111.79 2fxr n TRP 29 Ca 0.01 0.00 -0.40 0.00 2.07 0.00 0.00 57.50 59.18 2fxr n TRP 29 Cb 0.16 -0.14 -0.00 0.00 -0.81 0.00 0.00 31.31 30.52 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 -2.87 3.98 0.13 -2.67 2.00 -1.05 -0.95 119.66 118.23 2fxr s GLN 30 Ca 0.13 2.33 -0.01 0.00 -2.00 0.00 0.00 55.36 55.81 2fxr s GLN 30 Cb 0.17 -2.82 -0.04 0.00 0.80 0.00 0.00 33.01 31.12 2fxr s GLN 30 CO 0.71 -0.55 0.04 0.14 -0.50 0.00 0.00 175.29 175.13 2fxr s VAL 31 N -1.20 0.21 -0.07 1.34 -7.23 -1.02 -2.44 120.40 109.99 2fxr s VAL 31 Ca 0.56 -1.91 0.03 0.00 -1.81 0.00 0.00 61.98 58.85 2fxr s VAL 31 Cb -0.42 -2.00 0.00 0.00 0.56 0.00 0.00 36.38 34.53 2fxr s VAL 31 CO 0.55 -0.52 -0.18 -0.55 -0.31 0.00 0.00 175.10 174.09 2fxr s SER 32 N -3.06 2.33 -0.04 4.85 0.15 -0.47 -2.47 113.70 114.99 2fxr s SER 32 Ca 0.22 -0.40 -0.14 0.00 0.70 0.00 0.00 55.95 56.34 2fxr s SER 32 Cb 0.07 -0.95 -0.05 0.00 -1.71 0.00 0.00 66.02 63.38 2fxr s SER 32 CO 0.01 0.11 0.36 -0.76 1.20 0.00 0.00 173.24 174.16 2fxr s LEU 33 N 0.37 4.43 -0.06 3.45 1.43 -0.15 -1.21 118.68 126.95 2fxr s LEU 33 Ca -0.13 0.84 0.05 0.00 -1.03 0.00 0.00 54.13 53.86 2fxr s LEU 33 Cb -0.15 -2.49 -0.01 0.00 0.03 0.00 0.00 46.19 43.57 2fxr s LEU 33 CO 0.05 0.30 -0.21 -0.13 0.23 0.00 0.00 176.35 176.59 2fxr s ARG 34 N -0.84 2.22 -0.03 1.70 1.81 0.17 -2.40 118.95 121.59 2fxr s ARG 34 Ca 0.22 -0.75 -0.02 0.00 -1.72 0.00 0.00 55.73 53.46 2fxr s ARG 34 Cb -0.16 -1.87 -0.04 0.00 -0.45 0.00 0.00 34.95 32.43 2fxr s ARG 34 CO 0.11 0.29 0.09 0.54 -0.68 0.00 0.00 175.30 175.65 2fxr s VAL 35 N 0.01 4.88 0.44 3.52 0.11 0.60 -1.34 120.40 128.62 2fxr s VAL 35 Ca -0.06 -0.28 -0.22 0.00 -2.93 0.00 0.00 61.98 58.49 2fxr s VAL 35 Cb -0.13 -3.21 -0.09 0.00 -1.53 0.00 0.00 36.38 31.42 2fxr s VAL 35 CO 0.04 0.41 1.04 -2.28 -3.33 0.00 0.00 175.10 170.97 2fxr s HIS 36 N -1.16 3.15 -1.47 1.54 2.46 0.21 -1.62 115.29 118.40 2fxr s HIS 36 Ca 0.21 1.61 0.00 0.00 0.47 0.00 0.00 55.06 57.36 2fxr s HIS 36 Cb -0.12 -3.09 0.00 0.00 -0.13 0.00 0.00 32.58 29.24 2fxr s HIS 36 CO 0.12 -0.69 0.00 0.41 -2.47 0.00 0.00 174.74 172.11 2fxr n GLY 37 N 0.03 -0.59 0.42 1.59 0.00 -1.26 -4.89 105.19 100.50 2fxr n GLY 37 Ca 0.07 -0.65 0.23 0.00 0.00 0.00 0.00 46.02 45.67 2fxr n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fxr h PRO 37 N 0.00 0.00 -3.00 1.61 0.13 -2.04 -3.40 132.00 125.29 2fxr h PRO 37 Ca 0.00 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 2fxr h PRO 37 Cb 0.00 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 30.98 2fxr h PRO 37 CO 0.00 0.00 -0.01 1.52 -0.23 0.00 0.00 178.00 179.28 2fxr s TYR 37 N -4.61 -0.34 -0.93 1.56 1.13 -1.26 -5.08 117.35 107.82 2fxr s TYR 37 Ca -0.04 0.26 -0.24 0.00 -1.41 0.00 0.00 57.07 55.64 2fxr s TYR 37 Cb 0.16 0.31 -0.05 0.00 -1.10 0.00 0.00 41.96 41.28 2fxr s TYR 37 CO 0.55 -0.66 1.94 -1.58 -2.51 0.00 0.00 175.55 173.30 2fxr s TRP 38 N -2.87 1.83 0.33 -3.49 0.52 -1.26 -4.72 118.94 109.27 2fxr s TRP 38 Ca -0.03 0.61 -0.24 0.00 0.02 0.00 0.00 56.10 56.46 2fxr s TRP 38 Cb -0.00 -4.04 -0.10 0.00 -1.15 0.00 0.00 33.47 28.18 2fxr s TRP 38 CO -0.05 -1.69 0.91 1.41 0.02 0.00 0.00 176.95 177.55 2fxr s MET 39 N 6.94 4.46 -0.08 4.98 1.75 -0.64 -4.72 119.30 131.99 2fxr s MET 39 Ca 0.70 1.21 -0.27 0.00 -1.25 0.00 0.00 55.69 56.08 2fxr s MET 39 Cb -0.06 -2.67 -0.02 0.00 2.84 0.00 0.00 34.83 34.91 2fxr s MET 39 CO 0.01 0.23 0.88 -1.58 -0.65 0.00 0.00 175.02 173.90 2fxr s HIS 40 N -1.73 3.55 0.00 4.11 2.46 -1.26 -0.29 115.29 122.13 2fxr s HIS 40 Ca 0.52 1.47 0.00 0.00 0.47 0.00 0.00 55.06 57.51 2fxr s HIS 40 Cb -0.16 -3.03 0.00 0.00 -0.13 0.00 0.00 32.58 29.26 2fxr s HIS 40 CO 0.21 -0.08 0.00 1.97 -2.47 0.00 0.00 174.74 174.37 2fxr n PHE 41 N 4.40 0.00 -3.58 3.88 -1.74 -1.01 -4.97 117.46 114.45 2fxr n PHE 41 Ca 0.04 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.83 2fxr n PHE 41 Cb 0.50 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.48 2fxr n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2fxr n GLY 43 N -0.39 1.37 1.62 0.00 0.00 0.14 -0.98 105.19 106.95 2fxr n GLY 43 Ca -0.13 -2.13 -0.00 0.00 0.00 0.00 0.00 46.02 43.76 2fxr n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fxr n GLY 44 N -1.72 0.75 3.33 -0.02 0.00 -1.03 -3.55 105.19 102.94 2fxr n GLY 44 Ca 0.15 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.09 -0.38 -0.26 1.61 1.04 -0.12 -2.44 113.70 111.06 2fxr s SER 45 Ca 0.11 0.55 -0.21 0.00 0.48 0.00 0.00 55.95 56.88 2fxr s SER 45 Cb -0.01 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 2fxr s SER 45 CO 0.01 -0.34 0.64 -0.22 0.98 0.00 0.00 173.24 174.32 2fxr s LEU 46 N -0.59 4.07 0.00 2.42 2.96 -0.12 0.12 118.68 127.54 2fxr s LEU 46 Ca -0.07 0.68 0.08 0.00 -0.22 0.00 0.00 54.13 54.61 2fxr s LEU 46 Cb -0.03 -2.87 0.09 0.00 0.50 0.00 0.00 46.19 43.88 2fxr s LEU 46 CO 0.03 -0.40 0.84 2.30 -1.32 0.00 0.00 176.35 177.80 2fxr n ILE 47 N 5.23 0.18 -3.60 6.68 -5.35 -0.93 -0.34 119.36 121.23 2fxr n ILE 47 Ca -0.00 -0.59 -0.07 0.00 -0.27 0.00 0.00 62.75 61.82 2fxr n ILE 47 Cb 0.49 1.05 -0.05 0.00 -1.74 0.00 0.00 39.64 39.40 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 -0.75 -0.24 0.18 4.28 5.04 -1.17 -4.79 115.29 117.85 2fxr s HIS 48 Ca 0.11 0.39 0.21 0.00 -1.54 0.00 0.00 55.06 54.24 2fxr s HIS 48 Cb 0.07 0.47 1.17 0.00 0.04 0.00 0.00 32.58 34.33 2fxr s HIS 48 CO 0.11 -0.23 1.61 -1.35 -2.34 0.00 0.00 174.74 172.53 2fxr h PRO 49 N 2.34 0.00 0.00 2.88 0.11 -1.95 -1.62 132.00 133.76 2fxr h PRO 49 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 2fxr h PRO 49 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fxr h PRO 49 CO 0.27 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.10 2fxr n GLN 50 N -2.38 0.50 -4.63 1.05 6.02 -1.26 -0.12 117.38 116.56 2fxr n GLN 50 Ca -0.01 -0.34 -0.23 0.00 -0.01 0.00 0.00 57.00 56.40 2fxr n GLN 50 Cb 0.26 -0.83 -0.14 0.00 1.02 0.00 0.00 30.24 30.54 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 -0.17 1.51 -0.08 1.08 0.52 -0.61 -0.92 118.94 120.27 2fxr s TRP 51 Ca 0.00 -0.33 0.04 0.00 0.02 0.00 0.00 56.10 55.83 2fxr s TRP 51 Cb 0.00 -0.93 0.00 0.00 -1.15 0.00 0.00 33.47 31.39 2fxr s TRP 51 CO 0.00 0.03 -0.20 0.08 0.02 0.00 0.00 176.95 176.87 2fxr s VAL 52 N -0.63 1.75 -0.05 4.03 1.01 -0.26 -2.19 120.40 124.06 2fxr s VAL 52 Ca 0.05 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.05 2fxr s VAL 52 Cb -0.07 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 2fxr s VAL 52 CO 0.01 0.49 0.35 -0.22 0.00 0.00 0.00 175.10 175.73 2fxr s LEU 53 N 0.39 4.41 0.00 3.92 2.96 0.12 -1.31 118.68 129.16 2fxr s LEU 53 Ca -0.16 0.80 -0.10 0.00 -0.22 0.00 0.00 54.13 54.45 2fxr s LEU 53 Cb -0.17 -2.47 0.04 0.00 0.50 0.00 0.00 46.19 44.09 2fxr s LEU 53 CO 0.07 0.28 0.60 1.07 -1.32 0.00 0.00 176.35 177.05 2fxr n THR 54 N 2.26 0.00 -2.99 3.68 5.66 -0.67 -0.94 114.28 121.27 2fxr n THR 54 Ca -0.14 -0.99 -0.38 0.00 -3.05 0.00 0.00 64.05 59.49 2fxr n THR 54 Cb 0.53 0.85 -0.06 0.00 -1.55 0.00 0.00 70.33 70.09 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 -2.06 3.41 0.37 1.79 0.00 -1.26 -0.40 121.76 123.61 2fxr s ALA 55 Ca 0.16 0.32 0.10 0.00 0.00 0.00 0.00 51.96 52.54 2fxr s ALA 55 Cb -0.03 -2.94 0.71 0.00 0.00 0.00 0.00 23.12 20.85 2fxr s ALA 55 CO 0.12 0.29 1.85 0.00 0.00 0.00 0.00 175.76 178.02 2fxr h ALA 56 N 3.93 1.40 0.00 0.00 0.00 -1.64 -2.34 119.26 120.61 2fxr h ALA 56 Ca -0.47 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.15 2fxr h ALA 56 Cb 1.20 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2fxr h ALA 56 CO 0.66 0.43 0.00 -2.39 0.00 0.00 0.00 179.25 177.94 2fxr n HIS 57 N -4.17 0.00 0.12 0.00 1.44 -1.26 -0.37 115.22 110.97 2fxr n HIS 57 Ca -0.01 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.68 2fxr n HIS 57 Cb 0.35 -0.50 0.08 0.00 0.12 0.00 0.00 29.99 30.04 2fxr n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2fxr n VAL 59 N -3.54 0.00 -3.20 0.00 0.24 -1.02 -5.01 118.33 105.80 2fxr n VAL 59 Ca -0.00 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.85 2fxr n VAL 59 Cb 0.72 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 34.13 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 0.59 5.35 0.12 7.63 0.00 0.50 -4.54 105.19 114.84 2fxr n GLY 60 Ca 0.00 -1.58 0.11 0.00 0.00 0.00 0.00 46.02 44.55 2fxr n GLY 60 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2fxr n PRO 60 N 0.00 0.17 -3.12 1.61 -0.04 -1.26 -4.61 135.00 127.74 2fxr n PRO 60 Ca 0.00 0.42 -0.36 0.00 -0.04 0.00 0.00 63.50 63.53 2fxr n PRO 60 Cb 0.00 -1.83 -0.06 0.00 -0.04 0.00 0.00 33.50 31.57 2fxr n PRO 60 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2fxr s ASP 60 N -4.07 7.01 0.22 3.54 1.11 -1.26 -5.02 116.67 118.20 2fxr s ASP 60 Ca 0.04 1.38 -0.30 0.00 0.18 0.00 0.00 52.55 53.85 2fxr s ASP 60 Cb 0.09 -2.41 -0.09 0.00 1.07 0.00 0.00 42.92 41.58 2fxr s ASP 60 CO 0.35 0.01 1.36 0.68 1.18 0.00 0.00 175.17 178.76 2fxr s VAL 60 N -1.56 2.98 0.34 -1.27 -7.23 -1.26 -5.01 120.40 107.39 2fxr s VAL 60 Ca 0.44 0.81 0.08 0.00 -1.81 0.00 0.00 61.98 61.50 2fxr s VAL 60 Cb -0.16 -3.52 -0.03 0.00 0.56 0.00 0.00 36.38 33.23 2fxr s VAL 60 CO 0.20 0.13 0.27 -0.54 -0.31 0.00 0.00 175.10 174.85 2fxr s LYS 60 N -0.24 2.66 -0.59 4.82 -0.14 -1.26 -5.06 119.74 119.92 2fxr s LYS 60 Ca 0.58 -1.35 -0.25 0.00 -1.36 0.00 0.00 55.97 53.58 2fxr s LYS 60 Cb -0.39 -2.42 0.04 0.00 -1.68 0.00 0.00 37.83 33.38 2fxr s LYS 60 CO 0.40 0.08 1.04 0.34 -0.76 0.00 0.00 175.35 176.46 2fxr s ASP 60 N -3.98 6.33 0.51 2.83 3.68 -1.26 -4.90 116.67 119.88 2fxr s ASP 60 Ca 0.41 -0.31 0.38 0.00 2.13 0.00 0.00 52.55 55.15 2fxr s ASP 60 Cb -0.05 -2.48 1.54 0.00 -1.45 0.00 0.00 42.92 40.48 2fxr s ASP 60 CO 0.26 -1.38 1.69 -0.07 0.13 0.00 0.00 175.17 175.80 2fxr h LEU 61 N 11.47 0.10 -1.20 -1.34 3.38 -1.94 -0.55 115.31 125.22 2fxr h LEU 61 Ca -0.26 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2fxr h LEU 61 Cb 1.07 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 2fxr h LEU 61 CO 1.14 -0.03 0.49 0.00 0.09 0.00 0.00 178.44 180.13 2fxr h ALA 62 N 1.35 1.41 0.00 1.53 0.00 -1.90 -2.25 119.26 119.40 2fxr h ALA 62 Ca 0.75 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.59 2fxr h ALA 62 Cb 2.75 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 20.23 2fxr h ALA 62 CO -0.13 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.65 2fxr n ALA 63 N -2.42 2.49 -2.57 0.00 0.00 -0.21 -4.78 120.51 113.02 2fxr n ALA 63 Ca 0.08 -0.10 -0.31 0.00 0.00 0.00 0.00 53.44 53.11 2fxr n ALA 63 Cb 0.05 -1.26 -0.16 0.00 0.00 0.00 0.00 19.45 18.07 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 -1.57 2.06 0.11 0.00 2.96 -0.85 -0.62 118.68 120.77 2fxr s LEU 64 Ca 0.24 -0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 53.65 2fxr s LEU 64 Cb 0.11 -1.34 -0.04 0.00 0.50 0.00 0.00 46.19 45.43 2fxr s LEU 64 CO 0.19 0.27 0.06 -0.13 -1.32 0.00 0.00 176.35 175.42 2fxr s ARG 65 N -0.34 0.88 -0.07 1.98 1.81 -0.45 -4.13 118.95 118.62 2fxr s ARG 65 Ca 0.02 -1.35 0.04 0.00 -1.72 0.00 0.00 55.73 52.72 2fxr s ARG 65 Cb -0.12 0.25 0.00 0.00 -0.45 0.00 0.00 34.95 34.63 2fxr s ARG 65 CO 0.02 -0.24 -0.20 0.08 -0.68 0.00 0.00 175.30 174.28 2fxr s VAL 66 N -4.00 1.69 -0.18 3.52 1.01 0.10 -0.65 120.40 121.89 2fxr s VAL 66 Ca 0.19 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 2fxr s VAL 66 Cb 0.07 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2fxr s VAL 66 CO -0.01 0.48 -0.04 -1.58 0.00 0.00 0.00 175.10 173.94 2fxr s GLN 67 N 0.27 3.55 1.02 2.72 2.00 -0.35 0.27 119.66 129.14 2fxr s GLN 67 Ca -0.12 -0.57 -0.17 0.00 -2.00 0.00 0.00 55.36 52.50 2fxr s GLN 67 Cb -0.15 -2.95 0.23 0.00 0.80 0.00 0.00 33.01 30.94 2fxr s GLN 67 CO 0.05 0.07 1.34 -0.51 -0.50 0.00 0.00 175.29 175.74 2fxr s LEU 68 N 0.80 2.57 -0.01 3.68 1.43 -1.26 -1.37 118.68 124.51 2fxr s LEU 68 Ca -0.01 0.18 -0.39 0.00 -1.03 0.00 0.00 54.13 52.88 2fxr s LEU 68 Cb -0.15 -2.09 -0.18 0.00 0.03 0.00 0.00 46.19 43.81 2fxr s LEU 68 CO 0.02 -3.05 1.31 -1.14 0.23 0.00 0.00 176.35 173.72 2fxr n ARG 69 N -3.96 0.72 -4.23 1.70 0.63 -1.02 -4.72 116.66 105.78 2fxr n ARG 69 Ca 0.17 0.26 -0.17 0.00 -0.92 0.00 0.00 57.85 57.18 2fxr n ARG 69 Cb 0.59 -1.85 -0.11 0.00 0.45 0.00 0.00 32.46 31.54 2fxr n ARG 69 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2fxr s GLU 70 N 0.80 1.00 -0.03 -0.14 2.02 -1.26 -5.05 118.70 116.03 2fxr s GLU 70 Ca 0.89 -1.23 0.04 0.00 0.02 0.00 0.00 54.97 54.69 2fxr s GLU 70 Cb -1.10 -0.84 -0.25 0.00 0.10 0.00 0.00 34.13 32.05 2fxr s GLU 70 CO 0.54 0.16 0.70 0.37 0.02 0.00 0.00 175.26 177.04 2fxr h GLN 71 N 3.50 0.12 -3.56 1.61 5.75 -1.93 -3.44 115.11 117.16 2fxr h GLN 71 Ca -0.39 -0.20 -0.30 0.00 -0.15 0.00 0.00 58.65 57.60 2fxr h GLN 71 Cb 1.19 0.07 -0.34 0.00 1.07 0.00 0.00 27.48 29.48 2fxr h GLN 71 CO 0.51 0.84 -0.73 -1.01 -2.65 0.00 0.00 178.83 175.79 2fxr s HIS 72 N -2.60 0.08 0.34 3.99 3.76 -1.26 -2.53 115.29 117.07 2fxr s HIS 72 Ca -0.09 0.10 -0.29 0.00 -0.15 0.00 0.00 55.06 54.64 2fxr s HIS 72 Cb 0.08 -0.26 -0.12 0.00 1.11 0.00 0.00 32.58 33.39 2fxr s HIS 72 CO 0.82 -0.09 1.47 1.28 -0.85 0.00 0.00 174.74 177.36 2fxr n LEU 73 N 4.14 4.33 0.00 0.89 4.77 -0.82 -3.31 117.00 127.00 2fxr n LEU 73 Ca -0.27 1.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.91 2fxr n LEU 73 Cb 0.50 -1.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.02 2fxr n LEU 73 CO 0.22 -0.01 0.00 -1.22 -1.33 0.00 0.00 177.39 175.05 2fxr n TYR 74 N 0.91 0.00 -0.01 -1.77 4.01 -1.26 -4.83 117.16 114.20 2fxr n TYR 74 Ca 0.04 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.61 2fxr n TYR 74 Cb 0.37 -0.19 -0.09 0.00 -0.31 0.00 0.00 39.34 39.12 2fxr n TYR 74 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 2fxr h TYR 75 N 0.00 0.91 -1.20 -0.72 -1.99 -1.92 -3.34 116.97 108.70 2fxr h TYR 75 Ca 0.00 -0.42 -0.56 0.00 2.00 0.00 0.00 58.73 59.75 2fxr h TYR 75 Cb 0.00 -0.13 -0.42 0.00 2.00 0.00 0.00 36.73 38.18 2fxr h TYR 75 CO 0.00 1.24 -0.79 1.04 -0.00 0.00 0.00 178.16 179.65 2fxr n GLN 79 N -4.05 3.37 -1.82 4.88 1.13 -1.26 -5.08 117.38 114.55 2fxr n GLN 79 Ca -0.09 -4.32 -0.41 0.00 -1.94 0.00 0.00 57.00 50.24 2fxr n GLN 79 Cb 0.71 -2.21 -0.01 0.00 0.11 0.00 0.00 30.24 28.84 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 -3.55 6.41 -0.35 1.08 1.11 -1.26 -4.93 116.67 115.19 2fxr s ASP 80 Ca 0.48 2.93 0.15 0.00 0.18 0.00 0.00 52.55 56.29 2fxr s ASP 80 Cb 0.40 -2.64 0.43 0.00 1.07 0.00 0.00 42.92 42.18 2fxr s ASP 80 CO -0.10 -0.87 1.03 1.67 1.18 0.00 0.00 175.17 178.09 2fxr n GLN 81 N 1.74 1.14 -1.46 8.23 -0.06 -1.26 -5.13 117.38 120.58 2fxr n GLN 81 Ca 0.06 -2.90 -0.47 0.00 -2.00 0.00 0.00 57.00 51.69 2fxr n GLN 81 Cb 0.38 -1.00 -0.03 0.00 -4.06 0.00 0.00 30.24 25.54 2fxr n GLN 81 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 2fxr n LEU 82 N -0.14 -0.30 -4.14 1.69 4.77 -1.26 -4.78 117.00 112.84 2fxr n LEU 82 Ca 0.07 1.14 -0.31 0.00 -0.03 0.00 0.00 56.01 56.89 2fxr n LEU 82 Cb 0.81 -1.05 -0.17 0.00 -2.33 0.00 0.00 43.42 40.69 2fxr n LEU 82 CO 0.18 -2.47 -0.53 -0.76 -1.33 0.00 0.00 177.39 172.48 2fxr s LEU 83 N 2.13 1.96 0.62 2.23 1.43 0.14 -4.91 118.68 122.28 2fxr s LEU 83 Ca 0.64 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 53.04 2fxr s LEU 83 Cb -0.88 -1.30 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 2fxr s LEU 83 CO 0.57 0.07 1.17 -2.16 0.23 0.00 0.00 176.35 176.23 2fxr s PRO 84 N 0.77 2.87 -0.08 1.29 0.04 -1.26 -0.72 135.00 137.91 2fxr s PRO 84 Ca -0.10 1.66 -0.00 0.00 0.04 0.00 0.00 61.00 62.60 2fxr s PRO 84 Cb -0.16 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 2fxr s PRO 84 CO 0.01 -1.24 -0.06 0.08 0.04 0.00 0.00 177.00 175.82 2fxr s VAL 85 N -1.88 3.78 -0.12 -0.36 1.01 -1.26 -2.60 120.40 118.97 2fxr s VAL 85 Ca 0.73 -0.44 0.17 0.00 0.00 0.00 0.00 61.98 62.45 2fxr s VAL 85 Cb -0.26 -2.57 -0.25 0.00 0.00 0.00 0.00 36.38 33.30 2fxr s VAL 85 CO 0.36 0.59 0.20 -1.54 0.00 0.00 0.00 175.10 174.70 2fxr n SER 86 N 2.40 0.52 -3.87 3.32 3.41 0.94 -4.82 113.62 115.52 2fxr n SER 86 Ca -0.18 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.32 2fxr n SER 86 Cb 0.53 1.29 -0.11 0.00 -0.26 0.00 0.00 64.21 65.66 2fxr n SER 86 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2fxr s ARG 87 N -2.77 0.30 -0.22 4.33 0.52 -1.08 -4.98 118.95 115.04 2fxr s ARG 87 Ca -0.08 -0.16 0.01 0.00 -0.52 0.00 0.00 55.73 54.98 2fxr s ARG 87 Cb 0.08 0.12 0.05 0.00 0.52 0.00 0.00 34.95 35.73 2fxr s ARG 87 CO 0.77 -0.06 -0.08 0.42 0.02 0.00 0.00 175.30 176.37 2fxr s ILE 88 N -0.71 1.61 -0.29 1.52 1.01 -1.26 -0.97 121.20 122.12 2fxr s ILE 88 Ca -0.08 -1.13 0.01 0.00 0.00 0.00 0.00 60.65 59.44 2fxr s ILE 88 Cb -0.05 -1.78 0.06 0.00 0.01 0.00 0.00 42.46 40.71 2fxr s ILE 88 CO 0.01 0.03 -0.04 -0.63 0.00 0.00 0.00 174.94 174.31 2fxr s ILE 89 N 1.38 2.61 -0.16 2.92 1.01 0.12 -4.99 121.20 124.09 2fxr s ILE 89 Ca -0.04 -1.56 -0.07 0.00 0.00 0.00 0.00 60.65 58.98 2fxr s ILE 89 Cb -0.18 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.71 2fxr s ILE 89 CO -0.07 -0.11 0.09 -0.69 0.00 0.00 0.00 174.94 174.16 2fxr s VAL 90 N 1.17 5.10 -0.03 2.92 1.01 -1.26 0.29 120.40 129.59 2fxr s VAL 90 Ca -0.06 0.07 -0.35 0.00 0.00 0.00 0.00 61.98 61.64 2fxr s VAL 90 Cb -0.20 -3.27 -0.13 0.00 0.00 0.00 0.00 36.38 32.78 2fxr s VAL 90 CO -0.03 0.51 1.73 1.57 0.00 0.00 0.00 175.10 178.88 2fxr n HIS 91 N 3.00 2.21 0.14 5.22 -0.00 -1.11 -4.79 115.22 119.90 2fxr n HIS 91 Ca -0.17 0.19 0.08 0.00 0.46 0.00 0.00 57.72 58.28 2fxr n HIS 91 Cb 0.53 -2.58 0.41 0.00 -0.12 0.00 0.00 29.99 28.24 2fxr n HIS 91 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2fxr n PRO 92 N 5.24 0.10 0.06 1.57 -0.04 -1.26 -1.35 135.00 139.32 2fxr n PRO 92 Ca 0.21 0.58 0.12 0.00 -0.04 0.00 0.00 63.50 64.37 2fxr n PRO 92 Cb 0.26 -1.98 0.26 0.00 -0.04 0.00 0.00 33.50 32.00 2fxr n PRO 92 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2fxr n GLN 93 N -2.06 0.24 -2.72 0.54 -0.06 -1.26 -4.94 117.38 107.11 2fxr n GLN 93 Ca -0.01 0.10 -0.39 0.00 -2.00 0.00 0.00 57.00 54.70 2fxr n GLN 93 Cb 0.18 -1.68 -0.06 0.00 -4.06 0.00 0.00 30.24 24.62 2fxr n GLN 93 CO 0.00 0.00 0.00 0.12 -0.20 0.00 0.00 177.06 176.98 2fxr s PHE 94 N -3.12 3.81 0.00 3.69 5.36 -0.46 -4.85 117.98 122.41 2fxr s PHE 94 Ca 0.08 1.84 0.00 0.00 -0.96 0.00 0.00 56.93 57.89 2fxr s PHE 94 Cb 0.14 -3.01 0.00 0.00 -0.34 0.00 0.00 43.02 39.81 2fxr s PHE 94 CO 0.68 0.20 0.00 0.98 -1.46 0.00 0.00 175.22 175.62 2fxr n TYR 95 N 1.06 -0.42 -3.95 10.12 9.36 -1.26 -4.89 117.16 127.18 2fxr n TYR 95 Ca -0.00 0.00 -0.09 0.00 3.32 0.00 0.00 57.90 61.13 2fxr n TYR 95 Cb 0.48 0.24 -0.10 0.00 -0.63 0.00 0.00 39.34 39.33 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 -1.48 0.14 0.32 2.97 -4.23 -1.26 -4.57 115.64 107.53 2fxr s THR 96 Ca 0.00 -1.15 0.09 0.00 -1.18 0.00 0.00 61.69 59.45 2fxr s THR 96 Cb 0.00 -0.89 0.05 0.00 1.34 0.00 0.00 72.50 73.00 2fxr s THR 96 CO 0.00 -0.63 1.74 0.00 -0.54 0.00 0.00 174.62 175.19 2fxr h ALA 97 N 3.72 1.20 -0.50 3.99 0.00 -1.97 -2.53 119.26 123.17 2fxr h ALA 97 Ca -0.33 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.10 2fxr h ALA 97 Cb 1.18 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 2fxr h ALA 97 CO 0.51 0.56 -0.02 1.96 0.00 0.00 0.00 179.25 182.26 2fxr h GLN 98 N 0.10 0.90 0.01 0.00 7.50 -1.97 -2.98 115.11 118.68 2fxr h GLN 98 Ca 0.01 -0.30 -0.00 0.00 0.50 0.00 0.00 58.65 58.86 2fxr h GLN 98 Cb 0.78 -0.08 0.00 0.00 0.05 0.00 0.00 27.48 28.24 2fxr h GLN 98 CO 0.06 0.94 -0.01 0.82 -1.50 0.00 0.00 178.83 179.14 2fxr h ILE 99 N 0.76 1.12 0.00 2.54 2.04 -1.91 -3.46 117.51 118.59 2fxr h ILE 99 Ca 0.14 -0.38 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2fxr h ILE 99 Cb 0.54 1.38 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 2fxr h ILE 99 CO 0.03 0.10 0.00 0.61 0.00 0.00 0.00 178.15 178.89 2fxr n GLY 100 N -0.65 0.85 3.48 5.37 0.00 -0.97 -4.96 105.19 108.31 2fxr n GLY 100 Ca -0.08 -2.06 -0.20 0.00 0.00 0.00 0.00 46.02 43.68 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 -1.00 -1.71 -2.16 4.61 0.00 -1.26 -4.43 120.51 114.56 2fxr n ALA 101 Ca 0.00 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 2fxr n ALA 101 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 19.45 15.74 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 -3.06 5.61 -3.97 0.00 2.03 -1.26 -4.25 116.55 111.65 2fxr n ASP 102 Ca -0.16 -3.07 -0.09 0.00 0.52 0.00 0.00 54.79 51.99 2fxr n ASP 102 Cb 0.62 -1.48 -0.11 0.00 -0.72 0.00 0.00 41.12 39.44 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 0.49 0.11 0.18 5.18 2.07 -1.26 -3.71 121.20 124.27 2fxr s ILE 103 Ca 0.44 -0.92 -0.23 0.00 -1.41 0.00 0.00 60.65 58.53 2fxr s ILE 103 Cb 0.12 -0.37 0.06 0.00 0.13 0.00 0.00 42.46 42.40 2fxr s ILE 103 CO -0.03 -0.51 0.71 0.00 -1.91 0.00 0.00 174.94 173.21 2fxr s ALA 104 N -1.60 -1.50 0.05 1.50 0.00 0.46 -2.73 121.76 117.94 2fxr s ALA 104 Ca -0.14 0.23 0.05 0.00 0.00 0.00 0.00 51.96 52.09 2fxr s ALA 104 Cb -0.08 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.81 2fxr s ALA 104 CO -0.01 -0.88 -0.13 -0.51 0.00 0.00 0.00 175.76 174.22 2fxr s LEU 105 N -2.80 2.22 -0.05 0.00 1.43 0.14 -1.68 118.68 117.95 2fxr s LEU 105 Ca 0.06 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 52.67 2fxr s LEU 105 Cb -0.03 -0.51 0.00 0.00 0.03 0.00 0.00 46.19 45.68 2fxr s LEU 105 CO -0.04 -0.04 -0.17 -0.76 0.23 0.00 0.00 176.35 175.58 2fxr s LEU 106 N -1.41 1.87 -0.21 1.79 1.43 -0.43 0.15 118.68 121.87 2fxr s LEU 106 Ca -0.01 -0.36 -0.05 0.00 -1.03 0.00 0.00 54.13 52.68 2fxr s LEU 106 Cb -0.09 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.13 2fxr s LEU 106 CO 0.02 0.13 -0.01 -0.70 0.23 0.00 0.00 176.35 176.02 2fxr s GLU 107 N 0.20 3.53 0.70 1.70 2.12 -0.14 -1.11 118.70 125.71 2fxr s GLU 107 Ca -0.08 -0.55 -0.11 0.00 0.36 0.00 0.00 54.97 54.59 2fxr s GLU 107 Cb -0.13 -3.08 0.01 0.00 0.26 0.00 0.00 34.13 31.19 2fxr s GLU 107 CO 0.03 -0.09 1.07 -0.51 -0.54 0.00 0.00 175.26 175.22 2fxr s LEU 108 N 1.25 3.15 0.20 2.70 1.43 -0.10 -0.04 118.68 127.26 2fxr s LEU 108 Ca 0.03 1.69 0.26 0.00 -1.03 0.00 0.00 54.13 55.08 2fxr s LEU 108 Cb -0.15 -4.51 0.86 0.00 0.03 0.00 0.00 46.19 42.43 2fxr s LEU 108 CO 0.01 -1.56 1.78 -0.62 0.23 0.00 0.00 176.35 176.18 2fxr n GLU 109 N -3.11 0.23 -3.83 1.70 1.02 -1.07 -4.48 120.64 111.10 2fxr n GLU 109 Ca 0.08 0.23 -0.11 0.00 -0.02 0.00 0.00 57.16 57.34 2fxr n GLU 109 Cb 0.53 -1.79 -0.08 0.00 -0.02 0.00 0.00 31.44 30.08 2fxr n GLU 109 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2fxr s GLU 110 N -3.12 0.67 0.51 3.49 0.41 -1.26 -5.03 118.70 114.36 2fxr s GLU 110 Ca 0.10 -0.55 -0.18 0.00 -0.41 0.00 0.00 54.97 53.93 2fxr s GLU 110 Cb 0.12 0.28 -0.08 0.00 -1.78 0.00 0.00 34.13 32.68 2fxr s GLU 110 CO 0.56 -0.19 1.00 -1.25 -0.49 0.00 0.00 175.26 174.89 2fxr s PRO 111 N -2.29 3.87 -0.05 0.39 0.04 -1.26 -4.72 135.00 130.97 2fxr s PRO 111 Ca -0.07 1.10 -0.03 0.00 0.04 0.00 0.00 61.00 62.04 2fxr s PRO 111 Cb -0.02 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 2fxr s PRO 111 CO -0.02 -0.35 0.12 0.14 0.04 0.00 0.00 177.00 176.93 2fxr s VAL 112 N -2.39 5.14 -0.19 -0.36 -7.23 0.83 -4.97 120.40 111.24 2fxr s VAL 112 Ca 0.62 -0.12 -0.29 0.00 -1.81 0.00 0.00 61.98 60.37 2fxr s VAL 112 Cb -0.12 -3.31 -0.01 0.00 0.56 0.00 0.00 36.38 33.50 2fxr s VAL 112 CO 0.26 0.45 1.28 -0.54 -0.31 0.00 0.00 175.10 176.25 2fxr s LYS 113 N -1.48 4.18 0.49 4.82 -0.14 -1.26 -4.78 119.74 121.56 2fxr s LYS 113 Ca 0.21 1.60 -0.15 0.00 -1.36 0.00 0.00 55.97 56.27 2fxr s LYS 113 Cb -0.12 -3.79 -0.07 0.00 -1.68 0.00 0.00 37.83 32.17 2fxr s LYS 113 CO 0.11 -0.78 0.93 0.08 -0.76 0.00 0.00 175.35 174.93 2fxr s VAL 114 N 3.66 4.60 0.00 3.17 1.01 -1.26 -4.95 120.40 126.63 2fxr s VAL 114 Ca 0.55 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.59 2fxr s VAL 114 Cb -0.21 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.44 2fxr s VAL 114 CO 0.16 -0.65 0.00 -1.54 0.00 0.00 0.00 175.10 173.07 2fxr n SER 115 N -1.53 0.00 0.15 3.32 3.41 0.20 -4.98 113.62 114.19 2fxr n SER 115 Ca 0.05 -0.96 0.00 0.00 -0.26 0.00 0.00 58.87 57.71 2fxr n SER 115 Cb 0.54 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.76 2fxr n SER 115 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2fxr h SER 116 N 0.00 0.07 0.82 4.04 0.02 -2.01 -3.02 113.55 113.47 2fxr h SER 116 Ca 0.00 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2fxr h SER 116 Cb 0.00 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2fxr h SER 116 CO 0.00 0.51 -0.70 -0.74 -1.14 0.00 0.00 176.83 174.76 2fxr h HIS 117 N 0.06 0.00 -1.31 3.45 -0.00 -1.94 -3.45 115.15 111.96 2fxr h HIS 117 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.35 2fxr h HIS 117 Cb 0.81 0.00 -0.24 0.00 -0.00 0.00 0.00 27.41 27.98 2fxr h HIS 117 CO 0.00 0.00 -0.38 0.54 -0.00 0.00 0.00 177.93 178.09 2fxr s VAL 118 N -3.18 -0.85 0.22 5.26 0.11 -1.14 -4.57 120.40 116.24 2fxr s VAL 118 Ca 0.06 -0.06 -0.09 0.00 -2.93 0.00 0.00 61.98 58.96 2fxr s VAL 118 Cb 0.13 -0.96 -0.01 0.00 -1.53 0.00 0.00 36.38 34.01 2fxr s VAL 118 CO 0.73 -0.07 0.35 -1.38 -3.33 0.00 0.00 175.10 171.40 2fxr s HIS 119 N 2.73 0.57 0.76 1.54 -0.00 -1.18 -0.63 115.29 119.08 2fxr s HIS 119 Ca 0.15 -0.89 -0.11 0.00 -0.00 0.00 0.00 55.06 54.21 2fxr s HIS 119 Cb -0.14 -0.05 0.05 0.00 -0.00 0.00 0.00 32.58 32.44 2fxr s HIS 119 CO -0.22 -0.85 1.08 0.95 -0.00 0.00 0.00 174.74 175.70 2fxr s THR 120 N -4.04 3.48 0.06 -5.38 -4.23 -1.26 -3.15 115.64 101.12 2fxr s THR 120 Ca 0.25 0.48 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 2fxr s THR 120 Cb 0.02 -3.04 -0.04 0.00 1.34 0.00 0.00 72.50 70.78 2fxr s THR 120 CO 0.08 -0.63 0.19 0.54 -0.54 0.00 0.00 174.62 174.26 2fxr s VAL 121 N -2.95 5.27 -0.05 2.29 0.11 0.54 -4.86 120.40 120.75 2fxr s VAL 121 Ca 0.60 -0.44 -0.24 0.00 -2.93 0.00 0.00 61.98 58.97 2fxr s VAL 121 Cb -0.16 -3.57 -0.04 0.00 -1.53 0.00 0.00 36.38 31.08 2fxr s VAL 121 CO 0.56 0.14 0.72 -0.89 -3.33 0.00 0.00 175.10 172.30 2fxr s THR 122 N -1.49 5.01 0.42 5.04 2.01 -1.25 -4.65 115.64 120.74 2fxr s THR 122 Ca 0.34 1.49 -0.21 0.00 0.31 0.00 0.00 61.69 63.62 2fxr s THR 122 Cb -0.13 -4.06 -0.11 0.00 0.01 0.00 0.00 72.50 68.21 2fxr s THR 122 CO 0.27 0.26 0.96 -0.76 -0.69 0.00 0.00 174.62 174.66 2fxr s LEU 123 N 0.71 3.97 0.49 4.42 1.02 -1.26 -2.02 118.68 126.01 2fxr s LEU 123 Ca 0.38 1.72 -0.14 0.00 0.02 0.00 0.00 54.13 56.12 2fxr s LEU 123 Cb -0.18 -4.49 -0.07 0.00 0.02 0.00 0.00 46.19 41.47 2fxr s LEU 123 CO 0.19 -0.36 0.92 -2.16 0.02 0.00 0.00 176.35 174.96 2fxr s PRO 124 N -3.07 3.85 0.51 1.29 0.04 -1.26 -4.86 135.00 131.48 2fxr s PRO 124 Ca 0.61 0.77 -0.21 0.00 0.04 0.00 0.00 61.00 62.21 2fxr s PRO 124 Cb -0.10 -2.21 -0.06 0.00 0.04 0.00 0.00 34.50 32.16 2fxr s PRO 124 CO 0.15 -0.24 1.16 -1.25 0.04 0.00 0.00 177.00 176.86 2fxr s PRO 125 N -4.15 3.52 0.63 0.56 0.04 -1.26 -4.88 135.00 129.46 2fxr s PRO 125 Ca 0.56 1.73 0.26 0.00 0.04 0.00 0.00 61.00 63.59 2fxr s PRO 125 Cb -0.10 -2.21 1.30 0.00 0.04 0.00 0.00 34.50 33.53 2fxr s PRO 125 CO 0.34 -0.74 1.74 0.00 0.04 0.00 0.00 177.00 178.38 2fxr h ALA 126 N 1.61 1.91 -0.21 8.56 0.00 -1.96 -1.02 119.26 128.13 2fxr h ALA 126 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2fxr h ALA 126 Cb 1.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2fxr h ALA 126 CO 0.58 -0.71 0.00 -1.13 0.00 0.00 0.00 179.25 178.00 2fxr n SER 127 N -3.19 2.89 -4.73 0.00 3.41 -1.26 -4.94 113.62 105.80 2fxr n SER 127 Ca 0.05 -1.91 -0.41 0.00 -0.26 0.00 0.00 58.87 56.33 2fxr n SER 127 Cb 0.68 -0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 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 -1.74 4.39 -0.16 4.33 2.56 -0.39 -4.96 118.70 122.73 2fxr s GLU 128 Ca 0.34 2.03 0.10 0.00 0.00 0.00 0.00 54.97 57.45 2fxr s GLU 128 Cb 0.21 -3.21 -0.17 0.00 2.00 0.00 0.00 34.13 32.96 2fxr s GLU 128 CO 0.31 -0.27 -0.01 -2.37 -0.56 0.00 0.00 175.26 172.35 2fxr n THR 129 N 2.89 1.04 -3.12 -1.70 5.66 -1.26 -4.95 114.28 112.83 2fxr n THR 129 Ca 0.07 -0.57 -0.03 0.00 -3.05 0.00 0.00 64.05 60.47 2fxr n THR 129 Cb 0.43 -0.77 0.00 0.00 -1.55 0.00 0.00 70.33 68.44 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 -2.70 -2.93 -2.43 1.09 3.72 -1.26 -4.99 117.46 107.96 2fxr n PHE 130 Ca -0.27 1.13 -0.28 0.00 -0.05 0.00 0.00 57.45 57.98 2fxr n PHE 130 Cb 0.95 -3.96 0.00 0.00 -0.94 0.00 0.00 39.48 35.53 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 -3.16 3.54 1.05 -1.08 0.04 -1.26 -4.96 135.00 129.17 2fxr s PRO 131 Ca 0.02 0.33 -0.19 0.00 0.04 0.00 0.00 61.00 61.20 2fxr s PRO 131 Cb -0.01 -2.30 0.01 0.00 0.04 0.00 0.00 34.50 32.25 2fxr s PRO 131 CO 0.77 -0.31 -0.28 -0.35 0.04 0.00 0.00 177.00 176.87 2fxr n PRO 132 N -2.39 -0.92 0.00 0.56 -0.04 -1.26 -2.69 135.00 128.26 2fxr n PRO 132 Ca 0.02 -0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.23 2fxr n PRO 132 Cb 0.55 -1.54 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2fxr n PRO 132 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fxr n GLY 133 N 2.32 1.87 3.66 0.55 0.00 -1.26 -4.95 105.19 107.38 2fxr n GLY 133 Ca 0.01 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 0.00 4.16 0.18 1.61 0.00 -1.10 -4.97 119.30 119.18 2fxr s MET 134 Ca 0.00 2.23 -0.29 0.00 0.00 0.00 0.00 55.69 57.63 2fxr s MET 134 Cb 0.00 -4.01 -0.08 0.00 0.00 0.00 0.00 34.83 30.74 2fxr s MET 134 CO 0.00 -0.88 0.93 -2.14 0.00 0.00 0.00 175.02 172.93 2fxr s PRO 135 N 4.13 4.76 0.26 4.11 0.02 -1.26 -4.40 135.00 142.62 2fxr s PRO 135 Ca 0.76 1.43 0.02 0.00 0.02 0.00 0.00 61.00 63.23 2fxr s PRO 135 Cb -0.34 -3.32 -0.05 0.00 0.02 0.00 0.00 34.50 30.81 2fxr s PRO 135 CO 0.31 0.40 0.06 0.00 -0.33 0.00 0.00 177.00 177.45 2fxr s TRP 137 N -3.58 1.30 -0.02 0.00 0.52 0.41 -1.30 118.94 116.27 2fxr s TRP 137 Ca 0.35 -0.45 0.04 0.00 0.02 0.00 0.00 56.10 56.06 2fxr s TRP 137 Cb 0.07 -0.73 -0.01 0.00 -1.15 0.00 0.00 33.47 31.66 2fxr s TRP 137 CO 0.12 0.08 -0.15 0.54 0.02 0.00 0.00 176.95 177.56 2fxr s VAL 138 N -1.22 1.23 0.17 4.03 0.11 -0.72 -0.75 120.40 123.24 2fxr s VAL 138 Ca -0.01 -0.64 0.07 0.00 -2.93 0.00 0.00 61.98 58.48 2fxr s VAL 138 Cb -0.10 -1.04 -0.04 0.00 -1.53 0.00 0.00 36.38 33.67 2fxr s VAL 138 CO 0.02 0.35 -0.14 0.42 -3.33 0.00 0.00 175.10 172.43 2fxr s THR 139 N -0.16 1.54 0.00 5.04 -4.23 -1.21 -2.04 115.64 114.58 2fxr s THR 139 Ca 0.02 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 2fxr s THR 139 Cb -0.08 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 71.89 2fxr s THR 139 CO 0.00 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.13 2fxr n GLY 140 N -0.07 -0.68 1.14 3.99 0.00 -0.89 -4.46 105.19 104.21 2fxr n GLY 140 Ca -0.11 -1.29 -0.02 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.93 1.16 -1.58 1.61 8.01 -1.26 -1.95 117.44 122.50 2fxr n TRP 141 Ca 0.00 -1.40 -0.25 0.00 -1.31 0.00 0.00 57.50 54.53 2fxr n TRP 141 Cb 0.00 -0.47 0.19 0.00 -2.01 0.00 0.00 31.31 29.02 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 -0.95 -1.79 3.59 6.99 0.00 -1.25 -4.70 105.19 107.08 2fxr n GLY 142 Ca 0.31 -1.65 -0.36 0.00 0.00 0.00 0.00 46.02 44.33 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 -3.96 0.26 -0.95 1.61 8.00 0.59 -2.94 116.55 119.16 2fxr n ASP 143 Ca 0.14 0.66 0.11 0.00 0.71 0.00 0.00 54.79 56.41 2fxr n ASP 143 Cb 0.50 -1.38 0.27 0.00 -0.02 0.00 0.00 41.12 40.49 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 -2.47 0.45 0.00 2.53 0.24 0.24 -1.26 118.33 118.06 2fxr n VAL 144 Ca 0.13 -0.62 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2fxr n VAL 144 Cb 0.49 0.71 0.00 0.00 -1.47 0.00 0.00 33.84 33.57 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 1.09 0.00 -4.63 -1.34 4.64 -1.24 -4.43 116.55 110.63 2fxr n ASP 145 Ca 0.18 0.00 -0.46 0.00 -1.38 0.00 0.00 54.79 53.13 2fxr n ASP 145 Cb 0.50 0.00 -0.04 0.00 -1.04 0.00 0.00 41.12 40.54 2fxr n ASP 145 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 2fxr n ASN 146 N 0.00 3.39 0.00 1.67 4.13 -1.26 -1.32 115.26 121.86 2fxr n ASN 146 Ca 0.00 0.74 0.00 0.00 1.68 0.00 0.00 54.58 57.00 2fxr n ASN 146 Cb 0.00 -1.42 0.00 0.00 -1.54 0.00 0.00 39.78 36.82 2fxr n ASN 146 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2fxr n ASP 147 N 8.24 -3.24 -4.16 6.41 8.00 -1.26 -4.98 116.55 125.55 2fxr n ASP 147 Ca 0.26 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.37 2fxr n ASP 147 Cb 0.34 -1.58 -0.09 0.00 -0.02 0.00 0.00 41.12 39.76 2fxr n ASP 147 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2fxr s GLU 149 N -0.73 2.37 0.62 -1.24 2.12 -0.44 -5.08 118.70 116.32 2fxr s GLU 149 Ca 0.00 -1.94 -0.19 0.00 0.36 0.00 0.00 54.97 53.20 2fxr s GLU 149 Cb 0.00 -3.80 -0.02 0.00 0.26 0.00 0.00 34.13 30.57 2fxr s GLU 149 CO 0.00 -1.15 1.30 1.03 -0.54 0.00 0.00 175.26 175.90 2fxr s ARG 150 N 1.00 2.73 0.00 4.30 1.81 -1.26 -0.59 118.95 126.94 2fxr s ARG 150 Ca 0.09 2.08 0.00 0.00 -1.72 0.00 0.00 55.73 56.18 2fxr s ARG 150 Cb -0.23 -1.94 0.00 0.00 -0.45 0.00 0.00 34.95 32.32 2fxr s ARG 150 CO -0.03 -1.46 0.00 -0.11 -0.68 0.00 0.00 175.30 173.02 2fxr n LEU 151 N -1.68 0.00 -0.23 2.53 7.94 -1.26 -4.62 117.00 119.69 2fxr n LEU 151 Ca 0.14 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.04 2fxr n LEU 151 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 2fxr n LEU 151 CO 0.48 -0.68 0.00 -0.81 -1.11 0.00 0.00 177.39 175.27 2fxr n PRO 152 N -0.68 0.00 -2.87 1.96 -0.04 -1.26 -5.04 135.00 127.08 2fxr n PRO 152 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.42 2fxr n PRO 152 Cb 0.00 -0.44 0.02 0.00 -0.04 0.00 0.00 33.50 33.04 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 -2.38 -2.65 0.54 3.72 -1.26 -3.77 117.46 111.65 2fxr n PHE 153 Ca 0.00 0.89 -0.32 0.00 -0.05 0.00 0.00 57.45 57.96 2fxr n PHE 153 Cb 0.00 -3.77 -0.05 0.00 -0.94 0.00 0.00 39.48 34.72 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 -3.38 4.07 -0.04 -1.08 0.04 -1.26 -1.94 135.00 131.39 2fxr s PRO 154 Ca 0.13 0.98 -0.30 0.00 0.04 0.00 0.00 61.00 61.85 2fxr s PRO 154 Cb -0.02 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 2fxr s PRO 154 CO 0.63 -0.13 1.32 -1.17 0.04 0.00 0.00 177.00 177.70 2fxr s LEU 155 N -3.60 4.28 0.22 -3.56 2.96 -1.05 -4.77 118.68 113.17 2fxr s LEU 155 Ca 0.60 1.95 0.07 0.00 -0.22 0.00 0.00 54.13 56.53 2fxr s LEU 155 Cb -0.10 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 2fxr s LEU 155 CO 0.22 -0.68 0.15 -0.54 -1.32 0.00 0.00 176.35 174.18 2fxr s LYS 156 N 2.55 2.83 0.07 1.98 1.02 -0.82 -0.65 119.74 126.72 2fxr s LYS 156 Ca 0.60 -1.04 0.02 0.00 0.02 0.00 0.00 55.97 55.57 2fxr s LYS 156 Cb -0.28 -2.53 -0.03 0.00 -0.52 0.00 0.00 37.83 34.47 2fxr s LYS 156 CO 0.23 0.42 -0.08 1.14 -0.92 0.00 0.00 175.35 176.15 2fxr s GLN 157 N -3.57 0.66 -0.23 1.68 -2.07 -0.90 -2.09 119.66 113.13 2fxr s GLN 157 Ca 0.32 -0.99 -0.18 0.00 -1.82 0.00 0.00 55.36 52.69 2fxr s GLN 157 Cb -0.08 -0.29 0.06 0.00 -1.09 0.00 0.00 33.01 31.61 2fxr s GLN 157 CO 0.24 0.03 0.60 0.54 -1.32 0.00 0.00 175.29 175.38 2fxr s VAL 158 N -2.21 -0.00 -0.16 3.63 0.11 -0.87 -2.46 120.40 118.44 2fxr s VAL 158 Ca -0.01 0.01 -0.28 0.00 -2.93 0.00 0.00 61.98 58.77 2fxr s VAL 158 Cb -0.04 -0.85 -0.01 0.00 -1.53 0.00 0.00 36.38 33.95 2fxr s VAL 158 CO -0.01 0.01 0.96 -0.75 -3.33 0.00 0.00 175.10 171.97 2fxr s LYS 159 N 0.82 4.34 -0.08 1.54 2.20 -1.26 -1.75 119.74 125.55 2fxr s LYS 159 Ca -0.04 1.26 0.04 0.00 -0.36 0.00 0.00 55.97 56.87 2fxr s LYS 159 Cb -0.05 -3.58 -0.02 0.00 -1.51 0.00 0.00 37.83 32.68 2fxr s LYS 159 CO -0.06 -0.40 -0.18 0.14 -0.36 0.00 0.00 175.35 174.48 2fxr s VAL 160 N 2.36 2.63 0.03 4.02 -7.23 -0.42 -4.91 120.40 116.89 2fxr s VAL 160 Ca 0.44 -0.85 -0.30 0.00 -1.81 0.00 0.00 61.98 59.46 2fxr s VAL 160 Cb -0.17 -2.03 -0.05 0.00 0.56 0.00 0.00 36.38 34.70 2fxr s VAL 160 CO 0.13 0.56 1.13 -2.16 -0.31 0.00 0.00 175.10 174.45 2fxr s PRO 161 N -0.17 4.47 -0.02 4.82 0.04 -1.26 -3.62 135.00 139.26 2fxr s PRO 161 Ca -0.02 1.64 -0.19 0.00 0.04 0.00 0.00 61.00 62.48 2fxr s PRO 161 Cb -0.14 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.95 2fxr s PRO 161 CO 0.03 -0.21 0.54 0.42 0.04 0.00 0.00 177.00 177.82 2fxr s ILE 162 N 1.16 4.97 0.14 0.56 1.01 -1.26 -1.01 121.20 126.78 2fxr s ILE 162 Ca 0.56 1.11 0.09 0.00 0.00 0.00 0.00 60.65 62.42 2fxr s ILE 162 Cb -0.26 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 2fxr s ILE 162 CO 0.28 0.44 -0.22 -0.04 0.00 0.00 0.00 174.94 175.40 2fxr s MET 163 N -0.26 1.29 0.46 2.79 -1.94 -0.99 -3.99 119.30 116.66 2fxr s MET 163 Ca 0.28 -1.33 -0.25 0.00 -1.71 0.00 0.00 55.69 52.68 2fxr s MET 163 Cb -0.17 -1.54 -0.08 0.00 2.01 0.00 0.00 34.83 35.05 2fxr s MET 163 CO 0.15 0.34 1.40 -1.21 -0.01 0.00 0.00 175.02 175.70 2fxr s GLU 164 N -2.34 3.65 0.28 2.03 2.02 -1.26 -4.42 118.70 118.66 2fxr s GLU 164 Ca 0.13 2.36 0.01 0.00 0.02 0.00 0.00 54.97 57.49 2fxr s GLU 164 Cb -0.08 -2.61 0.63 0.00 0.10 0.00 0.00 34.13 32.17 2fxr s GLU 164 CO 0.06 -0.83 1.72 -0.91 0.02 0.00 0.00 175.26 175.33 2fxr h ASN 165 N 2.25 0.38 0.89 -0.19 -0.26 -1.93 -0.42 115.58 116.29 2fxr h ASN 165 Ca -0.51 0.13 -0.01 0.00 -0.56 0.00 0.00 56.30 55.35 2fxr h ASN 165 Cb 1.27 0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 38.62 2fxr h ASN 165 CO 0.61 0.08 -0.04 1.12 -1.06 0.00 0.00 177.43 178.14 2fxr h HIS 166 N 0.47 0.00 -0.07 1.19 2.07 -1.92 -1.25 115.15 115.64 2fxr h HIS 166 Ca 0.51 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 57.92 2fxr h HIS 166 Cb 0.88 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.86 2fxr h HIS 166 CO -0.13 0.04 -0.40 0.82 -3.07 0.00 0.00 177.93 175.20 2fxr h ILE 167 N 0.00 1.41 -0.46 6.12 1.08 -1.43 -2.56 117.51 121.67 2fxr h ILE 167 Ca -0.00 -1.80 -0.10 0.00 -0.39 0.00 0.00 64.86 62.57 2fxr h ILE 167 Cb 0.50 2.33 -0.01 0.00 -3.07 0.00 0.00 36.82 36.56 2fxr h ILE 167 CO 0.01 0.52 -0.11 0.00 -0.69 0.00 0.00 178.15 177.88 2fxr h ASP 169 N 0.73 0.56 -0.51 0.00 3.58 -1.28 -0.32 116.42 119.18 2fxr h ASP 169 Ca 0.12 0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.54 2fxr h ASP 169 Cb 0.65 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.57 2fxr h ASP 169 CO 0.04 0.39 0.19 0.00 -2.88 0.00 0.00 179.24 176.98 2fxr h ALA 170 N 1.27 1.30 0.00 -0.78 0.00 -1.36 -2.65 119.26 117.03 2fxr h ALA 170 Ca 0.24 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2fxr h ALA 170 Cb 0.05 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2fxr h ALA 170 CO -0.12 0.51 -0.63 0.87 0.00 0.00 0.00 179.25 179.88 2fxr h LYS 171 N 0.80 0.00 0.00 0.00 1.57 -0.88 -2.82 116.57 115.24 2fxr h LYS 171 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2fxr h LYS 171 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2fxr h LYS 171 CO -0.01 0.63 0.00 1.88 -0.57 0.00 0.00 179.45 181.38 2fxr h TYR 172 N 0.00 0.00 0.00 -1.35 -1.99 -0.72 -2.10 116.97 110.81 2fxr h TYR 172 Ca -0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.72 2fxr h TYR 172 Cb 1.21 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.94 2fxr h TYR 172 CO 0.00 0.00 -0.58 0.45 -0.00 0.00 0.00 178.16 178.03 2fxr h HIS 173 N 0.00 0.00 -2.88 4.88 3.86 -1.41 -3.43 115.15 116.18 2fxr h HIS 173 Ca 0.00 0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.66 2fxr h HIS 173 Cb 0.44 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2fxr h HIS 173 CO 0.00 0.00 0.86 -0.51 0.86 0.00 0.00 177.93 179.14 2fxr s LEU 173 N -4.80 4.31 -0.18 2.43 1.43 -0.79 -2.26 118.68 118.82 2fxr s LEU 173 Ca 0.05 2.09 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 2fxr s LEU 173 Cb 0.11 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2fxr s LEU 173 CO 0.72 -0.74 0.00 0.61 0.23 0.00 0.00 176.35 177.17 2fxr n GLY 173 N 3.69 0.44 3.26 -3.19 0.00 -1.26 -5.04 105.19 103.10 2fxr n GLY 173 Ca 0.14 -0.94 -0.17 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.07 1.58 -0.42 4.61 0.00 -0.96 -5.04 121.76 119.46 2fxr s ALA 173 Ca 0.00 -1.44 0.23 0.00 0.00 0.00 0.00 51.96 50.75 2fxr s ALA 173 Cb 0.00 -0.03 0.24 0.00 0.00 0.00 0.00 23.12 23.33 2fxr s ALA 173 CO 0.00 0.02 1.33 1.88 0.00 0.00 0.00 175.76 178.98 2fxr h TYR 173 N 3.05 0.00 -2.74 0.00 0.05 -1.95 -3.47 116.97 111.91 2fxr h TYR 173 Ca -0.38 0.00 -0.56 0.00 0.05 0.00 0.00 58.73 57.84 2fxr h TYR 173 Cb 1.20 0.00 0.07 0.00 1.01 0.00 0.00 36.73 39.01 2fxr h TYR 173 CO 0.66 0.00 0.78 2.41 -1.05 0.00 0.00 178.16 180.96 2fxr n THR 173 N -2.65 0.63 0.00 -2.88 -1.04 -1.26 -5.15 114.28 101.93 2fxr n THR 173 Ca 0.02 -0.16 0.00 0.00 -2.04 0.00 0.00 64.05 61.88 2fxr n THR 173 Cb 0.51 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 67.34 2fxr n THR 173 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2fxr n GLY 173 N 2.68 -2.43 2.99 3.41 0.00 -1.26 -4.94 105.19 105.64 2fxr n GLY 173 Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2fxr n GLY 173 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2fxr n ASP 173 N 0.00 0.00 -4.56 1.61 5.75 -1.26 -4.72 116.55 113.37 2fxr n ASP 173 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.36 2fxr n ASP 173 Cb 0.00 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 2fxr n ASP 173 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2fxr s VAL 173 N 0.00 4.05 0.06 2.12 1.01 -1.26 -4.99 120.40 121.39 2fxr s VAL 173 Ca 0.00 0.61 -0.31 0.00 0.00 0.00 0.00 61.98 62.29 2fxr s VAL 173 Cb 0.00 -4.72 -0.09 0.00 0.00 0.00 0.00 36.38 31.57 2fxr s VAL 173 CO 0.00 -1.40 1.74 -0.60 0.00 0.00 0.00 175.10 174.84 2fxr s ARG 174 N 4.85 4.17 -0.21 2.72 3.52 -1.26 -4.92 118.95 127.83 2fxr s ARG 174 Ca 0.38 2.42 -0.16 0.00 -0.13 0.00 0.00 55.73 58.24 2fxr s ARG 174 Cb -0.09 -3.73 -0.11 0.00 -1.56 0.00 0.00 34.95 29.46 2fxr s ARG 174 CO 0.21 -0.81 -0.15 -0.89 -0.81 0.00 0.00 175.30 172.86 2fxr n ILE 175 N 4.95 1.50 -2.75 4.11 5.41 -1.26 -4.73 119.36 126.58 2fxr n ILE 175 Ca 0.17 -0.04 -0.42 0.00 1.00 0.00 0.00 62.75 63.46 2fxr n ILE 175 Cb 0.40 -2.14 -0.04 0.00 -0.71 0.00 0.00 39.64 37.16 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 -2.49 4.13 0.92 1.39 1.01 -1.26 -4.98 120.40 119.12 2fxr s VAL 176 Ca -0.28 -0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 2fxr s VAL 176 Cb 0.07 -4.75 0.15 0.00 0.00 0.00 0.00 36.38 31.85 2fxr s VAL 176 CO 0.45 -1.56 1.17 -0.13 0.00 0.00 0.00 175.10 175.03 2fxr s ARG 177 N 4.61 1.03 0.38 2.72 0.52 -1.26 -4.87 118.95 122.08 2fxr s ARG 177 Ca 0.27 0.12 0.17 0.00 -0.52 0.00 0.00 55.73 55.78 2fxr s ARG 177 Cb -0.14 -1.84 0.73 0.00 0.52 0.00 0.00 34.95 34.22 2fxr s ARG 177 CO 0.13 -2.24 1.77 -0.44 0.02 0.00 0.00 175.30 174.54 2fxr h ASP 178 N -1.52 0.00 -0.09 0.23 3.32 -1.98 -2.40 116.42 113.98 2fxr h ASP 178 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2fxr h ASP 178 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 2fxr h ASP 178 CO 0.57 0.38 0.00 -0.90 -1.72 0.00 0.00 179.24 177.57 2fxr n ASP 179 N -3.70 0.78 -4.65 6.45 5.75 -1.26 -4.81 116.55 115.10 2fxr n ASP 179 Ca -0.01 -2.03 -0.24 0.00 -0.01 0.00 0.00 54.79 52.50 2fxr n ASP 179 Cb 0.47 -0.18 -0.08 0.00 -1.03 0.00 0.00 41.12 40.30 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 -1.71 2.17 0.02 0.11 -1.94 -0.91 0.08 119.30 117.13 2fxr s MET 180 Ca 0.06 -1.63 0.02 0.00 -1.71 0.00 0.00 55.69 52.43 2fxr s MET 180 Cb 0.04 -2.03 -0.01 0.00 2.01 0.00 0.00 34.83 34.83 2fxr s MET 180 CO 0.04 0.19 -0.06 -1.17 -0.01 0.00 0.00 175.02 174.01 2fxr s LEU 181 N -3.73 2.12 -0.06 -0.03 0.20 0.36 -4.52 118.68 113.03 2fxr s LEU 181 Ca 0.34 -0.30 0.05 0.00 0.69 0.00 0.00 54.13 54.92 2fxr s LEU 181 Cb -0.02 -0.17 -0.01 0.00 -0.43 0.00 0.00 46.19 45.56 2fxr s LEU 181 CO 0.20 -0.08 -0.23 0.00 -0.29 0.00 0.00 176.35 175.96 2fxr s ALA 183 N -0.05 -1.26 0.00 0.00 0.00 -0.89 -2.34 121.76 117.22 2fxr s ALA 183 Ca -0.05 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.18 2fxr s ALA 183 Cb -0.14 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.70 2fxr s ALA 183 CO 0.04 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 175.54 2fxr n GLY 184 N -0.18 1.37 0.00 0.00 0.00 -0.18 -1.66 105.19 104.55 2fxr n GLY 184 Ca -0.17 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 43.85 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 0.00 0.00 0.00 1.61 2.04 0.52 -4.65 115.26 114.77 2fxr n ASN 185 Ca 0.00 -0.86 0.07 0.00 -0.44 0.00 0.00 54.58 53.35 2fxr n ASN 185 Cb 0.00 0.00 0.39 0.00 -2.53 0.00 0.00 39.78 37.64 2fxr n ASN 185 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 2fxr n THR 186 N 0.00 0.05 0.00 5.53 -2.24 -1.26 -2.83 114.28 113.54 2fxr n THR 186 Ca 0.00 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 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 -1.02 1.82 -3.87 -0.78 1.74 -1.26 -4.82 116.66 108.47 2fxr n ARG 187 Ca 0.10 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.92 2fxr n ARG 187 Cb 0.05 -0.91 -0.17 0.00 -1.02 0.00 0.00 32.46 30.41 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 -1.68 1.26 0.08 5.56 0.52 -1.13 -3.43 118.95 120.12 2fxr s ARG 188 Ca 0.00 -0.17 -0.27 0.00 -0.52 0.00 0.00 55.73 54.77 2fxr s ARG 188 Cb 0.00 -1.45 0.08 0.00 0.52 0.00 0.00 34.95 34.11 2fxr s ARG 188 CO 0.00 -0.29 1.02 0.34 0.02 0.00 0.00 175.30 176.39 2fxr s ASP 189 N 1.78 -0.19 0.21 0.23 -1.08 -0.98 -0.36 116.67 116.29 2fxr s ASP 189 Ca 0.05 -0.26 0.02 0.00 -0.52 0.00 0.00 52.55 51.84 2fxr s ASP 189 Cb -0.13 0.39 -0.03 0.00 -1.46 0.00 0.00 42.92 41.69 2fxr s ASP 189 CO -0.07 -0.71 0.36 -0.94 0.52 0.00 0.00 175.17 174.33 2fxr s SER 190 N -2.82 6.34 0.30 -0.34 1.04 -1.26 0.23 113.70 117.18 2fxr s SER 190 Ca 0.11 0.22 0.04 0.00 0.48 0.00 0.00 55.95 56.80 2fxr s SER 190 Cb -0.00 -1.93 -0.02 0.00 0.10 0.00 0.00 66.02 64.17 2fxr s SER 190 CO -0.01 -0.05 0.15 0.00 0.98 0.00 0.00 173.24 174.31 2fxr n GLN 192 N -0.64 1.41 0.00 0.00 3.00 -1.26 -1.60 117.38 118.29 2fxr n GLN 192 Ca -0.01 0.51 0.00 0.00 -0.01 0.00 0.00 57.00 57.49 2fxr n GLN 192 Cb 0.47 -2.19 0.00 0.00 0.00 0.00 0.00 30.24 28.52 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 3.02 2.56 0.03 1.08 0.00 -1.26 -0.30 105.19 110.32 2fxr n GLY 193 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 2fxr n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2fxr n ASP 194 N 0.00 0.62 -4.49 1.61 8.00 -0.63 -3.96 116.55 117.70 2fxr n ASP 194 Ca 0.00 -0.30 -0.49 0.00 0.71 0.00 0.00 54.79 54.72 2fxr n ASP 194 Cb 0.00 0.86 -0.03 0.00 -0.02 0.00 0.00 41.12 41.92 2fxr n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2fxr n SER 195 N -1.90 0.02 0.00 -2.24 7.64 -1.26 -0.57 113.62 115.32 2fxr n SER 195 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2fxr n SER 195 Cb 0.43 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 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 1.75 3.10 3.58 0.23 0.00 -0.10 0.26 105.19 114.00 2fxr n GLY 196 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.72 1.55 0.32 -0.02 0.00 0.27 -3.35 107.32 104.36 2fxr s GLY 197 Ca 0.00 -0.67 -0.03 0.00 0.00 0.00 0.00 44.72 44.02 2fxr s GLY 197 CO 0.00 0.13 0.56 2.56 0.00 0.00 0.00 173.10 176.34 2fxr s PRO 198 N -5.13 3.57 -0.20 2.90 0.04 -1.26 -1.70 135.00 133.22 2fxr s PRO 198 Ca 0.69 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.60 2fxr s PRO 198 Cb -0.15 -2.65 0.05 0.00 0.04 0.00 0.00 34.50 31.79 2fxr s PRO 198 CO 0.58 0.18 -0.07 -1.17 0.04 0.00 0.00 177.00 176.55 2fxr s LEU 199 N -3.88 2.08 0.04 -3.56 2.96 -0.85 -3.28 118.68 112.19 2fxr s LEU 199 Ca 0.42 -0.87 0.09 0.00 -0.22 0.00 0.00 54.13 53.55 2fxr s LEU 199 Cb -0.10 -1.09 -0.03 0.00 0.50 0.00 0.00 46.19 45.47 2fxr s LEU 199 CO 0.33 -0.18 -0.24 0.68 -1.32 0.00 0.00 176.35 175.61 2fxr s VAL 200 N 1.49 2.29 0.01 1.68 -7.23 0.07 -0.75 120.40 117.96 2fxr s VAL 200 Ca -0.02 -1.33 0.06 0.00 -1.81 0.00 0.00 61.98 58.88 2fxr s VAL 200 Cb -0.16 -1.91 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 2fxr s VAL 200 CO -0.08 0.37 -0.19 0.00 -0.31 0.00 0.00 175.10 174.90 2fxr s LYS 202 N -0.70 3.86 0.00 0.00 2.36 -1.26 -1.64 119.74 122.36 2fxr s LYS 202 Ca 0.07 0.40 0.00 0.00 -2.55 0.00 0.00 55.97 53.89 2fxr s LYS 202 Cb -0.08 -3.76 0.00 0.00 -1.05 0.00 0.00 37.83 32.94 2fxr s LYS 202 CO 0.00 -0.72 0.00 0.28 1.55 0.00 0.00 175.35 176.47 2fxr n VAL 203 N 5.59 0.00 -2.21 4.02 0.31 -0.50 -4.81 118.33 120.73 2fxr n VAL 203 Ca 0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.96 2fxr n VAL 203 Cb 0.48 -0.13 0.01 0.00 -0.91 0.00 0.00 33.84 33.29 2fxr n VAL 203 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2fxr n ASN 204 N 0.00 7.53 0.00 4.52 3.02 -1.26 -4.63 115.26 124.44 2fxr n ASN 204 Ca 0.00 -3.47 0.00 0.00 -0.03 0.00 0.00 54.58 51.08 2fxr n ASN 204 Cb 0.00 -1.23 0.00 0.00 -0.61 0.00 0.00 39.78 37.94 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 0.59 2.37 3.72 7.41 0.00 -1.26 -5.00 105.19 113.01 2fxr n GLY 205 Ca 0.53 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.24 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 -3.05 4.28 -0.13 2.61 2.01 -1.26 -5.10 115.64 115.00 2fxr s THR 206 Ca 0.00 -0.74 -0.16 0.00 0.31 0.00 0.00 61.69 61.10 2fxr s THR 206 Cb 0.00 -3.00 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 2fxr s THR 206 CO 0.00 0.23 0.41 0.26 -0.69 0.00 0.00 174.62 174.82 2fxr s TRP 207 N -1.25 3.51 -0.04 4.92 0.52 -1.26 -1.41 118.94 123.92 2fxr s TRP 207 Ca 0.24 0.79 0.05 0.00 0.02 0.00 0.00 56.10 57.20 2fxr s TRP 207 Cb -0.12 -2.46 -0.01 0.00 -1.15 0.00 0.00 33.47 29.74 2fxr s TRP 207 CO 0.16 0.22 -0.19 -0.51 0.02 0.00 0.00 176.95 176.65 2fxr s LEU 208 N 0.47 1.96 -0.53 2.99 1.43 -0.65 -3.77 118.68 120.58 2fxr s LEU 208 Ca 0.22 -0.39 -0.28 0.00 -1.03 0.00 0.00 54.13 52.66 2fxr s LEU 208 Cb -0.14 -1.06 0.03 0.00 0.03 0.00 0.00 46.19 45.05 2fxr s LEU 208 CO 0.08 0.18 1.11 -1.58 0.23 0.00 0.00 176.35 176.37 2fxr s GLN 209 N -0.06 3.56 0.04 1.70 0.74 -0.86 -1.33 119.66 123.45 2fxr s GLN 209 Ca -0.03 0.28 0.02 0.00 0.05 0.00 0.00 55.36 55.68 2fxr s GLN 209 Cb -0.12 -3.97 -0.25 0.00 1.10 0.00 0.00 33.01 29.77 2fxr s GLN 209 CO 0.02 -1.50 0.99 0.00 -0.55 0.00 0.00 175.29 174.26 2fxr h ALA 210 N 9.35 0.35 -2.86 1.58 0.00 -1.30 -3.39 119.26 122.98 2fxr h ALA 210 Ca -0.24 -1.07 -0.28 0.00 0.00 0.00 0.00 54.91 53.31 2fxr h ALA 210 Cb 1.06 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.90 2fxr h ALA 210 CO 1.13 1.22 -0.30 0.20 0.00 0.00 0.00 179.25 181.50 2fxr s GLY 211 N -4.86 1.54 -0.11 0.00 0.00 -0.97 -2.21 107.32 100.70 2fxr s GLY 211 Ca -0.05 -1.58 0.01 0.00 0.00 0.00 0.00 44.72 43.10 2fxr s GLY 211 CO 0.84 -1.11 -0.11 0.14 0.00 0.00 0.00 173.10 172.87 2fxr s VAL 212 N -3.41 1.23 -0.18 1.40 1.01 -1.04 -2.00 120.40 117.41 2fxr s VAL 212 Ca 0.33 -0.45 -0.37 0.00 0.00 0.00 0.00 61.98 61.49 2fxr s VAL 212 Cb 0.01 -1.18 -0.13 0.00 0.00 0.00 0.00 36.38 35.07 2fxr s VAL 212 CO 0.19 0.40 1.83 0.52 0.00 0.00 0.00 175.10 178.04 2fxr n VAL 213 N 4.57 0.46 0.00 2.92 0.31 -0.69 -1.19 118.33 124.70 2fxr n VAL 213 Ca -0.16 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 2fxr n VAL 213 Cb 0.51 -1.59 0.00 0.00 -0.91 0.00 0.00 33.84 31.85 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 6.20 0.00 -1.12 4.52 2.88 -0.95 -0.93 113.62 124.21 2fxr n SER 214 Ca 0.25 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2fxr n SER 214 Cb 0.22 0.00 -0.00 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 -0.23 -0.01 0.00 0.66 4.27 -0.90 -4.85 117.44 116.38 2fxr n TRP 215 Ca 0.00 -0.02 0.00 0.00 -3.89 0.00 0.00 57.50 53.59 2fxr n TRP 215 Cb 0.00 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.95 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 0.49 2.32 3.43 -1.67 0.00 -1.26 -0.93 105.19 107.56 2fxr n GLY 216 Ca 0.00 -0.88 -0.44 0.00 0.00 0.00 0.00 46.02 44.70 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 3.46 1.56 1.61 2.12 -1.26 -4.89 118.70 119.30 2fxr s GLU 217 Ca 0.00 -1.67 0.00 0.00 0.36 0.00 0.00 54.97 53.66 2fxr s GLU 217 Cb 0.00 -4.68 0.00 0.00 0.26 0.00 0.00 34.13 29.71 2fxr s GLU 217 CO 0.00 -1.69 0.00 0.41 -0.54 0.00 0.00 175.26 173.44 2fxr n GLY 219 N 5.26 -1.60 3.11 -1.50 0.00 -1.26 -4.66 105.19 104.54 2fxr n GLY 219 Ca 0.15 -1.31 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 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 3.21 -1.00 -2.47 0.00 0.00 -1.26 -4.73 120.51 114.26 2fxr n ALA 221 Ca -0.18 0.10 -0.34 0.00 0.00 0.00 0.00 53.44 53.01 2fxr n ALA 221 Cb 0.53 -2.58 -0.06 0.00 0.00 0.00 0.00 19.45 17.35 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 -5.77 3.85 -0.19 0.00 -1.52 -1.26 -4.02 119.66 110.75 2fxr s GLN 221 Ca 0.30 0.31 -0.39 0.00 -1.95 0.00 0.00 55.36 53.63 2fxr s GLN 221 Cb -0.16 -2.92 -0.16 0.00 -0.22 0.00 0.00 33.01 29.56 2fxr s GLN 221 CO 0.38 0.49 1.66 -2.30 -0.25 0.00 0.00 175.29 175.26 2fxr n PRO 222 N 0.69 1.18 -1.70 2.91 -0.02 -1.26 -1.57 135.00 135.23 2fxr n PRO 222 Ca -0.05 0.43 -0.15 0.00 -2.02 0.00 0.00 63.50 61.70 2fxr n PRO 222 Cb 0.52 -2.11 -0.05 0.00 -0.02 0.00 0.00 33.50 31.84 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 4.76 -4.77 -3.17 2.55 5.03 -1.26 -4.93 115.26 113.48 2fxr n ASN 223 Ca 0.25 0.26 -0.20 0.00 0.87 0.00 0.00 54.58 55.75 2fxr n ASN 223 Cb 0.15 -3.71 -0.04 0.00 -1.02 0.00 0.00 39.78 35.16 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 -2.53 0.84 -1.11 3.52 5.12 -0.61 -3.74 116.66 118.15 2fxr n ARG 224 Ca -0.16 -3.22 -0.32 0.00 -1.93 0.00 0.00 57.85 52.21 2fxr n ARG 224 Cb 0.54 -1.44 0.12 0.00 -1.16 0.00 0.00 32.46 30.52 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 -1.68 1.72 0.58 5.56 0.04 -1.26 -4.32 135.00 135.64 2fxr s PRO 225 Ca 0.37 1.55 -0.19 0.00 0.04 0.00 0.00 61.00 62.77 2fxr s PRO 225 Cb 0.26 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.95 2fxr s PRO 225 CO -0.10 -2.11 1.21 0.20 0.04 0.00 0.00 177.00 176.24 2fxr s GLY 226 N -2.56 2.74 -0.11 0.56 0.00 -0.66 -4.78 107.32 102.52 2fxr s GLY 226 Ca 0.69 1.00 0.03 0.00 0.00 0.00 0.00 44.72 46.44 2fxr s GLY 226 CO 0.52 1.40 -0.21 -0.42 0.00 0.00 0.00 173.10 174.39 2fxr s ILE 227 N -1.59 2.30 0.10 0.90 -1.09 -0.11 -2.10 121.20 119.61 2fxr s ILE 227 Ca 0.76 -0.93 0.10 0.00 -2.23 0.00 0.00 60.65 58.35 2fxr s ILE 227 Cb -0.30 -1.90 -0.04 0.00 -1.58 0.00 0.00 42.46 38.64 2fxr s ILE 227 CO 0.33 0.55 -0.26 -0.31 -1.23 0.00 0.00 174.94 174.02 2fxr s TYR 228 N 0.37 2.25 0.13 3.97 1.51 0.24 -2.12 117.35 123.70 2fxr s TYR 228 Ca -0.16 -0.39 -0.31 0.00 -1.01 0.00 0.00 57.07 55.19 2fxr s TYR 228 Cb -0.17 -1.26 -0.08 0.00 -0.11 0.00 0.00 41.96 40.33 2fxr s TYR 228 CO 0.08 0.26 1.41 0.99 -1.11 0.00 0.00 175.55 177.18 2fxr s THR 229 N -0.98 3.18 -0.61 -0.71 2.01 -0.33 0.14 115.64 118.33 2fxr s THR 229 Ca 0.13 0.86 -0.28 0.00 0.31 0.00 0.00 61.69 62.71 2fxr s THR 229 Cb -0.10 -3.55 0.01 0.00 0.01 0.00 0.00 72.50 68.88 2fxr s THR 229 CO 0.05 0.07 1.42 -0.60 -0.69 0.00 0.00 174.62 174.87 2fxr s ARG 230 N 1.00 3.21 0.31 4.92 3.52 0.11 -2.49 118.95 129.53 2fxr s ARG 230 Ca 0.65 0.31 0.04 0.00 -0.13 0.00 0.00 55.73 56.60 2fxr s ARG 230 Cb -0.38 -4.16 0.66 0.00 -1.56 0.00 0.00 34.95 29.51 2fxr s ARG 230 CO 0.31 -2.06 1.84 0.28 -0.81 0.00 0.00 175.30 174.86 2fxr h VAL 231 N 6.35 0.87 0.00 7.11 2.07 -1.74 -1.82 116.25 129.08 2fxr h VAL 231 Ca -0.27 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2fxr h VAL 231 Cb 1.09 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2fxr h VAL 231 CO 1.20 0.16 -0.04 0.71 0.02 0.00 0.00 177.57 179.62 2fxr h THR 232 N 0.88 0.31 0.00 2.57 1.35 -1.88 -2.13 112.91 114.01 2fxr h THR 232 Ca 0.49 -0.25 -0.05 0.00 -0.55 0.00 0.00 66.41 66.05 2fxr h THR 232 Cb 0.61 1.19 -0.01 0.00 -1.73 0.00 0.00 68.15 68.21 2fxr h THR 232 CO -0.26 0.04 -0.23 0.22 -0.25 0.00 0.00 175.52 175.04 2fxr h TYR 233 N 0.00 0.00 -0.26 4.73 5.03 -1.69 -3.24 116.97 121.54 2fxr h TYR 233 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2fxr h TYR 233 Cb 0.18 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.46 2fxr h TYR 233 CO 0.00 0.23 0.00 0.66 -1.32 0.00 0.00 178.16 177.73 2fxr n TYR 234 N -3.38 0.36 -0.24 -3.82 4.01 -0.81 -4.73 117.16 108.54 2fxr n TYR 234 Ca 0.00 -0.51 0.04 0.00 -0.16 0.00 0.00 57.90 57.27 2fxr n TYR 234 Cb 0.45 -0.04 0.14 0.00 -0.31 0.00 0.00 39.34 39.58 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 1.50 -0.29 -0.81 7.72 3.38 -1.56 -0.69 115.31 124.57 2fxr h LEU 235 Ca 0.00 0.18 0.07 0.00 0.09 0.00 0.00 57.88 58.22 2fxr h LEU 235 Cb 0.69 0.30 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 2fxr h LEU 235 CO 0.01 -0.14 0.48 0.44 0.09 0.00 0.00 178.44 179.32 2fxr h ASP 236 N 0.12 0.73 -0.19 -0.43 3.32 -1.86 -1.73 116.42 116.38 2fxr h ASP 236 Ca 0.38 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 2fxr h ASP 236 Cb 0.65 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2fxr h ASP 236 CO -0.60 0.46 0.06 -0.25 -1.72 0.00 0.00 179.24 177.19 2fxr h TRP 237 N 0.86 0.31 -0.78 4.55 7.01 -1.51 -3.00 115.95 123.39 2fxr h TRP 237 Ca 0.37 -0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.43 2fxr h TRP 237 Cb 0.23 -0.09 -0.07 0.00 -2.10 0.00 0.00 29.16 27.13 2fxr h TRP 237 CO -0.05 0.39 0.43 0.82 -2.79 0.00 0.00 178.44 177.25 2fxr h ILE 238 N 0.14 0.90 0.00 2.65 2.04 -0.85 -1.36 117.51 121.04 2fxr h ILE 238 Ca 0.06 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2fxr h ILE 238 Cb 0.22 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 2fxr h ILE 238 CO -0.00 0.13 0.00 1.41 0.00 0.00 0.00 178.15 179.69 2fxr n HIS 239 N -4.78 0.00 0.70 1.37 8.25 -0.70 -0.73 115.22 119.34 2fxr n HIS 239 Ca 0.12 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.71 2fxr n HIS 239 Cb 0.27 0.00 0.33 0.00 1.12 0.00 0.00 29.99 31.70 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 -1.00 0.56 0.00 4.41 8.25 -0.51 -4.38 115.22 122.54 2fxr n HIS 240 Ca 0.14 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.76 2fxr n HIS 240 Cb 0.07 -0.69 0.00 0.00 1.12 0.00 0.00 29.99 30.48 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 -2.01 0.00 -3.31 4.41 4.01 -0.69 -5.04 117.16 114.53 2fxr n TYR 241 Ca 0.05 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.41 2fxr n TYR 241 Cb 0.41 0.03 -0.06 0.00 -0.31 0.00 0.00 39.34 39.41 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 -1.89 5.18 0.74 -0.72 1.01 0.09 -5.05 120.40 119.76 2fxr s VAL 242 Ca 0.00 0.95 -0.15 0.00 0.00 0.00 0.00 61.98 62.78 2fxr s VAL 242 Cb 0.00 -3.82 0.04 0.00 0.00 0.00 0.00 36.38 32.60 2fxr s VAL 242 CO 0.00 0.31 1.22 -2.84 0.00 0.00 0.00 175.10 173.79 2fxr s PRO 243 N 0.74 2.06 0.00 2.72 0.02 -1.26 -4.32 135.00 134.95 2fxr s PRO 243 Ca 0.26 1.81 0.30 0.00 0.02 0.00 0.00 61.00 63.38 2fxr s PRO 243 Cb -0.15 -1.82 1.38 0.00 0.02 0.00 0.00 34.50 33.93 2fxr s PRO 243 CO 0.10 -1.91 1.93 1.63 -0.33 0.00 0.00 177.00 178.42