#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uxr s LYS 2 N 0.00 3.22 0.25 0.03 1.02 -1.26 -5.11 119.74 117.89 2uxr s LYS 2 Ca 0.00 1.25 -0.31 0.00 0.02 0.00 0.00 55.97 56.93 2uxr s LYS 2 Cb 0.00 -2.02 -0.11 0.00 -0.52 0.00 0.00 37.83 35.18 2uxr s LYS 2 CO 0.00 -0.89 1.62 0.42 -0.92 0.00 0.00 175.35 175.57 2uxr s ILE 3 N -2.41 2.15 -0.01 2.17 1.01 -0.48 -4.68 121.20 118.94 2uxr s ILE 3 Ca 0.64 0.12 -0.06 0.00 0.00 0.00 0.00 60.65 61.35 2uxr s ILE 3 Cb -0.17 -3.08 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 2uxr s ILE 3 CO 0.37 0.02 0.25 -1.10 0.00 0.00 0.00 174.94 174.48 2uxr s GLN 4 N 0.13 3.56 -0.06 2.79 -1.52 -1.26 0.89 119.66 124.18 2uxr s GLN 4 Ca 0.67 -0.09 0.01 0.00 -1.95 0.00 0.00 55.36 54.00 2uxr s GLN 4 Cb -0.47 -3.10 -0.03 0.00 -0.22 0.00 0.00 33.01 29.19 2uxr s GLN 4 CO 0.42 0.67 -0.07 -1.64 -0.25 0.00 0.00 175.29 174.41 2uxr s MET 5 N -1.68 2.74 -0.15 2.91 -1.94 -1.26 -4.83 119.30 115.09 2uxr s MET 5 Ca 0.26 -0.55 -0.21 0.00 -1.71 0.00 0.00 55.69 53.48 2uxr s MET 5 Cb -0.13 -2.59 -0.24 0.00 2.01 0.00 0.00 34.83 33.88 2uxr s MET 5 CO 0.15 0.66 0.48 -0.22 -0.01 0.00 0.00 175.02 176.09 2uxr h LYS 6 N 5.21 0.10 -6.37 2.03 3.64 -1.95 -3.48 116.57 115.75 2uxr h LYS 6 Ca -0.49 -0.17 -0.68 0.00 -1.27 0.00 0.00 60.65 58.04 2uxr h LYS 6 Cb 1.17 0.06 -0.20 0.00 -0.41 0.00 0.00 32.23 32.85 2uxr h LYS 6 CO 0.52 1.08 -0.75 0.99 -2.27 0.00 0.00 179.45 179.03 2uxr s THR 7 N -2.37 3.29 0.39 1.00 2.01 -1.26 -5.11 115.64 113.59 2uxr s THR 7 Ca -0.23 -0.85 -0.26 0.00 0.31 0.00 0.00 61.69 60.65 2uxr s THR 7 Cb 0.03 -2.38 -0.09 0.00 0.01 0.00 0.00 72.50 70.07 2uxr s THR 7 CO 0.68 0.44 1.29 -2.16 -0.69 0.00 0.00 174.62 174.19 2uxr s PRO 8 N -1.23 4.03 0.18 4.92 0.04 -1.26 -4.84 135.00 136.84 2uxr s PRO 8 Ca 0.15 2.15 -0.30 0.00 0.04 0.00 0.00 61.00 63.03 2uxr s PRO 8 Cb -0.11 -2.80 -0.08 0.00 0.04 0.00 0.00 34.50 31.55 2uxr s PRO 8 CO 0.05 -0.43 1.08 -1.17 0.04 0.00 0.00 177.00 176.57 2uxr s LEU 9 N -2.33 4.50 -0.17 -3.56 2.96 -0.40 -4.84 118.68 114.83 2uxr s LEU 9 Ca 0.56 2.08 -0.28 0.00 -0.22 0.00 0.00 54.13 56.26 2uxr s LEU 9 Cb -0.38 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 42.70 2uxr s LEU 9 CO 0.49 -0.19 0.98 -0.69 -1.32 0.00 0.00 176.35 175.62 2uxr s VAL 10 N -0.32 4.76 -0.20 1.68 1.01 -0.69 -0.59 120.40 126.05 2uxr s VAL 10 Ca 0.49 1.95 -0.02 0.00 0.00 0.00 0.00 61.98 64.40 2uxr s VAL 10 Cb -0.29 -4.28 -0.00 0.00 0.00 0.00 0.00 36.38 31.81 2uxr s VAL 10 CO 0.35 -0.07 -0.10 -0.70 0.00 0.00 0.00 175.10 174.58 2uxr s GLU 11 N 2.57 3.27 -0.33 2.72 2.12 -0.28 0.28 118.70 129.05 2uxr s GLU 11 Ca 0.44 -0.69 -0.06 0.00 0.36 0.00 0.00 54.97 55.03 2uxr s GLU 11 Cb -0.16 -2.84 0.04 0.00 0.26 0.00 0.00 34.13 31.42 2uxr s GLU 11 CO 0.12 -0.15 0.09 -0.51 -0.54 0.00 0.00 175.26 174.26 2uxr s LEU 12 N 1.29 4.19 0.79 2.70 1.02 0.33 0.29 118.68 129.28 2uxr s LEU 12 Ca 0.03 -1.09 -0.11 0.00 0.02 0.00 0.00 54.13 52.99 2uxr s LEU 12 Cb -0.14 -1.85 0.08 0.00 0.02 0.00 0.00 46.19 44.30 2uxr s LEU 12 CO -0.05 -0.30 1.14 -0.62 0.02 0.00 0.00 176.35 176.55 2uxr s ASP 13 N 1.40 4.52 0.00 2.29 -1.08 0.07 -0.81 116.67 123.06 2uxr s ASP 13 Ca -0.01 0.66 0.00 0.00 -0.52 0.00 0.00 52.55 52.68 2uxr s ASP 13 Cb -0.19 -1.17 0.00 0.00 -1.46 0.00 0.00 42.92 40.10 2uxr s ASP 13 CO 0.02 -1.86 0.00 0.61 0.52 0.00 0.00 175.17 174.46 2uxr n GLY 14 N -3.23 5.50 3.35 2.66 0.00 -1.26 -2.20 105.19 110.01 2uxr n GLY 14 Ca 0.08 -0.98 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 2uxr n GLY 14 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2uxr s ASP 15 N 1.04 2.61 1.51 1.61 1.01 0.42 -4.08 116.67 120.78 2uxr s ASP 15 Ca 0.00 -1.02 0.00 0.00 0.71 0.00 0.00 52.55 52.24 2uxr s ASP 15 Cb 0.00 -0.14 0.00 0.00 1.01 0.00 0.00 42.92 43.79 2uxr s ASP 15 CO 0.00 -0.16 0.00 -0.62 0.21 0.00 0.00 175.17 174.60 2uxr n GLU 16 N -0.37 0.00 0.07 8.23 1.02 -1.26 -1.76 120.64 126.56 2uxr n GLU 16 Ca -0.08 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.93 2uxr n GLU 16 Cb 0.60 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.97 2uxr n GLU 16 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 2uxr h MET 17 N 0.00 0.38 0.00 3.49 4.05 -1.49 -2.29 114.93 119.07 2uxr h MET 17 Ca 0.00 -0.43 -0.06 0.00 -0.28 0.00 0.00 59.70 58.93 2uxr h MET 17 Cb 0.00 0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 2uxr h MET 17 CO 0.00 1.11 -0.30 1.79 0.23 0.00 0.00 176.91 179.74 2uxr h THR 18 N 0.20 0.77 -0.11 -0.77 1.35 -1.60 -0.78 112.91 111.97 2uxr h THR 18 Ca -0.08 -1.25 -0.18 0.00 -0.55 0.00 0.00 66.41 64.34 2uxr h THR 18 Cb 1.62 1.78 -0.00 0.00 -1.73 0.00 0.00 68.15 69.82 2uxr h THR 18 CO 0.17 0.29 -0.70 -0.09 -0.25 0.00 0.00 175.52 174.93 2uxr h ARG 19 N 0.00 0.48 -0.41 4.72 2.43 -1.03 -2.20 114.38 118.37 2uxr h ARG 19 Ca -0.00 -0.38 -0.01 0.00 -0.81 0.00 0.00 59.98 58.79 2uxr h ARG 19 Cb 0.76 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 2uxr h ARG 19 CO 0.04 1.00 0.23 0.28 -1.51 0.00 0.00 179.97 180.01 2uxr h VAL 20 N 0.34 1.15 -0.18 0.20 2.07 -0.84 -3.27 116.25 115.71 2uxr h VAL 20 Ca -0.03 -0.36 -0.15 0.00 0.82 0.00 0.00 66.70 66.98 2uxr h VAL 20 Cb 1.28 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 2uxr h VAL 20 CO 0.13 0.15 -0.52 -0.07 0.02 0.00 0.00 177.57 177.28 2uxr h LEU 21 N 0.53 0.54 -0.60 2.57 3.38 -1.12 -3.35 115.31 117.26 2uxr h LEU 21 Ca 0.15 -0.28 0.11 0.00 0.09 0.00 0.00 57.88 57.94 2uxr h LEU 21 Cb 0.04 -0.15 -0.11 0.00 0.09 0.00 0.00 40.66 40.52 2uxr h LEU 21 CO -0.02 0.96 -0.33 -0.25 0.09 0.00 0.00 178.44 178.88 2uxr h TRP 22 N 0.39 -0.93 0.00 1.13 2.91 -1.45 -0.89 115.95 117.11 2uxr h TRP 22 Ca 0.01 0.07 -0.01 0.00 1.13 0.00 0.00 58.89 60.10 2uxr h TRP 22 Cb 1.04 0.49 -0.00 0.00 -0.51 0.00 0.00 29.16 30.18 2uxr h TRP 22 CO 0.04 -0.38 -0.05 -1.00 -1.03 0.00 0.00 178.44 176.01 2uxr h PRO 23 N -0.16 0.00 -0.32 2.65 0.13 -1.73 -2.57 132.00 130.01 2uxr h PRO 23 Ca 0.23 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.23 2uxr h PRO 23 Cb 0.55 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 2uxr h PRO 23 CO -0.69 0.05 -0.33 -0.07 -0.23 0.00 0.00 178.00 176.74 2uxr h LEU 24 N 0.00 0.84 0.07 1.56 3.38 -1.35 0.40 115.31 120.21 2uxr h LEU 24 Ca -0.00 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 2uxr h LEU 24 Cb 0.12 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2uxr h LEU 24 CO 0.01 1.14 -0.04 0.40 0.09 0.00 0.00 178.44 180.04 2uxr h ILE 25 N 0.56 0.92 0.10 1.22 2.04 -1.25 0.20 117.51 121.30 2uxr h ILE 25 Ca 0.05 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.90 2uxr h ILE 25 Cb 0.91 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 2uxr h ILE 25 CO 0.08 0.00 -0.05 0.11 0.00 0.00 0.00 178.15 178.29 2uxr h LYS 26 N -0.10 -0.13 -0.43 2.37 1.57 -1.41 0.48 116.57 118.92 2uxr h LYS 26 Ca -0.01 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2uxr h LYS 26 Cb 0.08 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2uxr h LYS 26 CO 0.01 -0.07 0.21 -0.44 -0.57 0.00 0.00 179.45 178.59 2uxr h ASP 27 N -0.16 0.57 0.83 0.86 5.19 -0.86 -0.12 116.42 122.73 2uxr h ASP 27 Ca -0.01 -0.13 -0.12 0.00 -0.62 0.00 0.00 57.03 56.14 2uxr h ASP 27 Cb 0.12 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.47 2uxr h ASP 27 CO 0.02 0.54 -1.25 0.11 -3.12 0.00 0.00 179.24 175.55 2uxr h LYS 28 N 0.56 0.00 0.00 3.56 1.79 -1.00 -3.38 116.57 118.10 2uxr h LYS 28 Ca 0.15 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.58 2uxr h LYS 28 Cb 0.12 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.77 2uxr h LYS 28 CO -0.02 0.22 -1.21 1.28 -1.08 0.00 0.00 179.45 178.65 2uxr n LEU 29 N -2.86 0.00 -0.01 2.94 4.77 0.15 -4.60 117.00 117.39 2uxr n LEU 29 Ca -0.07 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.86 2uxr n LEU 29 Cb 0.76 0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.88 2uxr n LEU 29 CO 0.42 0.05 -0.40 0.18 -1.33 0.00 0.00 177.39 176.31 2uxr n LEU 30 N -1.94 1.22 -0.14 2.23 4.77 -1.14 -4.73 117.00 117.27 2uxr n LEU 30 Ca -0.04 0.18 0.05 0.00 -0.03 0.00 0.00 56.01 56.18 2uxr n LEU 30 Cb 0.42 -0.43 0.37 0.00 -2.33 0.00 0.00 43.42 41.45 2uxr n LEU 30 CO 0.07 -0.37 1.21 -0.07 -1.33 0.00 0.00 177.39 176.90 2uxr h LEU 31 N -0.35 0.63 -2.87 2.23 3.38 -1.21 0.59 115.31 117.70 2uxr h LEU 31 Ca -0.07 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2uxr h LEU 31 Cb 0.59 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2uxr h LEU 31 CO -0.04 0.42 0.00 -0.65 0.09 0.00 0.00 178.44 178.26 2uxr h PRO 32 N 0.72 0.00 0.00 1.13 0.11 -1.80 -3.33 132.00 128.82 2uxr h PRO 32 Ca 0.27 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.37 2uxr h PRO 32 Cb 0.15 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.26 2uxr h PRO 32 CO -0.08 0.00 -1.05 1.19 -0.21 0.00 0.00 178.00 177.85 2uxr n PHE 33 N -3.02 0.00 -4.66 0.65 3.72 -0.66 -4.91 117.46 108.58 2uxr n PHE 33 Ca -0.03 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.14 2uxr n PHE 33 Cb 0.07 -0.03 -0.16 0.00 -0.94 0.00 0.00 39.48 38.42 2uxr n PHE 33 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2uxr s ILE 34 N -2.03 1.16 -1.11 4.37 1.01 0.11 -1.39 121.20 123.32 2uxr s ILE 34 Ca -0.00 -0.59 -0.20 0.00 0.00 0.00 0.00 60.65 59.87 2uxr s ILE 34 Cb 0.00 -0.99 0.09 0.00 0.01 0.00 0.00 42.46 41.57 2uxr s ILE 34 CO 0.03 0.34 1.47 -1.81 0.00 0.00 0.00 174.94 174.97 2uxr s ASP 35 N -0.04 6.70 -0.16 3.58 1.01 0.26 -4.36 116.67 123.65 2uxr s ASP 35 Ca -0.01 -2.05 -0.29 0.00 0.71 0.00 0.00 52.55 50.91 2uxr s ASP 35 Cb -0.09 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.31 2uxr s ASP 35 CO 0.01 -1.23 1.32 -0.22 0.21 0.00 0.00 175.17 175.26 2uxr s LEU 36 N 3.88 4.17 -0.31 1.23 2.96 -1.26 -4.30 118.68 125.04 2uxr s LEU 36 Ca 0.45 1.72 -0.11 0.00 -0.22 0.00 0.00 54.13 55.97 2uxr s LEU 36 Cb -0.00 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 2uxr s LEU 36 CO -0.03 -0.82 0.20 -1.10 -1.32 0.00 0.00 176.35 173.27 2uxr s GLN 37 N 3.66 3.57 0.11 1.98 -0.21 -1.26 -5.09 119.66 122.41 2uxr s GLN 37 Ca 0.58 -0.58 0.03 0.00 0.02 0.00 0.00 55.36 55.41 2uxr s GLN 37 Cb -0.23 -3.68 -0.04 0.00 1.00 0.00 0.00 33.01 30.06 2uxr s GLN 37 CO 0.17 -0.36 -0.09 0.95 -2.12 0.00 0.00 175.29 173.84 2uxr s THR 38 N 1.70 0.94 -0.36 -0.19 -4.23 -1.26 -1.27 115.64 110.96 2uxr s THR 38 Ca 0.06 -1.76 -0.10 0.00 -1.18 0.00 0.00 61.69 58.71 2uxr s THR 38 Cb -0.17 -1.49 0.03 0.00 1.34 0.00 0.00 72.50 72.21 2uxr s THR 38 CO 0.09 -0.64 0.19 -1.61 -0.54 0.00 0.00 174.62 172.10 2uxr s GLU 39 N -3.12 2.84 -0.09 3.99 0.41 0.24 -4.89 118.70 118.08 2uxr s GLU 39 Ca 0.08 -1.06 -0.17 0.00 -0.41 0.00 0.00 54.97 53.41 2uxr s GLU 39 Cb -0.01 -3.67 -0.05 0.00 -1.78 0.00 0.00 34.13 28.62 2uxr s GLU 39 CO -0.01 -0.67 0.44 -0.47 -0.49 0.00 0.00 175.26 174.07 2uxr s TYR 40 N 1.54 3.56 -0.12 1.61 5.04 -1.26 -1.12 117.35 126.59 2uxr s TYR 40 Ca 0.02 0.89 0.01 0.00 -2.44 0.00 0.00 57.07 55.54 2uxr s TYR 40 Cb -0.19 -2.47 0.02 0.00 0.35 0.00 0.00 41.96 39.67 2uxr s TYR 40 CO 0.06 0.29 -0.12 0.71 -1.34 0.00 0.00 175.55 175.15 2uxr s TYR 41 N 0.20 1.86 -0.52 4.97 2.02 0.15 -4.96 117.35 121.06 2uxr s TYR 41 Ca 0.24 -0.95 -0.22 0.00 -0.37 0.00 0.00 57.07 55.77 2uxr s TYR 41 Cb -0.15 -1.41 0.04 0.00 -0.40 0.00 0.00 41.96 40.05 2uxr s TYR 41 CO 0.10 -0.55 0.80 0.34 -1.57 0.00 0.00 175.55 174.67 2uxr s ASP 42 N 1.39 6.30 -0.38 2.29 2.15 -1.26 -0.75 116.67 126.41 2uxr s ASP 42 Ca 0.01 -0.53 0.07 0.00 0.43 0.00 0.00 52.55 52.53 2uxr s ASP 42 Cb -0.13 -2.37 0.64 0.00 -0.30 0.00 0.00 42.92 40.76 2uxr s ASP 42 CO -0.07 -1.05 1.78 0.18 -0.17 0.00 0.00 175.17 175.83 2uxr n LEU 43 N 6.86 5.91 -4.76 -1.34 4.32 -0.93 -4.54 117.00 122.51 2uxr n LEU 43 Ca -0.01 -3.56 -0.38 0.00 -0.02 0.00 0.00 56.01 52.04 2uxr n LEU 43 Cb 0.47 -0.76 0.02 0.00 -1.62 0.00 0.00 43.42 41.52 2uxr n LEU 43 CO 0.59 1.04 0.91 -0.83 -1.22 0.00 0.00 177.39 177.88 2uxr s GLY 44 N -1.57 2.83 0.42 -0.72 0.00 -1.25 -4.58 107.32 102.45 2uxr s GLY 44 Ca 0.53 1.13 0.10 0.00 0.00 0.00 0.00 44.72 46.49 2uxr s GLY 44 CO 0.09 1.62 2.02 1.19 0.00 0.00 0.00 173.10 178.01 2uxr h ILE 45 N 1.60 1.00 -0.08 0.90 6.09 -1.91 -0.47 117.51 124.64 2uxr h ILE 45 Ca -0.50 -0.17 -0.20 0.00 -1.37 0.00 0.00 64.86 62.62 2uxr h ILE 45 Cb 1.28 0.46 -0.00 0.00 0.47 0.00 0.00 36.82 39.03 2uxr h ILE 45 CO 0.58 0.09 -0.77 -0.33 -3.07 0.00 0.00 178.15 174.65 2uxr h GLU 46 N 0.50 0.48 0.00 2.19 5.08 -1.96 -0.61 114.58 120.26 2uxr h GLU 46 Ca 0.22 -0.41 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 2uxr h GLU 46 Cb 0.23 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2uxr h GLU 46 CO -0.06 1.05 -0.48 1.49 -1.00 0.00 0.00 179.01 180.01 2uxr h GLU 47 N 0.32 0.00 -0.03 2.33 4.57 -1.43 0.76 114.58 121.10 2uxr h GLU 47 Ca -0.04 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.89 2uxr h GLU 47 Cb 1.37 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.97 2uxr h GLU 47 CO 0.14 0.48 -0.96 0.00 -1.18 0.00 0.00 179.01 177.49 2uxr h ARG 48 N 0.00 0.64 -0.46 1.92 3.08 -0.98 -2.55 114.38 116.02 2uxr h ARG 48 Ca -0.00 -0.65 -0.02 0.00 0.07 0.00 0.00 59.98 59.37 2uxr h ARG 48 Cb 0.97 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.18 2uxr h ARG 48 CO 0.06 1.25 0.20 0.22 -1.07 0.00 0.00 179.97 180.63 2uxr h ASP 49 N 0.38 0.63 -0.11 7.04 3.58 -1.05 1.26 116.42 128.15 2uxr h ASP 49 Ca -0.10 -0.15 -0.04 0.00 0.42 0.00 0.00 57.03 57.15 2uxr h ASP 49 Cb 1.60 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 42.48 2uxr h ASP 49 CO 0.18 0.61 -0.04 -0.09 -2.88 0.00 0.00 179.24 177.02 2uxr h ARG 50 N 0.61 0.37 -0.52 0.28 2.43 -0.79 -2.67 114.38 114.08 2uxr h ARG 50 Ca 0.16 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2uxr h ARG 50 Cb 0.16 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2uxr h ARG 50 CO -0.02 0.43 0.00 0.25 -1.51 0.00 0.00 179.97 179.13 2uxr n THR 51 N -4.30 1.80 -3.84 0.20 -2.24 -0.97 -4.96 114.28 99.97 2uxr n THR 51 Ca 0.00 -1.30 -0.29 0.00 -2.27 0.00 0.00 64.05 60.20 2uxr n THR 51 Cb 0.24 0.11 0.04 0.00 -2.10 0.00 0.00 70.33 68.62 2uxr n THR 51 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2uxr n ASN 52 N 0.68 -5.08 0.00 3.42 3.02 -0.74 -1.41 115.26 115.16 2uxr n ASN 52 Ca 0.22 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 54.05 2uxr n ASN 52 Cb 0.81 -4.16 0.00 0.00 -0.61 0.00 0.00 39.78 35.82 2uxr n ASN 52 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2uxr n ASP 53 N -2.88 -2.70 -0.01 6.41 2.03 0.43 -4.90 116.55 114.92 2uxr n ASP 53 Ca 0.02 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.25 2uxr n ASP 53 Cb 0.54 -1.63 0.08 0.00 -0.72 0.00 0.00 41.12 39.39 2uxr n ASP 53 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 2uxr h GLN 54 N 0.94 0.59 -0.74 -0.67 5.75 -1.47 -2.71 115.11 116.79 2uxr h GLN 54 Ca 0.00 -0.32 0.16 0.00 -0.15 0.00 0.00 58.65 58.34 2uxr h GLN 54 Cb 0.29 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 28.81 2uxr h GLN 54 CO 0.00 0.91 0.50 0.97 -2.65 0.00 0.00 178.83 178.56 2uxr h ILE 55 N 0.47 0.76 -0.83 2.39 6.09 -1.87 0.21 117.51 124.73 2uxr h ILE 55 Ca 0.03 -0.11 -0.04 0.00 -1.37 0.00 0.00 64.86 63.37 2uxr h ILE 55 Cb 0.96 0.40 -0.04 0.00 0.47 0.00 0.00 36.82 38.61 2uxr h ILE 55 CO 0.09 0.06 0.38 0.74 -3.07 0.00 0.00 178.15 176.34 2uxr h THR 56 N 0.33 1.26 -0.06 2.19 2.02 -1.83 -1.24 112.91 115.58 2uxr h THR 56 Ca 0.36 -0.76 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 2uxr h THR 56 Cb 0.94 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2uxr h THR 56 CO -0.10 0.32 -0.06 0.40 0.37 0.00 0.00 175.52 176.45 2uxr h ILE 57 N 1.19 1.37 -0.63 3.11 2.04 -0.71 -2.57 117.51 121.31 2uxr h ILE 57 Ca 0.28 -1.19 0.12 0.00 1.00 0.00 0.00 64.86 65.06 2uxr h ILE 57 Cb 0.15 2.02 -0.12 0.00 -0.74 0.00 0.00 36.82 38.13 2uxr h ILE 57 CO -0.03 0.33 -0.29 0.44 0.00 0.00 0.00 178.15 178.60 2uxr h ASP 58 N -0.28 -1.01 -0.33 1.72 3.32 -1.18 -0.91 116.42 117.75 2uxr h ASP 58 Ca 0.01 0.22 0.04 0.00 0.02 0.00 0.00 57.03 57.33 2uxr h ASP 58 Cb 0.56 0.54 -0.04 0.00 0.22 0.00 0.00 39.33 40.60 2uxr h ASP 58 CO 0.01 -0.28 0.09 0.00 -1.72 0.00 0.00 179.24 177.34 2uxr h ALA 59 N 1.22 0.37 -0.54 3.45 0.00 -1.09 -0.07 119.26 122.60 2uxr h ALA 59 Ca 0.27 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.26 2uxr h ALA 59 Cb 0.54 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2uxr h ALA 59 CO -0.70 -0.31 0.31 0.00 0.00 0.00 0.00 179.25 178.55 2uxr h ALA 60 N 1.23 0.69 -0.54 0.00 0.00 -1.21 -0.25 119.26 119.19 2uxr h ALA 60 Ca 0.15 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2uxr h ALA 60 Cb 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2uxr h ALA 60 CO -0.18 0.00 0.27 0.93 0.00 0.00 0.00 179.25 180.28 2uxr h GLU 61 N 0.61 0.74 -0.21 0.00 4.39 -0.63 -1.72 114.58 117.76 2uxr h GLU 61 Ca 0.22 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 59.71 2uxr h GLU 61 Cb 0.06 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 2uxr h GLU 61 CO -0.12 0.57 -0.41 0.00 -1.16 0.00 0.00 179.01 177.88 2uxr h ALA 62 N 1.55 0.89 -0.34 3.43 0.00 0.18 -1.68 119.26 123.29 2uxr h ALA 62 Ca 0.19 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2uxr h ALA 62 Cb 0.05 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2uxr h ALA 62 CO -0.03 0.64 0.17 0.82 0.00 0.00 0.00 179.25 180.85 2uxr h ILE 63 N 0.42 1.15 -0.48 0.00 2.04 -0.48 -1.06 117.51 119.11 2uxr h ILE 63 Ca 0.03 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 2uxr h ILE 63 Cb 0.90 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2uxr h ILE 63 CO 0.08 0.16 0.29 0.11 0.00 0.00 0.00 178.15 178.78 2uxr h LYS 64 N 0.42 0.65 -0.00 2.37 1.57 -1.20 0.86 116.57 121.23 2uxr h LYS 64 Ca 0.12 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2uxr h LYS 64 Cb 0.10 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2uxr h LYS 64 CO -0.02 0.46 -0.02 -0.22 -0.57 0.00 0.00 179.45 179.09 2uxr h LYS 65 N 0.66 0.01 0.07 3.15 3.64 -0.87 -3.38 116.57 119.85 2uxr h LYS 65 Ca 0.17 -0.01 -0.33 0.00 -1.27 0.00 0.00 60.65 59.22 2uxr h LYS 65 Cb -0.02 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 2uxr h LYS 65 CO -0.03 0.74 -1.82 1.88 -2.27 0.00 0.00 179.45 177.95 2uxr h TYR 66 N -0.71 0.26 0.00 1.91 0.05 -1.16 -3.50 116.97 113.83 2uxr h TYR 66 Ca -0.00 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.59 2uxr h TYR 66 Cb 0.74 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.47 2uxr h TYR 66 CO 0.18 1.39 0.00 0.41 -1.05 0.00 0.00 178.16 179.09 2uxr n GLY 67 N 1.76 0.60 2.88 3.88 0.00 0.30 -5.04 105.19 109.57 2uxr n GLY 67 Ca -0.23 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 2uxr n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2uxr s VAL 68 N -0.93 0.44 0.22 1.61 1.01 -1.25 -1.42 120.40 120.08 2uxr s VAL 68 Ca 0.00 -0.09 0.10 0.00 0.00 0.00 0.00 61.98 62.00 2uxr s VAL 68 Cb 0.00 -0.48 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 2uxr s VAL 68 CO 0.00 0.20 -0.20 -0.83 0.00 0.00 0.00 175.10 174.26 2uxr s GLY 69 N 0.82 1.66 -0.06 4.51 0.00 -0.52 -1.70 107.32 112.04 2uxr s GLY 69 Ca -0.10 -1.68 0.05 0.00 0.00 0.00 0.00 44.72 42.98 2uxr s GLY 69 CO -0.00 -1.74 -0.20 0.54 0.00 0.00 0.00 173.10 171.70 2uxr s VAL 70 N -2.18 1.65 -0.05 1.40 0.11 0.14 -1.60 120.40 119.87 2uxr s VAL 70 Ca 0.23 -0.83 0.03 0.00 -2.93 0.00 0.00 61.98 58.48 2uxr s VAL 70 Cb -0.06 -1.42 0.01 0.00 -1.53 0.00 0.00 36.38 33.38 2uxr s VAL 70 CO 0.10 0.47 -0.13 -0.75 -3.33 0.00 0.00 175.10 171.46 2uxr s LYS 71 N 0.09 1.63 0.47 1.54 2.20 -0.12 -0.52 119.74 125.04 2uxr s LYS 71 Ca -0.07 -0.47 -0.02 0.00 -0.36 0.00 0.00 55.97 55.06 2uxr s LYS 71 Cb -0.13 -1.38 -0.01 0.00 -1.51 0.00 0.00 37.83 34.79 2uxr s LYS 71 CO 0.04 0.11 0.73 1.21 -0.36 0.00 0.00 175.35 177.08 2uxr s ASN 72 N 0.38 5.89 0.22 1.43 2.47 0.01 -3.73 114.94 121.61 2uxr s ASN 72 Ca -0.09 0.49 -0.30 0.00 0.42 0.00 0.00 52.86 53.38 2uxr s ASN 72 Cb -0.13 -1.73 -0.09 0.00 -1.45 0.00 0.00 41.25 37.85 2uxr s ASN 72 CO 0.03 -0.72 1.19 0.00 -3.72 0.00 0.00 177.10 173.88 2uxr s ALA 73 N -2.65 3.44 0.21 1.71 0.00 -1.26 -4.56 121.76 118.65 2uxr s ALA 73 Ca 0.48 0.97 0.11 0.00 0.00 0.00 0.00 51.96 53.53 2uxr s ALA 73 Cb -0.10 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 2uxr s ALA 73 CO 0.40 -0.35 -0.23 0.95 0.00 0.00 0.00 175.76 176.53 2uxr s THR 74 N -0.39 2.39 -0.01 0.00 -4.23 -1.26 -0.44 115.64 111.70 2uxr s THR 74 Ca 0.51 -2.11 -0.27 0.00 -1.18 0.00 0.00 61.69 58.64 2uxr s THR 74 Cb -0.33 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.30 2uxr s THR 74 CO 0.39 -0.18 0.87 -0.63 -0.54 0.00 0.00 174.62 174.53 2uxr s ILE 75 N -1.85 4.89 -0.36 2.99 1.01 -1.26 -4.75 121.20 121.87 2uxr s ILE 75 Ca 0.23 1.82 -0.16 0.00 0.00 0.00 0.00 60.65 62.54 2uxr s ILE 75 Cb -0.07 -4.21 -0.00 0.00 0.01 0.00 0.00 42.46 38.19 2uxr s ILE 75 CO 0.11 0.22 0.38 -0.89 0.00 0.00 0.00 174.94 174.76 2uxr s THR 76 N 0.76 5.15 0.01 2.92 2.01 -1.26 -4.82 115.64 120.41 2uxr s THR 76 Ca 0.46 -0.06 -0.30 0.00 0.31 0.00 0.00 61.69 62.10 2uxr s THR 76 Cb -0.20 -3.88 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2uxr s THR 76 CO 0.24 -0.18 1.14 -2.16 -0.69 0.00 0.00 174.62 172.98 2uxr s PRO 77 N 2.04 4.44 0.00 4.92 0.04 -1.26 -4.98 135.00 140.20 2uxr s PRO 77 Ca 0.12 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.80 2uxr s PRO 77 Cb -0.17 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 30.94 2uxr s PRO 77 CO 0.12 -0.26 0.00 0.27 0.04 0.00 0.00 177.00 177.17 2uxr n ASN 78 N 4.30 0.28 -0.25 6.66 0.23 -1.26 -4.26 115.26 120.96 2uxr n ASN 78 Ca 0.09 -0.91 0.04 0.00 -0.53 0.00 0.00 54.58 53.27 2uxr n ASN 78 Cb 0.48 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.46 2uxr n ASN 78 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2uxr h GLN 79 N 0.00 0.90 -0.54 -3.83 4.20 -1.99 -1.20 115.11 112.65 2uxr h GLN 79 Ca 0.00 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2uxr h GLN 79 Cb 0.00 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.55 2uxr h GLN 79 CO 0.00 0.60 0.26 -0.44 -0.67 0.00 0.00 178.83 178.58 2uxr h ASP 80 N 0.93 0.71 -0.48 1.46 3.32 -2.00 -2.60 116.42 117.76 2uxr h ASP 80 Ca 0.35 -0.13 -0.13 0.00 0.02 0.00 0.00 57.03 57.14 2uxr h ASP 80 Cb 0.18 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2uxr h ASP 80 CO -0.12 0.63 -0.21 0.03 -1.72 0.00 0.00 179.24 177.85 2uxr h ARG 81 N 0.73 1.00 -0.79 3.56 2.47 -1.69 0.45 114.38 120.11 2uxr h ARG 81 Ca 0.19 -0.42 0.07 0.00 -1.26 0.00 0.00 59.98 58.55 2uxr h ARG 81 Cb 0.11 -0.04 -0.06 0.00 -1.65 0.00 0.00 29.97 28.33 2uxr h ARG 81 CO -0.02 1.10 0.46 0.28 0.56 0.00 0.00 179.97 182.35 2uxr h VAL 82 N 0.86 0.98 0.11 2.04 2.07 -1.24 -0.51 116.25 120.56 2uxr h VAL 82 Ca 0.11 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.34 2uxr h VAL 82 Cb 0.79 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2uxr h VAL 82 CO 0.07 0.15 -0.05 -0.08 0.02 0.00 0.00 177.57 177.68 2uxr h GLU 83 N 0.83 -0.14 -0.91 1.57 4.81 -1.31 -1.02 114.58 118.41 2uxr h GLU 83 Ca 0.36 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.74 2uxr h GLU 83 Cb 0.23 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.55 2uxr h GLU 83 CO -0.20 0.18 0.52 1.49 -0.73 0.00 0.00 179.01 180.28 2uxr h GLU 84 N -0.48 0.74 0.00 1.92 4.81 -0.43 -3.19 114.58 117.95 2uxr h GLU 84 Ca -0.02 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2uxr h GLU 84 Cb 0.39 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.60 2uxr h GLU 84 CO 0.02 0.49 -0.96 0.66 -0.73 0.00 0.00 179.01 178.50 2uxr n TYR 85 N -4.77 0.00 -2.08 0.92 4.02 -0.24 -4.99 117.16 110.01 2uxr n TYR 85 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.07 2uxr n TYR 85 Cb 0.42 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 39.70 2uxr n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2uxr n GLY 86 N 1.43 0.76 3.81 2.72 0.00 -0.48 -5.02 105.19 108.41 2uxr n GLY 86 Ca 0.03 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 2uxr n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2uxr s LEU 87 N -0.50 3.26 0.25 0.99 1.43 -0.65 -4.94 118.68 118.53 2uxr s LEU 87 Ca 0.00 1.70 0.11 0.00 -1.03 0.00 0.00 54.13 54.91 2uxr s LEU 87 Cb 0.00 -4.51 0.25 0.00 0.03 0.00 0.00 46.19 41.96 2uxr s LEU 87 CO 0.00 -1.36 1.54 0.11 0.23 0.00 0.00 176.35 176.87 2uxr h LYS 88 N -0.31 0.00 -2.22 1.70 1.57 -1.91 -3.48 116.57 111.92 2uxr h LYS 88 Ca -0.45 0.00 0.24 0.00 -1.87 0.00 0.00 60.65 58.57 2uxr h LYS 88 Cb 1.21 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.46 2uxr h LYS 88 CO 0.57 0.66 0.71 -1.83 -0.57 0.00 0.00 179.45 178.99 2uxr s GLU 89 N -3.35 0.88 -0.99 3.15 -1.05 -1.26 -5.07 118.70 111.02 2uxr s GLU 89 Ca -0.00 -0.55 -0.18 0.00 -0.15 0.00 0.00 54.97 54.09 2uxr s GLU 89 Cb 0.11 0.26 0.14 0.00 -0.44 0.00 0.00 34.13 34.20 2uxr s GLU 89 CO 0.76 -0.41 1.20 -0.65 0.95 0.00 0.00 175.26 177.11 2uxr s GLN 90 N -2.29 3.70 0.67 -4.83 -0.21 -1.26 -4.86 119.66 110.57 2uxr s GLN 90 Ca 0.22 -1.90 -0.17 0.00 0.02 0.00 0.00 55.36 53.52 2uxr s GLN 90 Cb -0.01 -4.96 -0.01 0.00 1.00 0.00 0.00 33.01 29.04 2uxr s GLN 90 CO 0.02 -1.79 1.14 0.91 -2.12 0.00 0.00 175.29 173.45 2uxr n TRP 91 N 6.45 1.32 -2.33 0.91 7.02 -1.26 -4.95 117.44 124.60 2uxr n TRP 91 Ca 0.27 0.42 -0.33 0.00 -1.02 0.00 0.00 57.50 56.83 2uxr n TRP 91 Cb 0.48 -2.18 -0.02 0.00 -2.42 0.00 0.00 31.31 27.17 2uxr n TRP 91 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2uxr s LYS 92 N -3.30 3.60 -0.36 -0.99 1.02 -1.26 -4.21 119.74 114.23 2uxr s LYS 92 Ca 0.78 1.30 -0.42 0.00 0.02 0.00 0.00 55.97 57.66 2uxr s LYS 92 Cb -0.37 -2.07 -0.16 0.00 -0.52 0.00 0.00 37.83 34.71 2uxr s LYS 92 CO 0.45 -0.59 1.81 0.45 -0.92 0.00 0.00 175.35 176.54 2uxr n SER 93 N -1.41 1.92 0.24 2.83 2.88 -1.26 -4.88 113.62 113.94 2uxr n SER 93 Ca 0.09 0.98 0.08 0.00 -1.33 0.00 0.00 58.87 58.70 2uxr n SER 93 Cb 0.53 -1.07 0.61 0.00 -0.75 0.00 0.00 64.21 63.52 2uxr n SER 93 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2uxr h PRO 94 N 7.51 0.00 0.00 -1.46 0.13 -1.92 -1.33 132.00 134.93 2uxr h PRO 94 Ca -0.40 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2uxr h PRO 94 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2uxr h PRO 94 CO 0.99 0.15 -0.00 -0.91 -0.23 0.00 0.00 178.00 178.00 2uxr h ASN 95 N 0.00 -0.00 -0.58 1.44 -0.26 -1.98 0.56 115.58 114.75 2uxr h ASN 95 Ca -0.00 -0.24 0.09 0.00 -0.56 0.00 0.00 56.30 55.58 2uxr h ASN 95 Cb 0.31 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 37.50 2uxr h ASN 95 CO 0.02 0.24 0.21 0.00 -1.06 0.00 0.00 177.43 176.84 2uxr h ALA 96 N 0.75 0.73 0.34 -0.83 0.00 -1.78 -0.08 119.26 118.38 2uxr h ALA 96 Ca -0.00 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2uxr h ALA 96 Cb 0.25 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2uxr h ALA 96 CO 0.00 -0.20 -0.16 1.15 0.00 0.00 0.00 179.25 180.04 2uxr h THR 97 N 0.39 0.68 -0.58 0.00 2.02 -1.17 -1.24 112.91 113.01 2uxr h THR 97 Ca 0.29 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 67.36 2uxr h THR 97 Cb 0.35 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.48 2uxr h THR 97 CO -0.29 0.03 0.32 0.58 0.37 0.00 0.00 175.52 176.53 2uxr h VAL 98 N -0.54 0.99 -0.04 3.16 2.07 -0.77 -2.75 116.25 118.38 2uxr h VAL 98 Ca -0.05 -0.21 -0.12 0.00 0.82 0.00 0.00 66.70 67.15 2uxr h VAL 98 Cb 0.40 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2uxr h VAL 98 CO 0.08 0.11 -0.51 0.03 0.02 0.00 0.00 177.57 177.30 2uxr h ARG 99 N 0.62 0.10 -0.32 1.57 3.08 -0.95 -1.99 114.38 116.48 2uxr h ARG 99 Ca 0.25 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.15 2uxr h ARG 99 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2uxr h ARG 99 CO -0.15 0.59 -0.19 0.00 -1.07 0.00 0.00 179.97 179.15 2uxr h ALA 100 N 1.40 1.08 0.00 0.04 0.00 -1.12 0.23 119.26 120.89 2uxr h ALA 100 Ca 0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 2uxr h ALA 100 Cb 0.93 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2uxr h ALA 100 CO 0.07 0.56 -0.25 0.52 0.00 0.00 0.00 179.25 180.15 2uxr h MET 101 N 0.53 0.00 0.01 0.00 2.86 -1.13 -3.33 114.93 113.87 2uxr h MET 101 Ca 0.08 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.35 2uxr h MET 101 Cb 0.62 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.21 2uxr h MET 101 CO 0.04 0.25 -2.40 1.28 1.06 0.00 0.00 176.91 177.15 2uxr n LEU 102 N -3.18 2.03 -1.22 1.22 4.77 -0.80 -5.08 117.00 114.74 2uxr n LEU 102 Ca 0.03 -0.06 0.15 0.00 -0.03 0.00 0.00 56.01 56.10 2uxr n LEU 102 Cb 0.61 -0.49 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 2uxr n LEU 102 CO 0.37 0.79 -0.44 -0.67 -1.33 0.00 0.00 177.39 176.11 2uxr n ASP 103 N -3.12 -7.10 0.00 -1.43 -0.08 0.78 -4.58 116.55 101.02 2uxr n ASP 103 Ca -0.40 1.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.87 2uxr n ASP 103 Cb 1.04 -4.04 0.00 0.00 2.34 0.00 0.00 41.12 40.47 2uxr n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2uxr n GLY 104 N -4.02 0.82 2.96 0.27 0.00 -1.26 -4.03 105.19 99.94 2uxr n GLY 104 Ca -0.05 -1.96 -0.19 0.00 0.00 0.00 0.00 46.02 43.82 2uxr n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2uxr s THR 105 N -2.25 0.64 -0.38 2.61 2.01 -0.41 -1.46 115.64 116.41 2uxr s THR 105 Ca 0.00 -0.26 -0.20 0.00 0.31 0.00 0.00 61.69 61.54 2uxr s THR 105 Cb 0.00 -0.59 0.01 0.00 0.01 0.00 0.00 72.50 71.92 2uxr s THR 105 CO 0.00 0.22 0.59 -0.69 -0.69 0.00 0.00 174.62 174.05 2uxr s VAL 106 N 0.35 4.92 -0.28 3.82 1.01 0.11 -0.43 120.40 129.90 2uxr s VAL 106 Ca -0.05 0.32 -0.20 0.00 0.00 0.00 0.00 61.98 62.06 2uxr s VAL 106 Cb -0.09 -4.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 2uxr s VAL 106 CO 0.00 -0.37 0.61 -0.36 0.00 0.00 0.00 175.10 174.98 2uxr s PHE 107 N 2.62 3.24 -0.18 5.22 0.08 -0.01 -0.85 117.98 128.11 2uxr s PHE 107 Ca 0.21 0.66 0.01 0.00 0.12 0.00 0.00 56.93 57.93 2uxr s PHE 107 Cb -0.15 -2.90 0.02 0.00 -0.57 0.00 0.00 43.02 39.43 2uxr s PHE 107 CO 0.16 -0.40 -0.19 1.03 -0.10 0.00 0.00 175.22 175.72 2uxr s ARG 108 N 2.52 2.91 -0.03 0.44 0.52 -0.16 -1.95 118.95 123.20 2uxr s ARG 108 Ca 0.25 -0.84 0.02 0.00 -0.52 0.00 0.00 55.73 54.63 2uxr s ARG 108 Cb -0.15 -2.56 0.01 0.00 0.52 0.00 0.00 34.95 32.77 2uxr s ARG 108 CO 0.10 -0.23 -0.06 0.21 0.02 0.00 0.00 175.30 175.34 2uxr s LYS 109 N 1.29 0.74 0.51 3.54 2.20 -0.77 -0.43 119.74 126.82 2uxr s LYS 109 Ca 0.04 -0.17 -0.22 0.00 -0.36 0.00 0.00 55.97 55.26 2uxr s LYS 109 Cb -0.13 -0.73 -0.06 0.00 -1.51 0.00 0.00 37.83 35.40 2uxr s LYS 109 CO -0.12 0.02 1.28 -1.25 -0.36 0.00 0.00 175.35 174.91 2uxr s PRO 110 N 0.47 3.38 -0.50 4.03 0.04 -1.26 0.03 135.00 141.19 2uxr s PRO 110 Ca -0.06 2.04 -0.19 0.00 0.04 0.00 0.00 61.00 62.84 2uxr s PRO 110 Cb -0.10 -2.31 0.06 0.00 0.04 0.00 0.00 34.50 32.19 2uxr s PRO 110 CO 0.00 -0.94 0.59 0.42 0.04 0.00 0.00 177.00 177.11 2uxr s ILE 111 N -1.40 4.93 0.01 0.56 1.01 0.11 -4.77 121.20 121.65 2uxr s ILE 111 Ca 0.69 -0.56 -0.19 0.00 0.00 0.00 0.00 60.65 60.59 2uxr s ILE 111 Cb -0.36 -4.26 -0.06 0.00 0.01 0.00 0.00 42.46 37.79 2uxr s ILE 111 CO 0.42 -0.76 0.54 -0.04 0.00 0.00 0.00 174.94 175.10 2uxr s MET 112 N 2.48 4.20 0.13 2.79 -1.94 -1.26 -4.81 119.30 120.88 2uxr s MET 112 Ca 0.14 0.64 0.09 0.00 -1.71 0.00 0.00 55.69 54.85 2uxr s MET 112 Cb -0.20 -3.29 -0.04 0.00 2.01 0.00 0.00 34.83 33.31 2uxr s MET 112 CO 0.11 0.50 -0.22 0.14 -0.01 0.00 0.00 175.02 175.55 2uxr s VAL 113 N -0.60 1.87 -0.48 -6.03 -7.23 -1.26 -5.03 120.40 101.64 2uxr s VAL 113 Ca 0.28 -1.69 0.25 0.00 -1.81 0.00 0.00 61.98 59.01 2uxr s VAL 113 Cb -0.18 -1.73 0.27 0.00 0.56 0.00 0.00 36.38 35.30 2uxr s VAL 113 CO 0.16 -0.09 1.75 0.11 -0.31 0.00 0.00 175.10 176.72 2uxr h LYS 114 N 3.81 0.00 -0.50 4.82 1.79 -1.96 -3.21 116.57 121.32 2uxr h LYS 114 Ca -0.46 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 2uxr h LYS 114 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2uxr h LYS 114 CO 0.42 0.00 0.00 0.27 -1.08 0.00 0.00 179.45 179.06 2uxr n ASN 115 N -2.35 4.31 -3.83 0.86 6.94 -1.26 -4.83 115.26 115.11 2uxr n ASN 115 Ca 0.03 -2.54 -0.23 0.00 -0.02 0.00 0.00 54.58 51.81 2uxr n ASN 115 Cb 0.29 -0.52 -0.17 0.00 -2.36 0.00 0.00 39.78 37.02 2uxr n ASN 115 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2uxr s ILE 116 N -2.00 0.56 0.11 1.53 1.01 -1.21 -0.48 121.20 120.71 2uxr s ILE 116 Ca 0.44 -0.03 -0.04 0.00 0.00 0.00 0.00 60.65 61.03 2uxr s ILE 116 Cb 0.30 -0.66 -0.05 0.00 0.01 0.00 0.00 42.46 42.06 2uxr s ILE 116 CO 0.19 0.28 0.32 -1.59 0.00 0.00 0.00 174.94 174.13 2uxr s LYS 117 N 1.67 3.57 0.48 2.79 0.00 -1.26 -4.76 119.74 122.23 2uxr s LYS 117 Ca 0.01 -0.18 -0.23 0.00 0.00 0.00 0.00 55.97 55.57 2uxr s LYS 117 Cb -0.13 -2.93 -0.07 0.00 0.00 0.00 0.00 37.83 34.71 2uxr s LYS 117 CO -0.05 0.53 1.27 -2.14 0.00 0.00 0.00 175.35 174.96 2uxr s PRO 118 N -2.51 3.57 0.54 1.78 0.02 -1.26 -4.79 135.00 132.35 2uxr s PRO 118 Ca 0.38 2.04 0.26 0.00 0.02 0.00 0.00 61.00 63.70 2uxr s PRO 118 Cb -0.12 -2.43 1.43 0.00 0.02 0.00 0.00 34.50 33.39 2uxr s PRO 118 CO 0.25 -0.78 1.98 0.77 -0.33 0.00 0.00 177.00 178.89 2uxr h SER 119 N 1.97 0.00 -3.76 2.53 0.02 0.39 -3.40 113.55 111.30 2uxr h SER 119 Ca -0.50 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 59.79 2uxr h SER 119 Cb 1.27 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 63.63 2uxr h SER 119 CO 0.60 0.00 -0.45 -0.69 -1.14 0.00 0.00 176.83 175.15 2uxr s VAL 120 N -4.96 5.27 0.23 2.27 1.01 -1.26 -5.00 120.40 117.96 2uxr s VAL 120 Ca -0.05 -0.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 2uxr s VAL 120 Cb 0.19 -3.68 0.28 0.00 0.00 0.00 0.00 36.38 33.17 2uxr s VAL 120 CO 0.71 0.06 1.62 0.03 0.00 0.00 0.00 175.10 177.52 2uxr h ARG 121 N 8.43 0.01 0.00 2.72 3.08 -1.88 -1.85 114.38 124.89 2uxr h ARG 121 Ca -0.32 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.73 2uxr h ARG 121 Cb 1.17 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 2uxr h ARG 121 CO 0.62 0.01 0.00 0.66 -1.07 0.00 0.00 179.97 180.19 2uxr h SER 122 N 0.01 0.00 -3.12 7.04 4.64 -1.85 -3.45 113.55 116.82 2uxr h SER 122 Ca 0.34 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.10 2uxr h SER 122 Cb 0.53 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.58 2uxr h SER 122 CO -0.71 0.00 1.01 0.26 -0.87 0.00 0.00 176.83 176.51 2uxr s TRP 123 N -3.24 2.57 -0.10 4.77 0.52 -0.70 -3.89 118.94 118.87 2uxr s TRP 123 Ca 0.07 0.80 0.03 0.00 0.02 0.00 0.00 56.10 57.01 2uxr s TRP 123 Cb 0.10 -3.99 -0.08 0.00 -1.15 0.00 0.00 33.47 28.36 2uxr s TRP 123 CO 0.49 -1.91 -0.06 1.04 0.02 0.00 0.00 176.95 176.53 2uxr n GLN 124 N 7.49 0.94 -4.08 4.98 6.02 0.33 -4.72 117.38 128.33 2uxr n GLN 124 Ca 0.16 0.04 -0.29 0.00 -0.01 0.00 0.00 57.00 56.90 2uxr n GLN 124 Cb 0.47 -1.22 -0.07 0.00 1.02 0.00 0.00 30.24 30.44 2uxr n GLN 124 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2uxr s LYS 125 N -2.21 2.80 0.46 -1.09 1.02 -0.26 -5.02 119.74 115.43 2uxr s LYS 125 Ca -0.12 -0.78 -0.25 0.00 0.02 0.00 0.00 55.97 54.85 2uxr s LYS 125 Cb 0.03 -2.66 -0.08 0.00 -0.52 0.00 0.00 37.83 34.61 2uxr s LYS 125 CO 0.28 0.54 1.42 -1.25 -0.92 0.00 0.00 175.35 175.42 2uxr s PRO 126 N -2.56 3.65 -0.19 -1.68 0.04 -1.26 -3.39 135.00 129.61 2uxr s PRO 126 Ca 0.29 2.41 -0.04 0.00 0.04 0.00 0.00 61.00 63.70 2uxr s PRO 126 Cb -0.11 -2.63 -0.02 0.00 0.04 0.00 0.00 34.50 31.78 2uxr s PRO 126 CO 0.21 -0.84 -0.03 0.42 0.04 0.00 0.00 177.00 176.80 2uxr s ILE 127 N -1.21 3.68 -0.20 0.56 1.01 -1.26 -1.03 121.20 122.75 2uxr s ILE 127 Ca 0.62 -0.41 -0.09 0.00 0.00 0.00 0.00 60.65 60.77 2uxr s ILE 127 Cb -0.44 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 2uxr s ILE 127 CO 0.56 0.44 0.10 -0.69 0.00 0.00 0.00 174.94 175.35 2uxr s VAL 128 N 1.00 5.02 -0.21 2.92 1.01 -0.73 -4.34 120.40 125.07 2uxr s VAL 128 Ca 0.01 0.05 -0.13 0.00 0.00 0.00 0.00 61.98 61.92 2uxr s VAL 128 Cb -0.15 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 2uxr s VAL 128 CO 0.01 0.43 0.25 -0.69 0.00 0.00 0.00 175.10 175.10 2uxr s VAL 129 N 0.55 5.31 -0.50 2.92 1.01 0.43 0.90 120.40 131.02 2uxr s VAL 129 Ca 0.05 0.40 -0.08 0.00 0.00 0.00 0.00 61.98 62.35 2uxr s VAL 129 Cb -0.12 -3.59 0.13 0.00 0.00 0.00 0.00 36.38 32.80 2uxr s VAL 129 CO 0.01 0.33 0.36 -0.83 0.00 0.00 0.00 175.10 174.97 2uxr s GLY 130 N 0.88 2.12 -0.26 4.51 0.00 0.80 -0.99 107.32 114.38 2uxr s GLY 130 Ca 0.12 -2.67 -0.14 0.00 0.00 0.00 0.00 44.72 42.03 2uxr s GLY 130 CO 0.05 1.10 0.34 -1.60 0.00 0.00 0.00 173.10 172.99 2uxr s ARG 131 N 1.09 4.02 0.08 2.90 3.52 -0.03 0.07 118.95 130.61 2uxr s ARG 131 Ca 0.08 -0.01 -0.31 0.00 -0.13 0.00 0.00 55.73 55.36 2uxr s ARG 131 Cb -0.24 -3.64 -0.10 0.00 -1.56 0.00 0.00 34.95 29.41 2uxr s ARG 131 CO -0.02 -0.22 1.91 1.58 -0.81 0.00 0.00 175.30 177.73 2uxr n HIS 132 N 5.16 2.58 1.28 5.12 -0.00 0.01 0.10 115.22 129.46 2uxr n HIS 132 Ca -0.10 -0.27 0.13 0.00 -0.00 0.00 0.00 57.72 57.49 2uxr n HIS 132 Cb 0.51 -2.77 0.39 0.00 -0.00 0.00 0.00 29.99 28.12 2uxr n HIS 132 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2uxr n ALA 133 N 6.55 3.01 -3.00 1.57 0.00 -0.53 -3.15 120.51 124.97 2uxr n ALA 133 Ca 0.19 -0.41 -0.33 0.00 0.00 0.00 0.00 53.44 52.89 2uxr n ALA 133 Cb 0.39 -1.13 -0.15 0.00 0.00 0.00 0.00 19.45 18.56 2uxr n ALA 133 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2uxr s TYR 134 N -2.43 2.76 0.00 0.00 5.04 -1.26 -4.51 117.35 116.95 2uxr s TYR 134 Ca 0.26 -0.62 0.00 0.00 -2.44 0.00 0.00 57.07 54.27 2uxr s TYR 134 Cb 0.19 -1.79 0.00 0.00 0.35 0.00 0.00 41.96 40.71 2uxr s TYR 134 CO 0.49 -0.18 0.00 0.41 -1.34 0.00 0.00 175.55 174.94 2uxr n GLY 135 N 3.33 -0.38 7.00 8.97 0.00 -1.26 -4.81 105.19 118.05 2uxr n GLY 135 Ca -0.18 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.73 2uxr n GLY 135 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2uxr n ASP 136 N 1.12 0.00 0.00 1.61 8.00 -0.32 -3.03 116.55 123.94 2uxr n ASP 136 Ca 0.00 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.61 2uxr n ASP 136 Cb 0.00 0.00 0.58 0.00 -0.02 0.00 0.00 41.12 41.68 2uxr n ASP 136 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2uxr n PHE 137 N 13.01 0.00 1.53 1.24 -0.00 -1.26 -1.80 117.46 130.17 2uxr n PHE 137 Ca 0.00 0.00 0.09 0.00 -0.00 0.00 0.00 57.45 57.54 2uxr n PHE 137 Cb 0.00 -0.23 0.51 0.00 -0.00 0.00 0.00 39.48 39.76 2uxr n PHE 137 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 2uxr n TYR 138 N -1.23 0.00 -3.20 2.97 4.01 -1.17 -3.26 117.16 115.28 2uxr n TYR 138 Ca 0.12 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.63 2uxr n TYR 138 Cb 0.16 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.12 2uxr n TYR 138 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2uxr n LYS 139 N -0.85 0.88 -3.09 -0.72 4.76 -0.75 -4.86 118.16 113.54 2uxr n LYS 139 Ca 0.13 -3.34 -0.29 0.00 -2.87 0.00 0.00 58.31 51.94 2uxr n LYS 139 Cb 0.06 -1.37 -0.03 0.00 -1.84 0.00 0.00 35.03 31.85 2uxr n LYS 139 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2uxr s ASN 140 N -1.52 6.43 -0.08 4.39 2.20 -1.20 -4.55 114.94 120.61 2uxr s ASN 140 Ca 0.36 0.85 0.03 0.00 -0.94 0.00 0.00 52.86 53.17 2uxr s ASN 140 Cb 0.21 -2.21 -0.02 0.00 -2.00 0.00 0.00 41.25 37.23 2uxr s ASN 140 CO -0.10 -0.32 -0.17 0.00 -2.94 0.00 0.00 177.10 173.57 2uxr s ALA 141 N -2.29 2.50 0.02 3.54 0.00 -0.92 -4.99 121.76 119.63 2uxr s ALA 141 Ca 0.46 -0.97 -0.00 0.00 0.00 0.00 0.00 51.96 51.45 2uxr s ALA 141 Cb -0.10 -0.95 -0.02 0.00 0.00 0.00 0.00 23.12 22.04 2uxr s ALA 141 CO 0.33 0.42 -0.03 -1.21 0.00 0.00 0.00 175.76 175.27 2uxr s GLU 142 N -0.24 0.33 -0.03 0.00 2.02 -1.26 -0.92 118.70 118.61 2uxr s GLU 142 Ca 0.00 -0.65 0.00 0.00 0.02 0.00 0.00 54.97 54.34 2uxr s GLU 142 Cb -0.13 0.12 0.03 0.00 0.10 0.00 0.00 34.13 34.24 2uxr s GLU 142 CO 0.03 -0.05 0.00 0.42 0.02 0.00 0.00 175.26 175.68 2uxr s ILE 143 N -1.64 0.18 -0.62 -1.63 1.01 -0.57 -5.00 121.20 112.93 2uxr s ILE 143 Ca -0.14 0.10 -0.23 0.00 0.00 0.00 0.00 60.65 60.38 2uxr s ILE 143 Cb -0.09 -0.29 0.06 0.00 0.01 0.00 0.00 42.46 42.15 2uxr s ILE 143 CO -0.02 0.16 0.97 0.12 0.00 0.00 0.00 174.94 176.17 2uxr s PHE 144 N 1.15 2.70 -1.11 3.97 5.36 -1.26 -1.22 117.98 127.56 2uxr s PHE 144 Ca -0.08 -0.34 -0.17 0.00 -0.96 0.00 0.00 56.93 55.38 2uxr s PHE 144 Cb -0.13 -4.22 0.12 0.00 -0.34 0.00 0.00 43.02 38.45 2uxr s PHE 144 CO -0.02 -1.56 1.40 0.00 -1.46 0.00 0.00 175.22 173.58 2uxr s ALA 145 N 4.09 3.52 -1.53 11.12 0.00 0.40 -4.85 121.76 134.50 2uxr s ALA 145 Ca 0.25 -2.96 0.10 0.00 0.00 0.00 0.00 51.96 49.36 2uxr s ALA 145 Cb -0.15 -4.25 0.52 0.00 0.00 0.00 0.00 23.12 19.24 2uxr s ALA 145 CO 0.14 -3.04 1.18 0.39 0.00 0.00 0.00 175.76 174.42 2uxr n GLU 146 N 6.84 0.17 -0.22 0.00 1.02 -1.26 -1.25 120.64 125.93 2uxr n GLU 146 Ca 0.34 0.16 0.02 0.00 -0.02 0.00 0.00 57.16 57.67 2uxr n GLU 146 Cb 0.46 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.41 2uxr n GLU 146 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2uxr n ALA 147 N -1.24 1.82 -0.75 0.62 0.00 -1.26 -4.36 120.51 115.35 2uxr n ALA 147 Ca 0.05 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.25 2uxr n ALA 147 Cb 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2uxr n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uxr n GLY 148 N -0.38 0.49 0.00 0.00 0.00 -0.80 -4.41 105.19 100.09 2uxr n GLY 148 Ca 0.04 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2uxr n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uxr n GLY 149 N 0.00 0.77 3.65 -0.02 0.00 -0.31 -4.94 105.19 104.35 2uxr n GLY 149 Ca 0.00 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.75 2uxr n GLY 149 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2uxr s LYS 150 N -1.77 4.19 -0.24 1.61 2.20 -1.26 -1.03 119.74 123.44 2uxr s LYS 150 Ca 0.00 0.67 -0.05 0.00 -0.36 0.00 0.00 55.97 56.23 2uxr s LYS 150 Cb 0.00 -3.60 -0.01 0.00 -1.51 0.00 0.00 37.83 32.71 2uxr s LYS 150 CO 0.00 -0.32 0.00 -0.51 -0.36 0.00 0.00 175.35 174.17 2uxr s LEU 151 N 2.17 3.20 0.10 5.43 1.43 -0.15 -5.02 118.68 125.84 2uxr s LEU 151 Ca 0.30 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2uxr s LEU 151 Cb -0.16 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 2uxr s LEU 151 CO 0.10 -0.06 0.03 -1.83 0.23 0.00 0.00 176.35 174.82 2uxr s GLU 152 N 1.50 0.81 -0.09 1.70 -1.05 -1.26 0.76 118.70 121.07 2uxr s GLU 152 Ca 0.05 -1.33 -0.01 0.00 -0.15 0.00 0.00 54.97 53.52 2uxr s GLU 152 Cb -0.15 0.24 -0.03 0.00 -0.44 0.00 0.00 34.13 33.74 2uxr s GLU 152 CO -0.01 -0.21 -0.03 0.96 0.95 0.00 0.00 175.26 176.92 2uxr s ILE 153 N -3.99 4.02 -0.07 1.83 -4.36 -0.63 -4.92 121.20 113.09 2uxr s ILE 153 Ca 0.17 -0.35 0.01 0.00 -0.26 0.00 0.00 60.65 60.22 2uxr s ILE 153 Cb 0.07 -2.68 0.02 0.00 1.25 0.00 0.00 42.46 41.12 2uxr s ILE 153 CO -0.03 0.59 -0.08 -0.69 0.24 0.00 0.00 174.94 174.96 2uxr s VAL 154 N -0.67 0.88 -0.17 8.37 1.01 -1.26 -1.47 120.40 127.09 2uxr s VAL 154 Ca 0.10 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2uxr s VAL 154 Cb -0.12 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 2uxr s VAL 154 CO 0.02 0.31 -0.04 -0.69 0.00 0.00 0.00 175.10 174.70 2uxr s VAL 155 N 1.07 3.72 -0.23 2.92 1.01 0.23 -4.97 120.40 124.15 2uxr s VAL 155 Ca -0.08 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.51 2uxr s VAL 155 Cb -0.14 -2.64 0.05 0.00 0.00 0.00 0.00 36.38 33.64 2uxr s VAL 155 CO -0.01 0.47 -0.12 0.28 0.00 0.00 0.00 175.10 175.72 2uxr s THR 156 N 0.65 1.97 0.88 3.92 -1.32 -1.26 -1.20 115.64 119.27 2uxr s THR 156 Ca -0.03 -1.30 -0.15 0.00 -1.21 0.00 0.00 61.69 59.00 2uxr s THR 156 Cb -0.15 -2.01 0.22 0.00 -1.51 0.00 0.00 72.50 69.05 2uxr s THR 156 CO 0.02 0.14 0.83 -0.90 -2.21 0.00 0.00 174.62 172.50 2uxr n ASP 157 N 4.55 -1.54 0.23 8.08 5.68 -0.56 -4.84 116.55 128.15 2uxr n ASP 157 Ca -0.15 -1.05 0.15 0.00 -0.50 0.00 0.00 54.79 53.24 2uxr n ASP 157 Cb 0.45 -0.74 0.49 0.00 -1.14 0.00 0.00 41.12 40.18 2uxr n ASP 157 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2uxr h LYS 158 N 0.00 0.00 -0.00 0.11 1.57 -2.00 -1.48 116.57 114.77 2uxr h LYS 158 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2uxr h LYS 158 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.23 2uxr h LYS 158 CO 0.20 0.00 -0.24 0.09 -0.57 0.00 0.00 179.45 178.93 2uxr n ASN 159 N -2.95 0.56 0.00 0.86 3.02 -1.26 -4.96 115.26 110.53 2uxr n ASN 159 Ca 0.02 -0.43 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 2uxr n ASN 159 Cb 0.37 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.56 2uxr n ASN 159 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2uxr n GLY 160 N 1.38 0.56 3.64 7.41 0.00 -0.56 -5.05 105.19 112.57 2uxr n GLY 160 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2uxr n GLY 160 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2uxr s LYS 161 N -0.85 3.82 0.02 1.61 2.20 -1.26 -4.74 119.74 120.53 2uxr s LYS 161 Ca 0.00 2.23 -0.01 0.00 -0.36 0.00 0.00 55.97 57.83 2uxr s LYS 161 Cb 0.00 -4.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 2uxr s LYS 161 CO 0.00 -1.30 0.17 -1.83 -0.36 0.00 0.00 175.35 172.03 2uxr s GLU 162 N 4.93 3.34 -0.02 4.03 -1.05 -1.26 -1.50 118.70 127.18 2uxr s GLU 162 Ca 0.86 -0.41 0.04 0.00 -0.15 0.00 0.00 54.97 55.31 2uxr s GLU 162 Cb -0.36 -3.02 -0.01 0.00 -0.44 0.00 0.00 34.13 30.31 2uxr s GLU 162 CO 0.36 0.65 -0.12 0.99 0.95 0.00 0.00 175.26 178.08 2uxr s THR 163 N -1.36 0.99 0.01 1.83 2.01 -0.34 -4.99 115.64 113.79 2uxr s THR 163 Ca 0.29 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.79 2uxr s THR 163 Cb -0.13 -0.84 -0.01 0.00 0.01 0.00 0.00 72.50 71.53 2uxr s THR 163 CO 0.21 0.29 -0.04 -0.13 -0.69 0.00 0.00 174.62 174.25 2uxr s ARG 164 N -0.12 0.32 0.01 4.92 0.52 -1.26 -0.60 118.95 122.73 2uxr s ARG 164 Ca 0.02 -0.29 0.02 0.00 -0.52 0.00 0.00 55.73 54.95 2uxr s ARG 164 Cb -0.07 -0.22 -0.01 0.00 0.52 0.00 0.00 34.95 35.17 2uxr s ARG 164 CO 0.00 0.05 -0.06 -0.65 0.02 0.00 0.00 175.30 174.66 2uxr s GLN 165 N -0.51 0.46 -0.15 3.54 -1.52 -0.54 -5.01 119.66 115.93 2uxr s GLN 165 Ca -0.03 -0.33 -0.19 0.00 -1.95 0.00 0.00 55.36 52.86 2uxr s GLN 165 Cb -0.04 -0.40 -0.03 0.00 -0.22 0.00 0.00 33.01 32.32 2uxr s GLN 165 CO -0.00 0.10 0.55 0.99 -0.25 0.00 0.00 175.29 176.68 2uxr s THR 166 N -0.43 5.11 -0.09 -0.19 2.01 -1.26 -1.60 115.64 119.19 2uxr s THR 166 Ca -0.01 1.07 -0.20 0.00 0.31 0.00 0.00 61.69 62.86 2uxr s THR 166 Cb -0.04 -3.88 -0.17 0.00 0.01 0.00 0.00 72.50 68.43 2uxr s THR 166 CO -0.00 0.23 0.69 0.40 -0.69 0.00 0.00 174.62 175.25 2uxr h ILE 167 N 4.93 1.05 -2.22 1.82 2.04 -0.02 -3.49 117.51 121.63 2uxr h ILE 167 Ca -0.37 -1.54 0.10 0.00 1.00 0.00 0.00 64.86 64.05 2uxr h ILE 167 Cb 1.17 1.89 -0.16 0.00 -0.74 0.00 0.00 36.82 38.98 2uxr h ILE 167 CO 0.75 0.32 0.49 -0.32 0.00 0.00 0.00 178.15 179.40 2uxr s MET 168 N -2.67 0.81 -0.18 2.37 0.00 -1.20 -5.05 119.30 113.38 2uxr s MET 168 Ca -0.13 -0.25 0.01 0.00 0.00 0.00 0.00 55.69 55.32 2uxr s MET 168 Cb -0.01 0.37 0.02 0.00 0.00 0.00 0.00 34.83 35.22 2uxr s MET 168 CO 0.47 -0.34 -0.19 -2.00 0.00 0.00 0.00 175.02 172.95 2uxr s GLU 169 N -2.92 2.90 0.13 4.11 2.12 -1.26 -0.97 118.70 122.81 2uxr s GLU 169 Ca 0.04 -0.81 0.03 0.00 0.36 0.00 0.00 54.97 54.58 2uxr s GLU 169 Cb -0.01 -2.53 -0.04 0.00 0.26 0.00 0.00 34.13 31.81 2uxr s GLU 169 CO -0.08 -0.22 -0.07 0.14 -0.54 0.00 0.00 175.26 174.50 2uxr s VAL 170 N 1.31 0.86 -0.43 3.70 -7.23 -0.20 -4.98 120.40 113.43 2uxr s VAL 170 Ca 0.05 -1.99 0.07 0.00 -1.81 0.00 0.00 61.98 58.30 2uxr s VAL 170 Cb -0.13 -1.82 0.42 0.00 0.56 0.00 0.00 36.38 35.41 2uxr s VAL 170 CO -0.13 -0.76 1.07 -0.67 -0.31 0.00 0.00 175.10 174.31 2uxr n ASP 171 N -0.13 4.20 -3.59 4.85 2.03 -1.26 -1.16 116.55 121.49 2uxr n ASP 171 Ca -0.11 -3.57 -0.10 0.00 0.52 0.00 0.00 54.79 51.54 2uxr n ASP 171 Cb 0.61 -0.48 -0.02 0.00 -0.72 0.00 0.00 41.12 40.51 2uxr n ASP 171 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 2uxr s GLU 172 N -3.47 1.42 0.18 -0.67 -1.05 -1.26 -4.91 118.70 108.95 2uxr s GLU 172 Ca 0.45 -0.64 -0.33 0.00 -0.15 0.00 0.00 54.97 54.29 2uxr s GLU 172 Cb 0.40 0.58 -0.14 0.00 -0.44 0.00 0.00 34.13 34.53 2uxr s GLU 172 CO -0.15 -0.64 1.49 -2.30 0.95 0.00 0.00 175.26 174.61 2uxr n PRO 173 N -0.40 1.99 -4.13 -4.83 -0.02 -1.26 -2.61 135.00 123.73 2uxr n PRO 173 Ca -0.12 0.71 -0.10 0.00 -2.02 0.00 0.00 63.50 61.98 2uxr n PRO 173 Cb 0.63 -2.43 -0.10 0.00 -0.02 0.00 0.00 33.50 31.58 2uxr n PRO 173 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2uxr s ALA 174 N 0.55 0.77 0.06 3.55 0.00 -0.38 -4.90 121.76 121.41 2uxr s ALA 174 Ca 0.76 -1.41 0.08 0.00 0.00 0.00 0.00 51.96 51.39 2uxr s ALA 174 Cb -0.70 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 2uxr s ALA 174 CO 0.43 -0.51 -0.22 0.96 0.00 0.00 0.00 175.76 176.42 2uxr s ILE 175 N -4.04 2.50 -0.02 0.00 -4.36 -1.26 -0.46 121.20 113.56 2uxr s ILE 175 Ca 0.24 -1.34 0.03 0.00 -0.26 0.00 0.00 60.65 59.32 2uxr s ILE 175 Cb 0.07 -2.03 -0.00 0.00 1.25 0.00 0.00 42.46 41.74 2uxr s ILE 175 CO 0.02 0.31 -0.12 -0.69 0.24 0.00 0.00 174.94 174.70 2uxr s VAL 176 N -0.91 0.96 0.00 8.37 1.01 -0.36 -4.94 120.40 124.54 2uxr s VAL 176 Ca 0.14 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.66 2uxr s VAL 176 Cb -0.10 -0.83 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 2uxr s VAL 176 CO 0.04 0.28 -0.10 -1.58 0.00 0.00 0.00 175.10 173.75 2uxr s GLN 177 N -0.05 0.76 0.02 2.72 0.74 -1.26 -1.51 119.66 121.08 2uxr s GLN 177 Ca 0.00 -0.42 0.04 0.00 0.05 0.00 0.00 55.36 55.04 2uxr s GLN 177 Cb -0.07 -0.73 -0.02 0.00 1.10 0.00 0.00 33.01 33.30 2uxr s GLN 177 CO 0.00 0.19 -0.14 0.20 -0.55 0.00 0.00 175.29 175.00 2uxr s GLY 178 N -0.44 0.72 0.25 2.59 0.00 -0.09 -5.00 107.32 105.36 2uxr s GLY 178 Ca 0.02 -0.72 0.04 0.00 0.00 0.00 0.00 44.72 44.06 2uxr s GLY 178 CO -0.00 -0.66 0.01 -0.26 0.00 0.00 0.00 173.10 172.19 2uxr s ILE 179 N -0.63 1.06 0.14 0.90 -4.36 -1.26 -2.17 121.20 114.88 2uxr s ILE 179 Ca 0.03 -2.03 -0.02 0.00 -0.26 0.00 0.00 60.65 58.36 2uxr s ILE 179 Cb -0.07 -2.46 -0.03 0.00 1.25 0.00 0.00 42.46 41.15 2uxr s ILE 179 CO 0.01 -0.23 0.10 -1.38 0.24 0.00 0.00 174.94 173.68 2uxr s HIS 180 N -3.40 0.80 0.27 1.37 -3.43 -1.26 -4.99 115.29 104.65 2uxr s HIS 180 Ca 0.31 -1.16 -0.06 0.00 -0.80 0.00 0.00 55.06 53.34 2uxr s HIS 180 Cb 0.06 -0.41 -0.01 0.00 -1.43 0.00 0.00 32.58 30.79 2uxr s HIS 180 CO 0.11 -0.57 0.39 1.21 -2.00 0.00 0.00 174.74 173.88 2uxr s ASN 181 N -3.04 0.32 0.10 7.38 3.84 -1.26 -1.17 114.94 121.11 2uxr s ASN 181 Ca 0.24 -1.23 0.09 0.00 0.21 0.00 0.00 52.86 52.17 2uxr s ASN 181 Cb 0.07 0.56 -0.04 0.00 -0.55 0.00 0.00 41.25 41.29 2uxr s ASN 181 CO 0.02 -1.12 -0.19 0.42 -2.79 0.00 0.00 177.10 173.44 2uxr s THR 182 N -3.73 2.76 0.26 -5.21 -4.23 -1.26 -5.02 115.64 99.21 2uxr s THR 182 Ca 0.29 -1.44 -0.02 0.00 -1.18 0.00 0.00 61.69 59.34 2uxr s THR 182 Cb 0.01 -2.23 0.23 0.00 1.34 0.00 0.00 72.50 71.85 2uxr s THR 182 CO 0.14 0.16 1.77 0.58 -0.54 0.00 0.00 174.62 176.73 2uxr h VAL 183 N 3.69 0.75 -0.34 2.29 2.07 -2.01 -2.42 116.25 120.28 2uxr h VAL 183 Ca -0.49 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 2uxr h VAL 183 Cb 1.16 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 2uxr h VAL 183 CO 0.46 0.11 0.06 0.00 0.02 0.00 0.00 177.57 178.22 2uxr h ALA 184 N 1.54 0.45 -0.58 1.67 0.00 -1.99 -2.00 119.26 118.35 2uxr h ALA 184 Ca 0.45 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2uxr h ALA 184 Cb 0.61 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2uxr h ALA 184 CO -0.35 0.15 0.25 1.03 0.00 0.00 0.00 179.25 180.34 2uxr h SER 185 N 0.40 0.78 -0.61 0.00 0.87 -1.95 -1.13 113.55 111.90 2uxr h SER 185 Ca 0.10 -0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.49 2uxr h SER 185 Cb 0.34 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 2uxr h SER 185 CO 0.01 0.71 0.31 0.40 -0.53 0.00 0.00 176.83 177.73 2uxr h ILE 186 N 0.79 1.21 -0.30 2.23 2.04 -1.31 -0.48 117.51 121.68 2uxr h ILE 186 Ca 0.20 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2uxr h ILE 186 Cb 0.16 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2uxr h ILE 186 CO -0.02 0.24 0.13 1.23 0.00 0.00 0.00 178.15 179.73 2uxr h GLY 187 N 0.98 0.47 1.01 5.37 0.00 -0.99 -0.48 103.07 109.43 2uxr h GLY 187 Ca 0.22 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2uxr h GLY 187 CO -0.03 0.23 0.51 0.45 0.00 0.00 0.00 176.54 177.71 2uxr h HIS 188 N 0.34 1.05 -0.11 5.60 3.86 -0.91 -2.13 115.15 122.85 2uxr h HIS 188 Ca 0.10 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.33 2uxr h HIS 188 Cb 0.15 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 2uxr h HIS 188 CO -0.01 0.69 0.03 0.35 0.86 0.00 0.00 177.93 179.85 2uxr h PHE 189 N 1.11 0.06 0.35 2.45 3.57 -0.88 -0.18 116.94 123.42 2uxr h PHE 189 Ca 0.29 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.78 2uxr h PHE 189 Cb -0.08 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.65 2uxr h PHE 189 CO -0.01 0.03 -0.17 0.00 -2.23 0.00 0.00 178.31 175.93 2uxr h ALA 190 N 1.07 -0.47 -0.72 2.41 0.00 -0.99 -2.04 119.26 118.51 2uxr h ALA 190 Ca 0.05 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 54.97 2uxr h ALA 190 Cb 0.03 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.91 2uxr h ALA 190 CO -0.05 -0.74 0.27 0.00 0.00 0.00 0.00 179.25 178.73 2uxr h ARG 191 N -0.52 0.41 -0.70 0.00 3.08 -1.41 0.47 114.38 115.71 2uxr h ARG 191 Ca -0.05 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2uxr h ARG 191 Cb 0.39 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 2uxr h ARG 191 CO 0.08 0.27 0.41 0.00 -1.07 0.00 0.00 179.97 179.66 2uxr h ALA 192 N 1.53 1.41 0.00 0.04 0.00 -0.79 0.20 119.26 121.65 2uxr h ALA 192 Ca 0.39 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 2uxr h ALA 192 Cb 0.58 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2uxr h ALA 192 CO -0.39 0.50 -0.00 0.00 0.00 0.00 0.00 179.25 179.36 2uxr h PHE 194 N -0.50 0.89 -0.32 0.00 0.04 -0.72 -0.62 116.94 115.71 2uxr h PHE 194 Ca -0.00 -0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.69 2uxr h PHE 194 Cb 0.50 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.35 2uxr h PHE 194 CO 0.10 0.64 0.00 0.93 -0.60 0.00 0.00 178.31 179.39 2uxr h GLU 195 N 0.90 0.56 -0.54 1.51 4.39 -0.62 -2.71 114.58 118.07 2uxr h GLU 195 Ca 0.22 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 2uxr h GLU 195 Cb 0.08 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 2uxr h GLU 195 CO -0.03 0.69 0.28 -0.92 -1.16 0.00 0.00 179.01 177.87 2uxr h TYR 196 N 0.37 0.76 -0.52 4.33 3.20 -0.86 -1.03 116.97 123.22 2uxr h TYR 196 Ca 0.09 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 2uxr h TYR 196 Cb 0.44 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 2uxr h TYR 196 CO 0.04 0.58 0.19 0.77 -1.64 0.00 0.00 178.16 178.09 2uxr h SER 197 N 0.73 0.73 -0.35 -2.11 0.02 -1.11 -1.29 113.55 110.17 2uxr h SER 197 Ca 0.19 -0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 2uxr h SER 197 Cb 0.08 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2uxr h SER 197 CO -0.03 0.72 0.07 -0.07 -1.14 0.00 0.00 176.83 176.39 2uxr h LEU 198 N 0.70 0.55 -0.74 5.07 3.38 -1.38 0.44 115.31 123.33 2uxr h LEU 198 Ca 0.17 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2uxr h LEU 198 Cb 0.23 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2uxr h LEU 198 CO -0.01 0.66 0.40 -0.78 0.09 0.00 0.00 178.44 178.79 2uxr h ASP 199 N 0.42 0.93 0.36 -0.43 3.58 -0.94 -2.82 116.42 117.53 2uxr h ASP 199 Ca 0.11 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2uxr h ASP 199 Cb 0.33 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.14 2uxr h ASP 199 CO 0.00 0.77 -0.63 0.00 -2.88 0.00 0.00 179.24 176.51 2uxr n GLN 200 N -4.45 0.03 -3.47 0.28 1.13 -0.51 -4.99 117.38 105.40 2uxr n GLN 200 Ca 0.07 -0.02 -0.18 0.00 -1.94 0.00 0.00 57.00 54.92 2uxr n GLN 200 Cb 0.10 -1.50 0.07 0.00 0.11 0.00 0.00 30.24 29.02 2uxr n GLN 200 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2uxr n LYS 201 N -1.47 -4.97 -4.25 -1.09 5.02 0.14 -5.04 118.16 106.51 2uxr n LYS 201 Ca 0.05 0.77 -0.18 0.00 -2.02 0.00 0.00 58.31 56.94 2uxr n LYS 201 Cb 0.33 -5.59 -0.11 0.00 -0.02 0.00 0.00 35.03 29.64 2uxr n LYS 201 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2uxr s ILE 202 N -3.45 1.36 0.83 -0.18 -4.36 -0.42 -5.00 121.20 109.97 2uxr s ILE 202 Ca 0.12 -1.76 -0.11 0.00 -0.26 0.00 0.00 60.65 58.64 2uxr s ILE 202 Cb -0.02 -1.58 0.09 0.00 1.25 0.00 0.00 42.46 42.20 2uxr s ILE 202 CO 0.76 -0.43 1.14 -1.81 0.24 0.00 0.00 174.94 174.84 2uxr s ASP 203 N -2.53 3.73 -0.14 4.36 1.01 -1.26 -4.58 116.67 117.27 2uxr s ASP 203 Ca 0.10 2.10 0.02 0.00 0.71 0.00 0.00 52.55 55.48 2uxr s ASP 203 Cb -0.04 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.34 2uxr s ASP 203 CO 0.03 -2.56 -0.20 0.00 0.21 0.00 0.00 175.17 172.65 2uxr s TRP 205 N 0.81 2.80 0.07 0.00 0.52 -0.25 -0.49 118.94 122.39 2uxr s TRP 205 Ca -0.07 -0.30 0.02 0.00 0.02 0.00 0.00 56.10 55.77 2uxr s TRP 205 Cb -0.15 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.40 2uxr s TRP 205 CO -0.01 0.06 -0.07 0.12 0.02 0.00 0.00 176.95 177.07 2uxr s PHE 206 N -0.30 0.76 -0.22 -1.98 5.36 -0.74 0.43 117.98 121.28 2uxr s PHE 206 Ca 0.03 -0.70 -0.26 0.00 -0.96 0.00 0.00 56.93 55.04 2uxr s PHE 206 Cb -0.13 -0.45 0.08 0.00 -0.34 0.00 0.00 43.02 42.18 2uxr s PHE 206 CO 0.03 -0.12 0.77 0.00 -1.46 0.00 0.00 175.22 174.44 2uxr s ALA 207 N -2.44 -1.81 0.00 11.12 0.00 -1.26 -1.87 121.76 125.50 2uxr s ALA 207 Ca 0.00 1.85 0.00 0.00 0.00 0.00 0.00 51.96 53.81 2uxr s ALA 207 Cb -0.03 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.13 2uxr s ALA 207 CO -0.02 -0.33 0.00 0.25 0.00 0.00 0.00 175.76 175.66 2uxr n THR 208 N 2.18 0.00 -3.04 0.00 -2.24 -1.20 -4.70 114.28 105.28 2uxr n THR 208 Ca -0.15 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.35 2uxr n THR 208 Cb 0.56 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 2uxr n THR 208 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2uxr n LYS 209 N 0.00 3.25 0.01 -0.78 3.00 -1.26 -0.35 118.16 122.02 2uxr n LYS 209 Ca 0.00 -4.80 0.08 0.00 -0.00 0.00 0.00 58.31 53.59 2uxr n LYS 209 Cb 0.00 -2.27 0.35 0.00 0.00 0.00 0.00 35.03 33.11 2uxr n LYS 209 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2uxr n ASP 210 N 0.08 0.03 0.14 3.14 5.75 -1.26 -0.68 116.55 123.75 2uxr n ASP 210 Ca 0.32 0.51 0.05 0.00 -0.01 0.00 0.00 54.79 55.65 2uxr n ASP 210 Cb 0.38 -0.51 0.04 0.00 -1.03 0.00 0.00 41.12 40.00 2uxr n ASP 210 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2uxr h THR 211 N 0.00 0.61 0.02 2.12 1.35 -1.96 -3.32 112.91 111.71 2uxr h THR 211 Ca 0.00 -1.88 -0.40 0.00 -0.55 0.00 0.00 66.41 63.58 2uxr h THR 211 Cb 0.28 2.26 -0.06 0.00 -1.73 0.00 0.00 68.15 68.89 2uxr h THR 211 CO 0.00 0.35 -2.39 -0.38 -0.25 0.00 0.00 175.52 172.85 2uxr n ILE 212 N -3.14 1.54 -3.27 6.82 -0.00 -0.30 -4.74 119.36 116.27 2uxr n ILE 212 Ca 0.01 -0.52 -0.46 0.00 -0.00 0.00 0.00 62.75 61.79 2uxr n ILE 212 Cb 0.69 -1.59 -0.01 0.00 -0.00 0.00 0.00 39.64 38.74 2uxr n ILE 212 CO 0.00 0.00 0.00 -0.55 -0.00 0.00 0.00 176.55 176.00 2uxr s SER 213 N -6.82 7.07 0.35 4.38 0.15 0.15 -4.87 113.70 114.11 2uxr s SER 213 Ca -0.34 -3.13 0.25 0.00 0.70 0.00 0.00 55.95 53.43 2uxr s SER 213 Cb 0.10 -2.24 0.67 0.00 -1.71 0.00 0.00 66.02 62.83 2uxr s SER 213 CO 0.60 -0.48 1.72 0.11 1.20 0.00 0.00 173.24 176.39 2uxr h LYS 214 N 7.23 0.00 0.00 5.44 1.57 -1.85 -1.85 116.57 127.11 2uxr h LYS 214 Ca 0.17 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2uxr h LYS 214 Cb 0.94 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.25 2uxr h LYS 214 CO 0.95 0.00 -1.01 1.04 -0.57 0.00 0.00 179.45 179.86 2uxr n GLN 215 N -2.72 1.39 -0.03 3.15 6.02 -1.26 -4.49 117.38 119.45 2uxr n GLN 215 Ca 0.04 -0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 57.01 2uxr n GLN 215 Cb 0.45 -1.00 -0.01 0.00 1.02 0.00 0.00 30.24 30.70 2uxr n GLN 215 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 2uxr h TYR 216 N 0.00 0.00 -0.56 1.08 3.20 -1.96 -3.16 116.97 115.56 2uxr h TYR 216 Ca -0.00 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.78 2uxr h TYR 216 Cb 0.36 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 2uxr h TYR 216 CO 0.00 0.00 0.01 -0.44 -1.64 0.00 0.00 178.16 176.09 2uxr h ASP 217 N -0.45 0.93 -0.42 -2.11 5.19 -1.87 -2.75 116.42 114.94 2uxr h ASP 217 Ca 0.00 -0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.17 2uxr h ASP 217 Cb 0.22 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.46 2uxr h ASP 217 CO 0.00 0.98 0.28 -0.61 -3.12 0.00 0.00 179.24 176.77 2uxr h GLN 218 N 0.89 0.55 -0.77 3.56 4.15 -1.55 -0.98 115.11 120.97 2uxr h GLN 218 Ca 0.17 -0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.67 2uxr h GLN 218 Cb 0.50 -0.12 -0.08 0.00 0.21 0.00 0.00 27.48 27.98 2uxr h GLN 218 CO 0.02 0.37 0.38 -0.09 -1.93 0.00 0.00 178.83 177.58 2uxr h ARG 219 N 0.57 0.58 0.08 1.69 9.65 -1.45 -0.38 114.38 125.12 2uxr h ARG 219 Ca 0.15 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2uxr h ARG 219 Cb -0.06 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 28.39 2uxr h ARG 219 CO -0.03 0.39 -0.04 0.74 2.80 0.00 0.00 179.97 183.83 2uxr h PHE 220 N 0.60 -0.09 -0.54 2.20 -1.00 -1.16 -2.17 116.94 114.78 2uxr h PHE 220 Ca 0.39 -0.00 0.11 0.00 2.81 0.00 0.00 57.97 61.28 2uxr h PHE 220 Cb 0.48 0.03 -0.09 0.00 3.61 0.00 0.00 35.95 39.99 2uxr h PHE 220 CO -0.11 0.12 -0.00 -0.22 -1.61 0.00 0.00 178.31 176.49 2uxr h LYS 221 N -0.30 0.11 0.32 1.51 3.64 -1.21 -1.85 116.57 118.80 2uxr h LYS 221 Ca -0.01 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2uxr h LYS 221 Cb 0.25 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2uxr h LYS 221 CO 0.02 0.07 -0.21 0.82 -2.27 0.00 0.00 179.45 177.88 2uxr h ILE 222 N 0.12 0.56 -0.82 2.00 1.08 -0.99 -2.42 117.51 117.04 2uxr h ILE 222 Ca 0.27 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.80 2uxr h ILE 222 Cb 0.42 0.56 -0.06 0.00 -3.07 0.00 0.00 36.82 34.68 2uxr h ILE 222 CO -0.45 0.00 0.51 0.40 -0.69 0.00 0.00 178.15 177.92 2uxr h ILE 223 N -0.52 1.06 0.01 -0.67 2.04 -1.24 -1.27 117.51 116.93 2uxr h ILE 223 Ca -0.03 -0.33 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 2uxr h ILE 223 Cb 0.43 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2uxr h ILE 223 CO 0.03 0.17 -0.01 -0.26 0.00 0.00 0.00 178.15 178.08 2uxr h PHE 224 N 0.95 -0.02 -0.67 1.37 -1.00 -1.27 -0.76 116.94 115.55 2uxr h PHE 224 Ca 0.35 -0.00 0.14 0.00 2.81 0.00 0.00 57.97 61.27 2uxr h PHE 224 Cb 0.13 0.01 -0.11 0.00 3.61 0.00 0.00 35.95 39.59 2uxr h PHE 224 CO -0.04 0.24 0.09 0.93 -1.61 0.00 0.00 178.31 177.92 2uxr h GLU 225 N -0.28 0.19 0.05 1.51 5.08 -1.28 0.17 114.58 120.03 2uxr h GLU 225 Ca -0.00 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2uxr h GLU 225 Cb 0.27 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2uxr h GLU 225 CO 0.00 0.12 -0.03 0.93 -1.00 0.00 0.00 179.01 179.04 2uxr h GLU 226 N 0.19 -0.07 -0.22 2.33 5.08 -1.14 -1.09 114.58 119.67 2uxr h GLU 226 Ca 0.36 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.78 2uxr h GLU 226 Cb 0.60 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.81 2uxr h GLU 226 CO -0.51 0.54 -0.17 0.82 -1.00 0.00 0.00 179.01 178.69 2uxr h ILE 227 N -0.79 0.53 0.20 3.13 2.04 -1.20 -0.09 117.51 121.33 2uxr h ILE 227 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2uxr h ILE 227 Cb 0.64 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 2uxr h ILE 227 CO 0.01 0.00 -0.50 0.15 0.00 0.00 0.00 178.15 177.81 2uxr h PHE 228 N -0.17 -1.44 -0.50 1.37 3.57 -0.68 -1.17 116.94 117.91 2uxr h PHE 228 Ca 0.13 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.69 2uxr h PHE 228 Cb 0.36 0.60 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 2uxr h PHE 228 CO -0.32 -0.59 0.33 0.00 -2.23 0.00 0.00 178.31 175.50 2uxr h ALA 229 N -0.67 1.78 0.00 2.41 0.00 -1.06 0.71 119.26 122.43 2uxr h ALA 229 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2uxr h ALA 229 Cb 0.75 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2uxr h ALA 229 CO -0.23 0.16 -0.67 1.96 0.00 0.00 0.00 179.25 180.48 2uxr h GLN 230 N 0.56 0.00 0.00 0.00 4.20 -0.92 -3.42 115.11 115.52 2uxr h GLN 230 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 2uxr h GLN 230 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 2uxr h GLN 230 CO -0.05 0.00 -0.08 0.39 -0.67 0.00 0.00 178.83 178.41 2uxr n GLU 231 N -2.19 5.43 0.00 1.46 1.02 -0.45 -4.98 120.64 120.93 2uxr n GLU 231 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2uxr n GLU 231 Cb 0.45 -0.54 0.00 0.00 -0.02 0.00 0.00 31.44 31.33 2uxr n GLU 231 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2uxr n TYR 232 N -0.13 0.00 -0.27 -0.32 4.01 0.10 -4.81 117.16 115.74 2uxr n TYR 232 Ca 0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 2uxr n TYR 232 Cb 0.00 0.00 0.21 0.00 -0.31 0.00 0.00 39.34 39.24 2uxr n TYR 232 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 2uxr h LYS 233 N 0.00 0.42 0.12 -0.72 3.64 -1.41 0.13 116.57 118.75 2uxr h LYS 233 Ca 0.00 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 59.11 2uxr h LYS 233 Cb 0.00 -0.10 0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2uxr h LYS 233 CO 0.00 0.28 -1.04 0.93 -2.27 0.00 0.00 179.45 177.35 2uxr h GLU 234 N 0.43 0.49 -0.59 1.90 5.08 -1.88 -1.02 114.58 119.00 2uxr h GLU 234 Ca 0.44 -0.69 0.06 0.00 -1.00 0.00 0.00 59.36 58.17 2uxr h GLU 234 Cb 0.71 0.23 -0.05 0.00 0.50 0.00 0.00 28.75 30.14 2uxr h GLU 234 CO -0.43 1.30 0.31 0.87 -1.00 0.00 0.00 179.01 180.05 2uxr h LYS 235 N 0.02 0.56 0.15 2.33 1.57 -1.80 0.11 116.57 119.52 2uxr h LYS 235 Ca -0.16 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.60 2uxr h LYS 235 Cb 1.76 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.90 2uxr h LYS 235 CO 0.20 0.37 -0.35 0.74 -0.57 0.00 0.00 179.45 179.84 2uxr h PHE 236 N 0.58 -0.96 -0.48 -1.35 -1.00 -0.69 0.47 116.94 113.51 2uxr h PHE 236 Ca 0.27 0.02 0.06 0.00 2.81 0.00 0.00 57.97 61.12 2uxr h PHE 236 Cb 0.18 0.40 -0.05 0.00 3.61 0.00 0.00 35.95 40.09 2uxr h PHE 236 CO -0.10 -0.46 0.20 0.00 -1.61 0.00 0.00 178.31 176.34 2uxr h ALA 237 N -0.02 0.60 -0.72 2.45 0.00 -0.81 0.16 119.26 120.92 2uxr h ALA 237 Ca 0.02 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.10 2uxr h ALA 237 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 2uxr h ALA 237 CO -0.18 -0.18 0.31 0.00 0.00 0.00 0.00 179.25 179.19 2uxr h ALA 238 N 1.30 1.00 0.00 0.00 0.00 -0.58 -2.27 119.26 118.71 2uxr h ALA 238 Ca 0.22 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2uxr h ALA 238 Cb 0.20 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2uxr h ALA 238 CO -0.21 -0.15 -0.19 0.00 0.00 0.00 0.00 179.25 178.70 2uxr n ALA 239 N -2.47 2.71 -2.37 0.00 0.00 0.14 -4.95 120.51 113.56 2uxr n ALA 239 Ca 0.12 -0.17 -0.04 0.00 0.00 0.00 0.00 53.44 53.35 2uxr n ALA 239 Cb 0.35 -1.35 0.01 0.00 0.00 0.00 0.00 19.45 18.45 2uxr n ALA 239 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uxr n GLY 240 N 1.46 0.45 3.40 0.00 0.00 0.48 -5.03 105.19 105.95 2uxr n GLY 240 Ca 0.06 -0.63 -0.20 0.00 0.00 0.00 0.00 46.02 45.26 2uxr n GLY 240 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2uxr s ILE 241 N -2.61 1.15 0.04 -0.61 -4.36 -1.01 -5.01 121.20 108.78 2uxr s ILE 241 Ca 0.05 -2.03 0.02 0.00 -0.26 0.00 0.00 60.65 58.44 2uxr s ILE 241 Cb -0.02 -2.59 -0.02 0.00 1.25 0.00 0.00 42.46 41.07 2uxr s ILE 241 CO 0.06 -0.14 -0.08 -1.61 0.24 0.00 0.00 174.94 173.41 2uxr s GLU 242 N -3.87 0.54 -0.16 0.37 2.02 -1.26 -4.25 118.70 112.08 2uxr s GLU 242 Ca 0.33 -0.68 -0.15 0.00 0.02 0.00 0.00 54.97 54.50 2uxr s GLU 242 Cb 0.07 -0.36 -0.04 0.00 0.10 0.00 0.00 34.13 33.90 2uxr s GLU 242 CO 0.13 0.07 0.33 -0.47 0.02 0.00 0.00 175.26 175.34 2uxr s TYR 243 N -1.16 3.45 -0.15 1.61 5.04 -1.26 -1.65 117.35 123.23 2uxr s TYR 243 Ca -0.07 0.63 0.01 0.00 -2.44 0.00 0.00 57.07 55.20 2uxr s TYR 243 Cb -0.09 -2.40 0.02 0.00 0.35 0.00 0.00 41.96 39.85 2uxr s TYR 243 CO 0.00 0.19 -0.17 0.12 -1.34 0.00 0.00 175.55 174.35 2uxr s PHE 244 N 0.63 2.37 -0.14 4.97 5.36 0.35 -4.99 117.98 126.53 2uxr s PHE 244 Ca 0.18 -1.32 -0.03 0.00 -0.96 0.00 0.00 56.93 54.80 2uxr s PHE 244 Cb -0.14 -1.69 -0.03 0.00 -0.34 0.00 0.00 43.02 40.83 2uxr s PHE 244 CO 0.05 -0.68 -0.04 -0.47 -1.46 0.00 0.00 175.22 172.62 2uxr s TYR 245 N 1.30 3.01 0.05 10.12 5.04 -1.26 -1.79 117.35 133.82 2uxr s TYR 245 Ca 0.02 -0.24 0.00 0.00 -2.44 0.00 0.00 57.07 54.41 2uxr s TYR 245 Cb -0.13 -1.91 -0.00 0.00 0.35 0.00 0.00 41.96 40.26 2uxr s TYR 245 CO -0.09 0.03 0.05 -2.37 -1.34 0.00 0.00 175.55 171.84 2uxr n THR 246 N 3.29 0.00 -2.98 4.34 5.66 -0.78 -5.00 114.28 118.80 2uxr n THR 246 Ca -0.18 -0.28 -0.32 0.00 -3.05 0.00 0.00 64.05 60.23 2uxr n THR 246 Cb 0.53 0.15 -0.05 0.00 -1.55 0.00 0.00 70.33 69.41 2uxr n THR 246 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2uxr s LEU 247 N 0.00 3.95 0.13 1.09 1.43 -1.26 -3.22 118.68 120.80 2uxr s LEU 247 Ca 0.05 1.27 -0.13 0.00 -1.03 0.00 0.00 54.13 54.29 2uxr s LEU 247 Cb 0.00 -4.11 -0.03 0.00 0.03 0.00 0.00 46.19 42.08 2uxr s LEU 247 CO 0.03 -0.30 1.51 -0.29 0.23 0.00 0.00 176.35 177.53 2uxr h ILE 248 N 1.61 1.28 -0.55 -0.59 6.09 -0.97 0.05 117.51 124.43 2uxr h ILE 248 Ca -0.48 -1.32 0.00 0.00 -1.37 0.00 0.00 64.86 61.70 2uxr h ILE 248 Cb 1.18 1.28 -0.03 0.00 0.47 0.00 0.00 36.82 39.73 2uxr h ILE 248 CO 0.64 0.44 0.36 -2.24 -3.07 0.00 0.00 178.15 174.28 2uxr h ASP 249 N 0.63 0.63 -0.17 2.19 2.03 -1.95 -2.85 116.42 116.94 2uxr h ASP 249 Ca 0.09 -0.02 -0.10 0.00 -0.73 0.00 0.00 57.03 56.27 2uxr h ASP 249 Cb 0.74 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.08 2uxr h ASP 249 CO 0.06 0.46 -0.29 -0.78 -1.03 0.00 0.00 179.24 177.66 2uxr h ASP 250 N 0.75 0.54 -0.85 4.15 3.58 -1.83 -2.93 116.42 119.84 2uxr h ASP 250 Ca 0.20 -0.54 0.06 0.00 0.42 0.00 0.00 57.03 57.17 2uxr h ASP 250 Cb -0.08 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 40.76 2uxr h ASP 250 CO -0.04 0.98 0.55 1.62 -2.88 0.00 0.00 179.24 179.47 2uxr h VAL 251 N 0.13 1.06 -0.30 2.25 3.04 -0.89 -1.25 116.25 120.29 2uxr h VAL 251 Ca 0.01 -0.33 -0.18 0.00 -1.01 0.00 0.00 66.70 65.19 2uxr h VAL 251 Cb 0.88 0.03 -0.00 0.00 -2.01 0.00 0.00 31.29 30.18 2uxr h VAL 251 CO 0.07 0.17 -0.53 0.58 -1.01 0.00 0.00 177.57 176.85 2uxr h VAL 252 N 0.95 1.27 -0.48 1.51 2.07 -1.52 -0.48 116.25 119.57 2uxr h VAL 252 Ca 0.36 -1.71 0.10 0.00 0.82 0.00 0.00 66.70 66.26 2uxr h VAL 252 Cb 0.19 1.60 -0.10 0.00 -1.52 0.00 0.00 31.29 31.47 2uxr h VAL 252 CO -0.13 0.56 -0.18 0.00 0.02 0.00 0.00 177.57 177.85 2uxr h ALA 253 N 0.70 0.21 -0.28 1.67 0.00 -1.27 -2.83 119.26 117.46 2uxr h ALA 253 Ca 0.02 0.18 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2uxr h ALA 253 Cb 1.14 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 2uxr h ALA 253 CO 0.12 -0.51 -0.18 0.00 0.00 0.00 0.00 179.25 178.68 2uxr h ARG 254 N -0.07 0.50 0.00 0.00 3.08 -0.95 -2.70 114.38 114.25 2uxr h ARG 254 Ca 0.23 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2uxr h ARG 254 Cb 0.42 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.43 2uxr h ARG 254 CO -0.53 0.66 -0.06 1.98 -1.07 0.00 0.00 179.97 180.96 2uxr h MET 255 N 0.46 0.00 0.00 0.04 4.05 -0.91 -0.97 114.93 117.60 2uxr h MET 255 Ca 0.08 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.49 2uxr h MET 255 Cb 0.57 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.37 2uxr h MET 255 CO 0.04 0.06 -0.02 0.52 0.23 0.00 0.00 176.91 177.74 2uxr h MET 256 N 0.00 0.00 -0.01 0.39 2.86 -1.24 -3.23 114.93 113.71 2uxr h MET 256 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2uxr h MET 256 Cb 0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.76 2uxr h MET 256 CO 0.01 0.02 -0.18 1.63 1.06 0.00 0.00 176.91 179.44 2uxr n LYS 257 N -3.11 1.85 -2.36 1.72 4.76 -0.75 -4.73 118.16 115.54 2uxr n LYS 257 Ca 0.02 -0.69 -0.31 0.00 -2.87 0.00 0.00 58.31 54.46 2uxr n LYS 257 Cb 0.39 -1.11 -0.02 0.00 -1.84 0.00 0.00 35.03 32.46 2uxr n LYS 257 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2uxr s THR 258 N -1.31 4.64 -1.83 -0.18 -1.32 -0.44 -4.89 115.64 110.30 2uxr s THR 258 Ca 0.09 0.97 0.29 0.00 -1.21 0.00 0.00 61.69 61.84 2uxr s THR 258 Cb 0.08 -3.77 0.55 0.00 -1.51 0.00 0.00 72.50 67.85 2uxr s THR 258 CO 0.24 -0.79 1.91 -1.84 -2.21 0.00 0.00 174.62 171.94 2uxr n GLU 259 N -1.86 0.88 0.00 7.08 0.28 -1.25 -3.60 120.64 122.16 2uxr n GLU 259 Ca 0.05 -0.29 0.00 0.00 -0.16 0.00 0.00 57.16 56.76 2uxr n GLU 259 Cb 0.54 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.92 2uxr n GLU 259 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2uxr n GLY 260 N 1.22 -1.31 1.39 -1.84 0.00 -1.26 -0.52 105.19 102.87 2uxr n GLY 260 Ca 0.17 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2uxr n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2uxr n GLY 261 N 0.00 0.62 3.50 -0.02 0.00 -0.20 -4.79 105.19 104.31 2uxr n GLY 261 Ca 0.00 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 45.04 2uxr n GLY 261 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2uxr s MET 262 N -1.69 1.74 -0.32 1.61 0.23 -1.24 -4.26 119.30 115.38 2uxr s MET 262 Ca 0.00 -1.96 -0.16 0.00 -1.03 0.00 0.00 55.69 52.53 2uxr s MET 262 Cb 0.00 -1.18 -0.02 0.00 -1.53 0.00 0.00 34.83 32.11 2uxr s MET 262 CO 0.00 -0.11 0.43 -1.17 -2.03 0.00 0.00 175.02 172.14 2uxr s LEU 263 N -3.56 4.28 -0.63 0.18 2.96 0.18 -1.78 118.68 120.30 2uxr s LEU 263 Ca 0.35 0.02 -0.17 0.00 -0.22 0.00 0.00 54.13 54.11 2uxr s LEU 263 Cb 0.08 -2.47 0.13 0.00 0.50 0.00 0.00 46.19 44.44 2uxr s LEU 263 CO 0.16 -0.35 0.68 0.86 -1.32 0.00 0.00 176.35 176.38 2uxr s TRP 264 N 2.19 3.21 0.15 5.38 -0.00 0.26 -1.09 118.94 129.04 2uxr s TRP 264 Ca 0.16 -1.26 -0.30 0.00 -0.00 0.00 0.00 56.10 54.69 2uxr s TRP 264 Cb -0.16 -3.93 -0.08 0.00 -0.00 0.00 0.00 33.47 29.30 2uxr s TRP 264 CO 0.12 -1.17 1.30 0.00 -0.00 0.00 0.00 176.95 177.20 2uxr s ALA 265 N 1.93 3.51 -0.00 5.86 0.00 0.17 -0.14 121.76 133.09 2uxr s ALA 265 Ca 0.11 1.05 0.03 0.00 0.00 0.00 0.00 51.96 53.15 2uxr s ALA 265 Cb -0.23 -3.48 -0.01 0.00 0.00 0.00 0.00 23.12 19.40 2uxr s ALA 265 CO 0.02 -0.52 -0.09 0.00 0.00 0.00 0.00 175.76 175.17 2uxr n LYS 267 N 2.77 -0.22 -0.24 0.00 5.02 -1.26 -0.81 118.16 123.42 2uxr n LYS 267 Ca -0.14 0.01 -0.07 0.00 -2.02 0.00 0.00 58.31 56.10 2uxr n LYS 267 Cb 0.57 -2.40 -0.02 0.00 -0.02 0.00 0.00 35.03 33.17 2uxr n LYS 267 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 2uxr h ASN 268 N -1.52 -1.43 0.13 4.39 -0.73 -1.86 0.15 115.58 114.70 2uxr h ASN 268 Ca -0.44 0.26 -0.01 0.00 1.87 0.00 0.00 56.30 57.98 2uxr h ASN 268 Cb 1.28 0.68 0.00 0.00 0.27 0.00 0.00 38.32 40.55 2uxr h ASN 268 CO 0.43 -0.32 -0.06 0.22 -0.37 0.00 0.00 177.43 177.33 2uxr h TYR 269 N -0.16 -0.16 -0.71 0.67 3.20 -1.91 -2.73 116.97 115.17 2uxr h TYR 269 Ca 0.22 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.20 2uxr h TYR 269 Cb 0.56 0.05 -0.08 0.00 1.54 0.00 0.00 36.73 38.80 2uxr h TYR 269 CO -0.73 0.09 0.31 -0.44 -1.64 0.00 0.00 178.16 175.75 2uxr h ASP 270 N -0.39 0.35 0.21 -2.11 3.32 -1.85 -2.42 116.42 113.52 2uxr h ASP 270 Ca -0.02 0.08 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2uxr h ASP 270 Cb 0.32 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2uxr h ASP 270 CO 0.03 0.17 -0.13 1.23 -1.72 0.00 0.00 179.24 178.83 2uxr h GLY 271 N 0.50 0.00 0.66 2.75 0.00 -0.62 0.41 103.07 106.77 2uxr h GLY 271 Ca 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.68 2uxr h GLY 271 CO -0.33 0.00 -0.03 -1.80 0.00 0.00 0.00 176.54 174.38 2uxr h ASP 272 N 0.00 0.14 0.38 0.19 3.58 -1.12 -2.14 116.42 117.45 2uxr h ASP 272 Ca -0.00 -0.41 -0.02 0.00 0.42 0.00 0.00 57.03 57.02 2uxr h ASP 272 Cb 0.26 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.28 2uxr h ASP 272 CO 0.02 0.52 -0.18 0.58 -2.88 0.00 0.00 179.24 177.29 2uxr h VAL 273 N -0.23 0.60 -0.00 2.25 2.07 -1.25 -3.16 116.25 116.53 2uxr h VAL 273 Ca 0.02 -0.40 -0.14 0.00 0.82 0.00 0.00 66.70 67.00 2uxr h VAL 273 Cb 0.46 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2uxr h VAL 273 CO 0.01 0.07 -0.65 0.24 0.02 0.00 0.00 177.57 177.26 2uxr h MET 274 N -0.75 0.02 -0.50 1.57 2.86 -1.04 -1.90 114.93 115.18 2uxr h MET 274 Ca -0.05 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.51 2uxr h MET 274 Cb 0.51 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 2uxr h MET 274 CO 0.09 0.66 0.05 0.66 1.06 0.00 0.00 176.91 179.43 2uxr h SER 275 N 0.01 0.76 -0.18 1.22 4.64 -1.47 0.11 113.55 118.64 2uxr h SER 275 Ca -0.01 -0.16 -0.07 0.00 -0.47 0.00 0.00 61.79 61.08 2uxr h SER 275 Cb 1.16 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2uxr h SER 275 CO 0.09 0.80 -0.14 0.44 -0.87 0.00 0.00 176.83 177.14 2uxr h ASP 276 N 0.76 0.44 -0.47 4.97 5.19 -1.40 -1.52 116.42 124.40 2uxr h ASP 276 Ca 0.16 -0.46 0.09 0.00 -0.62 0.00 0.00 57.03 56.20 2uxr h ASP 276 Cb 0.38 -0.12 -0.10 0.00 0.18 0.00 0.00 39.33 39.67 2uxr h ASP 276 CO 0.01 0.80 -0.34 -0.03 -3.12 0.00 0.00 179.24 176.56 2uxr h MET 277 N 0.08 -0.22 -0.41 3.56 4.05 -1.30 -0.15 114.93 120.54 2uxr h MET 277 Ca 0.03 0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.42 2uxr h MET 277 Cb 0.67 0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 31.50 2uxr h MET 277 CO 0.04 -0.15 0.07 0.28 0.23 0.00 0.00 176.91 177.38 2uxr h VAL 278 N -0.23 1.24 -0.28 -5.77 2.07 -0.74 -1.64 116.25 110.90 2uxr h VAL 278 Ca 0.19 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2uxr h VAL 278 Cb 0.55 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2uxr h VAL 278 CO -0.59 0.30 0.16 0.00 0.02 0.00 0.00 177.57 177.45 2uxr h ALA 279 N 0.93 0.36 0.01 1.67 0.00 -1.14 -1.71 119.26 119.37 2uxr h ALA 279 Ca 0.12 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2uxr h ALA 279 Cb 0.37 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2uxr h ALA 279 CO 0.01 -0.12 -0.00 1.03 0.00 0.00 0.00 179.25 180.16 2uxr h SER 280 N 0.34 -0.01 -0.77 0.00 0.87 -0.96 -2.46 113.55 110.55 2uxr h SER 280 Ca 0.10 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2uxr h SER 280 Cb 0.05 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.97 2uxr h SER 280 CO -0.02 0.05 0.49 0.00 -0.53 0.00 0.00 176.83 176.82 2uxr h ALA 281 N 0.92 1.41 0.00 6.23 0.00 -1.27 -2.69 119.26 123.87 2uxr h ALA 281 Ca -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2uxr h ALA 281 Cb 0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2uxr h ALA 281 CO 0.00 0.53 -0.16 0.74 0.00 0.00 0.00 179.25 180.36 2uxr h PHE 282 N 1.06 0.00 0.00 0.00 0.04 -1.20 0.82 116.94 117.66 2uxr h PHE 282 Ca 0.28 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.05 2uxr h PHE 282 Cb -0.08 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.07 2uxr h PHE 282 CO 0.00 0.16 0.00 0.41 -0.60 0.00 0.00 178.31 178.28 2uxr n GLY 283 N 0.81 -1.30 3.15 -1.45 0.00 -0.94 -4.38 105.19 101.07 2uxr n GLY 283 Ca 0.02 0.72 -0.09 0.00 0.00 0.00 0.00 46.02 46.67 2uxr n GLY 283 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2uxr s SER 284 N 2.00 0.32 0.57 1.61 1.04 -1.14 -4.72 113.70 113.39 2uxr s SER 284 Ca 0.00 -1.16 0.30 0.00 0.48 0.00 0.00 55.95 55.56 2uxr s SER 284 Cb 0.00 0.29 1.45 0.00 0.10 0.00 0.00 66.02 67.86 2uxr s SER 284 CO 0.00 -0.72 1.86 -0.07 0.98 0.00 0.00 173.24 175.29 2uxr h LEU 285 N 2.89 0.00 -0.03 2.42 3.38 -1.87 0.24 115.31 122.34 2uxr h LEU 285 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2uxr h LEU 285 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2uxr h LEU 285 CO 0.60 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.13 2uxr h ALA 286 N 1.44 1.00 -0.55 1.53 0.00 -1.91 -3.36 119.26 117.42 2uxr h ALA 286 Ca 0.30 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.48 2uxr h ALA 286 Cb 1.44 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 19.13 2uxr h ALA 286 CO -0.00 0.00 2.64 -1.33 0.00 0.00 0.00 179.25 180.56 2uxr n MET 287 N -2.85 4.37 -3.75 0.00 2.81 0.07 -2.46 117.12 115.31 2uxr n MET 287 Ca 0.04 -3.25 -0.12 0.00 -1.81 0.00 0.00 57.70 52.56 2uxr n MET 287 Cb 0.49 -2.69 -0.13 0.00 -0.71 0.00 0.00 33.22 30.19 2uxr n MET 287 CO 0.00 0.00 0.00 1.41 1.51 0.00 0.00 175.97 178.89 2uxr s MET 288 N -0.46 0.23 0.21 0.03 0.00 -1.26 0.09 119.30 118.16 2uxr s MET 288 Ca 0.56 0.45 -0.06 0.00 0.00 0.00 0.00 55.69 56.64 2uxr s MET 288 Cb 0.18 -0.02 -0.06 0.00 0.00 0.00 0.00 34.83 34.93 2uxr s MET 288 CO -0.08 -0.11 0.48 -1.54 0.00 0.00 0.00 175.02 173.76 2uxr s SER 289 N 0.82 6.51 -0.13 1.11 1.04 0.10 -4.63 113.70 118.53 2uxr s SER 289 Ca -0.06 0.70 -0.04 0.00 0.48 0.00 0.00 55.95 57.03 2uxr s SER 289 Cb -0.07 -2.14 0.06 0.00 0.10 0.00 0.00 66.02 63.98 2uxr s SER 289 CO -0.05 -0.06 0.24 -0.55 0.98 0.00 0.00 173.24 173.80 2uxr s SER 290 N -2.69 0.47 -0.06 7.02 0.15 -1.24 -1.85 113.70 115.50 2uxr s SER 290 Ca 0.43 0.51 0.01 0.00 0.70 0.00 0.00 55.95 57.60 2uxr s SER 290 Cb -0.11 0.61 0.02 0.00 -1.71 0.00 0.00 66.02 64.83 2uxr s SER 290 CO 0.26 -0.25 -0.05 0.54 1.20 0.00 0.00 173.24 174.94 2uxr s VAL 291 N 2.39 0.67 -0.20 4.45 0.11 -0.82 -1.88 120.40 125.12 2uxr s VAL 291 Ca 0.02 -0.16 -0.29 0.00 -2.93 0.00 0.00 61.98 58.62 2uxr s VAL 291 Cb -0.12 -0.70 0.00 0.00 -1.53 0.00 0.00 36.38 34.03 2uxr s VAL 291 CO -0.08 0.27 1.02 -0.22 -3.33 0.00 0.00 175.10 172.76 2uxr s LEU 292 N 1.17 4.13 -0.37 2.54 2.96 0.89 -0.83 118.68 129.17 2uxr s LEU 292 Ca -0.07 1.39 -0.06 0.00 -0.22 0.00 0.00 54.13 55.17 2uxr s LEU 292 Cb -0.14 -3.52 0.07 0.00 0.50 0.00 0.00 46.19 43.10 2uxr s LEU 292 CO -0.01 -0.61 0.16 -0.69 -1.32 0.00 0.00 176.35 173.88 2uxr s VAL 293 N 2.90 3.75 0.17 1.68 1.01 0.43 -1.93 120.40 128.41 2uxr s VAL 293 Ca 0.44 -1.41 -0.17 0.00 0.00 0.00 0.00 61.98 60.84 2uxr s VAL 293 Cb -0.16 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.89 2uxr s VAL 293 CO 0.09 -0.37 0.63 -0.55 0.00 0.00 0.00 175.10 174.90 2uxr s SER 294 N 1.70 6.95 0.09 3.32 0.15 -0.89 -1.29 113.70 123.73 2uxr s SER 294 Ca 0.01 1.24 0.16 0.00 0.70 0.00 0.00 55.95 58.07 2uxr s SER 294 Cb -0.21 -2.35 0.69 0.00 -1.71 0.00 0.00 66.02 62.43 2uxr s SER 294 CO 0.01 0.10 1.50 -0.81 1.20 0.00 0.00 173.24 175.23 2uxr n PRO 295 N 0.89 0.06 -0.25 5.44 -0.04 -1.26 -2.13 135.00 137.70 2uxr n PRO 295 Ca -0.05 0.34 0.11 0.00 -0.04 0.00 0.00 63.50 63.86 2uxr n PRO 295 Cb 0.51 -1.63 0.27 0.00 -0.04 0.00 0.00 33.50 32.61 2uxr n PRO 295 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2uxr n TYR 296 N -1.75 0.67 -0.48 0.54 4.01 -1.26 -4.94 117.16 113.95 2uxr n TYR 296 Ca 0.02 -0.34 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 2uxr n TYR 296 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 2uxr n TYR 296 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2uxr n GLY 297 N 1.46 0.75 3.91 2.72 0.00 -0.91 -5.08 105.19 108.04 2uxr n GLY 297 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 2uxr n GLY 297 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uxr s TYR 298 N -2.35 3.47 0.00 1.61 2.02 -1.26 -4.96 117.35 115.89 2uxr s TYR 298 Ca 0.00 0.79 0.02 0.00 -0.37 0.00 0.00 57.07 57.51 2uxr s TYR 298 Cb 0.00 -2.47 -0.01 0.00 -0.40 0.00 0.00 41.96 39.09 2uxr s TYR 298 CO 0.00 -0.48 -0.06 -0.06 -1.57 0.00 0.00 175.55 173.38 2uxr s PHE 299 N -2.85 0.55 -0.07 2.71 0.08 -0.51 -2.10 117.98 115.80 2uxr s PHE 299 Ca 0.50 -0.15 -0.01 0.00 0.12 0.00 0.00 56.93 57.40 2uxr s PHE 299 Cb -0.10 -0.35 0.03 0.00 -0.57 0.00 0.00 43.02 42.02 2uxr s PHE 299 CO 0.46 -0.02 -0.02 -2.00 -0.10 0.00 0.00 175.22 173.54 2uxr s GLU 300 N -0.32 0.73 -0.11 0.44 2.12 -0.81 -1.43 118.70 119.32 2uxr s GLU 300 Ca 0.01 0.02 -0.05 0.00 0.36 0.00 0.00 54.97 55.31 2uxr s GLU 300 Cb -0.03 -0.97 -0.04 0.00 0.26 0.00 0.00 34.13 33.35 2uxr s GLU 300 CO -0.00 -0.23 0.06 0.71 -0.54 0.00 0.00 175.26 175.26 2uxr s TYR 301 N 1.62 3.34 0.20 5.30 2.02 -0.63 -0.08 117.35 129.12 2uxr s TYR 301 Ca -0.00 0.30 -0.11 0.00 -0.37 0.00 0.00 57.07 56.89 2uxr s TYR 301 Cb -0.13 -1.89 -0.00 0.00 -0.40 0.00 0.00 41.96 39.54 2uxr s TYR 301 CO -0.04 0.52 0.37 -1.83 -1.57 0.00 0.00 175.55 173.01 2uxr s GLU 302 N -0.76 1.31 0.35 -0.62 -1.05 -0.79 -0.94 118.70 116.21 2uxr s GLU 302 Ca 0.12 -1.17 -0.22 0.00 -0.15 0.00 0.00 54.97 53.56 2uxr s GLU 302 Cb -0.12 0.42 -0.10 0.00 -0.44 0.00 0.00 34.13 33.90 2uxr s GLU 302 CO 0.03 -0.51 0.90 0.00 0.95 0.00 0.00 175.26 176.62 2uxr s ALA 303 N -3.98 3.18 -0.64 -0.84 0.00 -1.24 -3.71 121.76 114.53 2uxr s ALA 303 Ca 0.18 0.39 0.24 0.00 0.00 0.00 0.00 51.96 52.77 2uxr s ALA 303 Cb 0.02 -3.09 0.41 0.00 0.00 0.00 0.00 23.12 20.46 2uxr s ALA 303 CO 0.03 0.19 1.40 0.00 0.00 0.00 0.00 175.76 177.38 2uxr h ALA 304 N 2.61 0.66 -3.99 0.00 0.00 -1.88 -3.47 119.26 113.20 2uxr h ALA 304 Ca -0.48 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.25 2uxr h ALA 304 Cb 1.19 0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.02 2uxr h ALA 304 CO 0.63 0.00 0.10 -2.39 0.00 0.00 0.00 179.25 177.59 2uxr n HIS 305 N -2.19 -3.52 -2.61 0.00 1.44 -1.26 -5.05 115.22 102.04 2uxr n HIS 305 Ca 0.04 -0.62 0.00 0.00 -2.01 0.00 0.00 57.72 55.12 2uxr n HIS 305 Cb 0.44 -0.35 0.00 0.00 0.12 0.00 0.00 29.99 30.21 2uxr n HIS 305 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2uxr n GLY 306 N 1.71 1.99 0.90 -1.39 0.00 -1.26 -4.87 105.19 102.26 2uxr n GLY 306 Ca 0.07 -2.09 0.08 0.00 0.00 0.00 0.00 46.02 44.07 2uxr n GLY 306 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2uxr n THR 307 N -0.58 0.69 -3.93 2.61 -2.24 -1.26 -4.87 114.28 104.68 2uxr n THR 307 Ca 0.00 -0.65 -0.38 0.00 -2.27 0.00 0.00 64.05 60.75 2uxr n THR 307 Cb 0.00 0.29 0.02 0.00 -2.10 0.00 0.00 70.33 68.54 2uxr n THR 307 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2uxr n VAL 308 N 0.88 -3.45 -0.30 2.28 0.31 -1.26 -1.59 118.33 115.20 2uxr n VAL 308 Ca 0.16 -0.48 0.10 0.00 -0.01 0.00 0.00 64.34 64.11 2uxr n VAL 308 Cb 0.42 -2.82 0.26 0.00 -0.91 0.00 0.00 33.84 30.79 2uxr n VAL 308 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2uxr h GLN 309 N -1.86 0.52 -0.32 5.55 4.15 -1.97 -1.81 115.11 119.37 2uxr h GLN 309 Ca -0.67 -0.03 -0.16 0.00 0.77 0.00 0.00 58.65 58.56 2uxr h GLN 309 Cb 1.39 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.96 2uxr h GLN 309 CO 0.47 0.34 -0.43 0.00 -1.93 0.00 0.00 178.83 177.28 2uxr h ARG 310 N 0.53 0.82 -0.49 1.69 3.08 -2.01 -2.43 114.38 115.57 2uxr h ARG 310 Ca 0.50 -0.45 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 2uxr h ARG 310 Cb 0.82 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 2uxr h ARG 310 CO -0.43 1.08 0.04 0.45 -1.07 0.00 0.00 179.97 180.04 2uxr h HIS 311 N 0.66 0.83 -0.38 3.04 3.86 -1.85 -2.99 115.15 118.31 2uxr h HIS 311 Ca 0.05 -0.10 0.03 0.00 -1.16 0.00 0.00 60.37 59.19 2uxr h HIS 311 Cb 1.00 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 29.20 2uxr h HIS 311 CO 0.06 0.74 0.18 -0.92 0.86 0.00 0.00 177.93 178.85 2uxr h TYR 312 N 0.74 0.32 -0.71 2.45 3.20 -1.00 0.59 116.97 122.56 2uxr h TYR 312 Ca 0.15 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.07 2uxr h TYR 312 Cb 0.40 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.54 2uxr h TYR 312 CO 0.02 0.17 0.47 1.88 -1.64 0.00 0.00 178.16 179.06 2uxr h TYR 313 N 0.36 0.84 -0.05 -3.82 0.05 -1.43 0.18 116.97 113.10 2uxr h TYR 313 Ca 0.16 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.96 2uxr h TYR 313 Cb 0.08 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 37.54 2uxr h TYR 313 CO -0.11 0.49 0.02 1.96 -1.05 0.00 0.00 178.16 179.48 2uxr h GLN 314 N 0.87 0.07 -0.64 4.88 1.08 -1.29 -1.98 115.11 118.11 2uxr h GLN 314 Ca 0.28 -0.01 0.10 0.00 -1.45 0.00 0.00 58.65 57.57 2uxr h GLN 314 Cb 0.04 -0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 27.38 2uxr h GLN 314 CO -0.08 0.19 0.24 1.25 -0.95 0.00 0.00 178.83 179.49 2uxr h HIS 315 N -0.07 0.43 0.00 2.96 2.76 -0.06 -1.50 115.15 119.67 2uxr h HIS 315 Ca 0.02 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2uxr h HIS 315 Cb 0.15 -0.09 -0.00 0.00 1.55 0.00 0.00 27.41 29.01 2uxr h HIS 315 CO -0.02 0.10 -0.01 -0.07 -1.30 0.00 0.00 177.93 176.63 2uxr h LEU 316 N 0.43 0.00 -0.40 0.26 3.38 -0.56 -1.19 115.31 117.23 2uxr h LEU 316 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2uxr h LEU 316 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2uxr h LEU 316 CO -0.32 0.01 -0.05 0.29 0.09 0.00 0.00 178.44 178.46 2uxr n LYS 317 N -3.67 1.09 -0.42 1.13 5.02 -0.62 -4.91 118.16 115.77 2uxr n LYS 317 Ca -0.03 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.86 2uxr n LYS 317 Cb 0.09 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 2uxr n LYS 317 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2uxr n GLY 318 N 1.17 0.74 3.87 0.72 0.00 -0.45 -5.07 105.19 106.16 2uxr n GLY 318 Ca 0.19 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 2uxr n GLY 318 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2uxr s GLU 319 N -0.83 3.73 0.39 1.61 8.01 -0.84 -5.02 118.70 125.74 2uxr s GLU 319 Ca 0.00 0.14 -0.24 0.00 0.01 0.00 0.00 54.97 54.88 2uxr s GLU 319 Cb 0.00 -3.03 -0.09 0.00 -4.31 0.00 0.00 34.13 26.69 2uxr s GLU 319 CO 0.00 0.59 1.02 1.03 0.01 0.00 0.00 175.26 177.91 2uxr s ARG 320 N -1.81 4.24 0.25 1.61 1.81 -1.26 -4.05 118.95 119.75 2uxr s ARG 320 Ca 0.31 1.42 0.08 0.00 -1.72 0.00 0.00 55.73 55.82 2uxr s ARG 320 Cb -0.14 -2.54 -0.05 0.00 -0.45 0.00 0.00 34.95 31.77 2uxr s ARG 320 CO 0.17 -0.05 -0.11 0.95 -0.68 0.00 0.00 175.30 175.57 2uxr s THR 321 N -1.72 1.80 -0.79 0.02 -4.23 -1.26 -4.95 115.64 104.51 2uxr s THR 321 Ca 0.57 -2.20 0.03 0.00 -1.18 0.00 0.00 61.69 58.91 2uxr s THR 321 Cb -0.20 -2.26 0.28 0.00 1.34 0.00 0.00 72.50 71.66 2uxr s THR 321 CO 0.25 -0.44 1.02 -0.24 -0.54 0.00 0.00 174.62 174.67 2uxr n SER 322 N -0.50 4.75 -4.66 3.99 2.88 -1.26 -0.26 113.62 118.55 2uxr n SER 322 Ca -0.06 -3.46 -0.40 0.00 -1.33 0.00 0.00 58.87 53.62 2uxr n SER 322 Cb 0.62 -0.87 -0.06 0.00 -0.75 0.00 0.00 64.21 63.15 2uxr n SER 322 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2uxr s THR 323 N -2.74 5.02 -0.33 2.46 2.01 -1.26 -4.13 115.64 116.66 2uxr s THR 323 Ca 0.38 1.21 -0.28 0.00 0.31 0.00 0.00 61.69 63.30 2uxr s THR 323 Cb 0.13 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 2uxr s THR 323 CO 0.02 0.12 1.83 0.21 -0.69 0.00 0.00 174.62 176.10 2uxr s ASN 324 N 1.17 5.85 -0.04 3.53 3.84 -1.26 -4.44 114.94 123.59 2uxr s ASN 324 Ca 0.29 1.32 0.11 0.00 0.21 0.00 0.00 52.86 54.80 2uxr s ASN 324 Cb -0.16 -2.52 0.40 0.00 -0.55 0.00 0.00 41.25 38.41 2uxr s ASN 324 CO 0.11 -1.74 1.27 -0.81 -2.79 0.00 0.00 177.10 173.13 2uxr n PRO 325 N 8.46 2.36 -0.22 0.43 -0.04 -1.26 -4.60 135.00 140.13 2uxr n PRO 325 Ca 0.23 -1.58 -0.08 0.00 -0.04 0.00 0.00 63.50 62.03 2uxr n PRO 325 Cb 0.47 -1.52 0.03 0.00 -0.04 0.00 0.00 33.50 32.44 2uxr n PRO 325 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2uxr h VAL 326 N 2.36 1.26 -0.30 0.52 2.07 -1.91 -1.81 116.25 118.44 2uxr h VAL 326 Ca 0.00 -0.99 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 2uxr h VAL 326 Cb 0.81 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2uxr h VAL 326 CO 0.09 0.37 -0.11 0.00 0.02 0.00 0.00 177.57 177.93 2uxr h ALA 327 N 1.02 1.25 -0.48 1.67 0.00 -1.73 -0.20 119.26 120.79 2uxr h ALA 327 Ca 0.19 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2uxr h ALA 327 Cb 0.42 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2uxr h ALA 327 CO 0.01 0.49 0.01 -0.07 0.00 0.00 0.00 179.25 179.69 2uxr h LEU 328 N 0.47 0.83 -0.09 0.00 3.38 -1.77 -0.94 115.31 117.18 2uxr h LEU 328 Ca 0.09 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2uxr h LEU 328 Cb 0.48 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2uxr h LEU 328 CO 0.03 0.93 0.05 0.40 0.09 0.00 0.00 178.44 179.94 2uxr h ILE 329 N 0.70 1.01 0.00 1.22 2.04 -0.99 -1.83 117.51 119.67 2uxr h ILE 329 Ca 0.14 -0.04 -0.05 0.00 1.00 0.00 0.00 64.86 65.91 2uxr h ILE 329 Cb 0.50 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 2uxr h ILE 329 CO 0.02 0.02 -0.26 1.88 0.00 0.00 0.00 178.15 179.82 2uxr h TYR 330 N 0.11 0.00 0.15 1.37 -1.99 -0.89 0.40 116.97 116.13 2uxr h TYR 330 Ca 0.03 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.76 2uxr h TYR 330 Cb -0.01 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.72 2uxr h TYR 330 CO -0.08 0.26 -0.07 0.00 -0.00 0.00 0.00 178.16 178.26 2uxr h ALA 331 N 1.74 -0.21 0.33 3.88 0.00 -0.95 0.80 119.26 124.86 2uxr h ALA 331 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2uxr h ALA 331 Cb 0.59 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2uxr h ALA 331 CO 0.03 -0.53 -0.23 -1.49 0.00 0.00 0.00 179.25 177.03 2uxr h TRP 332 N -0.38 -0.61 -0.03 0.00 4.06 -0.94 0.27 115.95 118.32 2uxr h TRP 332 Ca -0.02 -0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.83 2uxr h TRP 332 Cb 0.30 0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 28.68 2uxr h TRP 332 CO -0.01 -0.36 -0.43 1.79 -3.56 0.00 0.00 178.44 175.87 2uxr h THR 333 N -0.56 1.31 -0.37 1.49 1.35 -0.96 -0.23 112.91 114.95 2uxr h THR 333 Ca -0.03 -1.50 -0.02 0.00 -0.55 0.00 0.00 66.41 64.31 2uxr h THR 333 Cb 0.48 1.77 -0.02 0.00 -1.73 0.00 0.00 68.15 68.65 2uxr h THR 333 CO 0.01 0.43 0.14 1.23 -0.25 0.00 0.00 175.52 177.08 2uxr h GLY 334 N 1.28 0.59 0.74 5.82 0.00 0.81 -2.06 103.07 110.26 2uxr h GLY 334 Ca 0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 2uxr h GLY 334 CO 0.06 0.31 -0.01 0.00 0.00 0.00 0.00 176.54 176.90 2uxr h ALA 335 N 0.98 0.14 -0.52 3.60 0.00 -0.68 -2.70 119.26 120.07 2uxr h ALA 335 Ca 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2uxr h ALA 335 Cb 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2uxr h ALA 335 CO -0.01 -0.16 0.28 -0.07 0.00 0.00 0.00 179.25 179.29 2uxr h LEU 336 N -0.11 0.63 -0.08 0.00 3.38 -1.13 -0.42 115.31 117.59 2uxr h LEU 336 Ca 0.03 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2uxr h LEU 336 Cb 0.38 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2uxr h LEU 336 CO 0.01 0.52 0.03 -0.09 0.09 0.00 0.00 178.44 178.99 2uxr h ARG 337 N 0.72 0.12 -0.70 1.13 2.43 -1.33 -1.56 114.38 115.18 2uxr h ARG 337 Ca 0.19 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2uxr h ARG 337 Cb 0.02 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 2uxr h ARG 337 CO -0.03 0.25 0.29 -0.22 -1.51 0.00 0.00 179.97 178.75 2uxr h LYS 338 N -0.05 1.05 0.03 0.20 1.63 -1.14 -1.03 116.57 117.27 2uxr h LYS 338 Ca 0.03 -0.19 0.03 0.00 -0.85 0.00 0.00 60.65 59.67 2uxr h LYS 338 Cb 0.18 -0.17 -0.04 0.00 -0.60 0.00 0.00 32.23 31.60 2uxr h LYS 338 CO -0.00 0.86 -0.27 -0.09 -3.45 0.00 0.00 179.45 176.50 2uxr h ARG 339 N 1.00 -0.41 -0.31 1.90 1.12 -1.05 -0.13 114.38 116.49 2uxr h ARG 339 Ca 0.23 0.03 -0.04 0.00 -1.11 0.00 0.00 59.98 59.09 2uxr h ARG 339 Cb 0.20 0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 30.24 2uxr h ARG 339 CO -0.02 -0.28 0.01 0.78 -3.11 0.00 0.00 179.97 177.35 2uxr h GLY 340 N -0.43 0.51 0.70 2.80 0.00 -1.01 -0.45 103.07 105.18 2uxr h GLY 340 Ca 0.05 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 2uxr h GLY 340 CO -0.21 0.27 -0.03 -2.09 0.00 0.00 0.00 176.54 174.48 2uxr h GLU 341 N 0.46 -0.07 -0.76 4.80 4.81 -0.99 0.15 114.58 122.99 2uxr h GLU 341 Ca 0.10 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.41 2uxr h GLU 341 Cb 0.29 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 2uxr h GLU 341 CO 0.01 0.24 0.50 -0.07 -0.73 0.00 0.00 179.01 178.95 2uxr h LEU 342 N -0.38 0.67 -0.02 1.64 3.38 -0.65 -2.99 115.31 116.96 2uxr h LEU 342 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2uxr h LEU 342 Cb 0.34 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2uxr h LEU 342 CO 0.01 0.42 -0.34 0.47 0.09 0.00 0.00 178.44 179.09 2uxr n ASP 343 N -4.49 0.37 -2.55 -0.43 8.00 -0.21 -4.95 116.55 112.29 2uxr n ASP 343 Ca 0.12 -0.07 -0.17 0.00 0.71 0.00 0.00 54.79 55.38 2uxr n ASP 343 Cb 0.26 0.03 0.04 0.00 -0.02 0.00 0.00 41.12 41.44 2uxr n ASP 343 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2uxr n GLY 344 N 1.49 -0.16 2.98 0.44 0.00 -0.20 -4.97 105.19 104.77 2uxr n GLY 344 Ca 0.06 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2uxr n GLY 344 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2uxr n THR 345 N -4.27 2.36 0.48 2.61 -2.24 0.36 -4.97 114.28 108.61 2uxr n THR 345 Ca -0.03 -5.02 0.12 0.00 -2.27 0.00 0.00 64.05 56.86 2uxr n THR 345 Cb 0.56 -2.27 0.46 0.00 -2.10 0.00 0.00 70.33 66.98 2uxr n THR 345 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2uxr n PRO 346 N 2.05 0.22 -0.14 -0.78 -0.04 -1.26 -2.33 135.00 132.72 2uxr n PRO 346 Ca 0.21 0.35 -0.02 0.00 -0.04 0.00 0.00 63.50 64.00 2uxr n PRO 346 Cb 0.36 -1.85 0.20 0.00 -0.04 0.00 0.00 33.50 32.17 2uxr n PRO 346 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2uxr h ASP 347 N 0.00 0.78 -0.12 3.54 3.32 -1.95 0.15 116.42 122.14 2uxr h ASP 347 Ca 0.00 -0.12 0.04 0.00 0.02 0.00 0.00 57.03 56.96 2uxr h ASP 347 Cb 0.50 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 2uxr h ASP 347 CO 0.00 0.74 -0.14 0.25 -1.72 0.00 0.00 179.24 178.37 2uxr h LEU 348 N 0.82 -0.43 -0.34 1.55 5.85 -1.78 0.49 115.31 121.47 2uxr h LEU 348 Ca 0.19 0.08 0.05 0.00 0.84 0.00 0.00 57.88 59.04 2uxr h LEU 348 Cb 0.25 0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 2uxr h LEU 348 CO -0.01 -0.18 0.07 0.00 -0.34 0.00 0.00 178.44 177.98 2uxr h ALA 350 N 1.25 0.73 -0.94 0.00 0.00 -0.52 -1.65 119.26 118.14 2uxr h ALA 350 Ca 0.16 0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.20 2uxr h ALA 350 Cb 0.18 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2uxr h ALA 350 CO -0.21 -0.24 0.61 0.35 0.00 0.00 0.00 179.25 179.76 2uxr h PHE 351 N 0.35 1.15 -0.50 0.00 3.57 -0.42 -2.56 116.94 118.51 2uxr h PHE 351 Ca 0.30 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.79 2uxr h PHE 351 Cb 0.39 -0.38 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2uxr h PHE 351 CO -0.19 0.66 0.16 0.00 -2.23 0.00 0.00 178.31 176.71 2uxr h ASP 353 N 0.68 0.63 -0.04 0.00 3.32 -1.12 -1.98 116.42 117.92 2uxr h ASP 353 Ca 0.16 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.25 2uxr h ASP 353 Cb 0.27 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2uxr h ASP 353 CO -0.01 0.35 -0.03 0.28 -1.72 0.00 0.00 179.24 178.11 2uxr h SER 354 N 0.75 0.09 -0.60 6.45 0.02 -1.05 -2.28 113.55 116.93 2uxr h SER 354 Ca 0.40 -0.48 -0.05 0.00 -0.84 0.00 0.00 61.79 60.82 2uxr h SER 354 Cb 0.40 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.88 2uxr h SER 354 CO -0.26 0.55 0.21 0.25 -1.14 0.00 0.00 176.83 176.44 2uxr h LEU 355 N -0.37 0.88 -0.32 5.07 5.85 -1.03 0.84 115.31 126.23 2uxr h LEU 355 Ca 0.01 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 2uxr h LEU 355 Cb 0.53 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2uxr h LEU 355 CO 0.01 0.82 0.17 -0.33 -0.34 0.00 0.00 178.44 178.77 2uxr h GLU 356 N 0.93 0.44 -0.73 1.25 5.08 -1.39 -2.32 114.58 117.84 2uxr h GLU 356 Ca 0.21 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2uxr h GLU 356 Cb 0.24 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2uxr h GLU 356 CO -0.01 0.38 0.26 0.00 -1.00 0.00 0.00 179.01 178.64 2uxr h ALA 357 N 1.04 1.08 -0.55 3.43 0.00 -1.07 -2.48 119.26 120.72 2uxr h ALA 357 Ca 0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2uxr h ALA 357 Cb 0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2uxr h ALA 357 CO -0.02 0.64 0.22 0.82 0.00 0.00 0.00 179.25 180.91 2uxr h ILE 358 N 1.07 1.22 -0.10 0.00 2.04 -0.81 -0.31 117.51 120.62 2uxr h ILE 358 Ca 0.24 -0.67 0.04 0.00 1.00 0.00 0.00 64.86 65.47 2uxr h ILE 358 Cb 0.25 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2uxr h ILE 358 CO -0.01 0.26 -0.17 0.74 0.00 0.00 0.00 178.15 178.96 2uxr h THR 359 N 0.75 0.57 0.20 -0.27 2.02 -1.26 0.41 112.91 115.32 2uxr h THR 359 Ca 0.18 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.35 2uxr h THR 359 Cb 0.19 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 2uxr h THR 359 CO -0.02 0.00 -0.10 0.40 0.37 0.00 0.00 175.52 176.18 2uxr h ILE 360 N -0.23 0.85 -0.46 3.11 1.08 -1.41 -2.55 117.51 117.90 2uxr h ILE 360 Ca 0.08 -0.25 -0.02 0.00 -0.39 0.00 0.00 64.86 64.29 2uxr h ILE 360 Cb 0.35 1.00 -0.02 0.00 -3.07 0.00 0.00 36.82 35.08 2uxr h ILE 360 CO -0.23 0.06 0.21 -0.08 -0.69 0.00 0.00 178.15 177.41 2uxr h GLU 361 N -0.39 0.64 0.23 2.37 4.81 -0.96 -1.47 114.58 119.81 2uxr h GLU 361 Ca -0.03 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 2uxr h GLU 361 Cb 0.30 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 2uxr h GLU 361 CO 0.04 0.51 -0.13 0.00 -0.73 0.00 0.00 179.01 178.71 2uxr h ILE 363 N -0.34 1.16 0.00 0.00 2.04 -1.17 -2.76 117.51 116.44 2uxr h ILE 363 Ca -0.03 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.41 2uxr h ILE 363 Cb 0.27 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2uxr h ILE 363 CO 0.04 0.17 -0.14 -0.33 0.00 0.00 0.00 178.15 177.89 2uxr h GLU 364 N 0.65 0.00 0.00 2.37 5.08 -1.24 -0.64 114.58 120.80 2uxr h GLU 364 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2uxr h GLU 364 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2uxr h GLU 364 CO -0.03 0.14 0.00 0.43 -1.00 0.00 0.00 179.01 178.55 2uxr n SER 365 N -4.30 0.00 0.00 1.42 7.64 -0.70 -4.92 113.62 112.76 2uxr n SER 365 Ca -0.03 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.01 2uxr n SER 365 Cb 0.21 -0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 2uxr n SER 365 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2uxr n GLY 366 N 0.44 0.89 3.25 0.23 0.00 -0.25 -4.72 105.19 105.03 2uxr n GLY 366 Ca 0.08 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 2uxr n GLY 366 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uxr s TYR 367 N -2.00 3.28 0.16 1.61 2.02 -1.06 0.04 117.35 121.40 2uxr s TYR 367 Ca 0.00 -1.57 -0.23 0.00 -0.37 0.00 0.00 57.07 54.90 2uxr s TYR 367 Cb 0.00 -2.35 0.07 0.00 -0.40 0.00 0.00 41.96 39.28 2uxr s TYR 367 CO 0.00 -0.77 0.64 0.00 -1.57 0.00 0.00 175.55 173.86 2uxr s MET 368 N 1.36 1.31 0.79 -0.62 0.23 -0.75 -3.55 119.30 118.06 2uxr s MET 368 Ca -0.01 -0.53 -0.12 0.00 -1.03 0.00 0.00 55.69 54.00 2uxr s MET 368 Cb -0.20 0.57 0.06 0.00 -1.53 0.00 0.00 34.83 33.74 2uxr s MET 368 CO 0.02 -0.58 1.14 0.95 -2.03 0.00 0.00 175.02 174.51 2uxr s THR 369 N -3.72 2.63 0.35 3.16 -4.23 -1.26 -0.06 115.64 112.51 2uxr s THR 369 Ca 0.03 0.20 0.08 0.00 -1.18 0.00 0.00 61.69 60.82 2uxr s THR 369 Cb -0.02 -3.14 0.13 0.00 1.34 0.00 0.00 72.50 70.81 2uxr s THR 369 CO -0.10 -0.27 1.85 1.23 -0.54 0.00 0.00 174.62 176.80 2uxr h GLY 370 N -0.98 0.32 0.58 3.99 0.00 -1.75 -2.21 103.07 103.02 2uxr h GLY 370 Ca -0.46 -0.22 0.09 0.00 0.00 0.00 0.00 47.33 46.74 2uxr h GLY 370 CO 0.64 0.20 0.56 1.29 0.00 0.00 0.00 176.54 179.23 2uxr h ASP 371 N 0.27 0.84 0.61 0.19 2.03 -1.94 -2.44 116.42 115.99 2uxr h ASP 371 Ca 0.05 0.04 -0.28 0.00 -0.73 0.00 0.00 57.03 56.11 2uxr h ASP 371 Cb 0.47 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 38.83 2uxr h ASP 371 CO 0.03 0.49 -1.34 -0.07 -1.03 0.00 0.00 179.24 177.32 2uxr h LEU 372 N 0.95 0.32 -1.32 0.15 3.38 -1.82 -3.31 115.31 113.65 2uxr h LEU 372 Ca 0.43 -0.39 0.09 0.00 0.09 0.00 0.00 57.88 58.10 2uxr h LEU 372 Cb 0.33 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 2uxr h LEU 372 CO -0.23 1.31 0.52 0.00 0.09 0.00 0.00 178.44 180.14 2uxr h ALA 373 N 0.64 1.72 0.00 1.53 0.00 -1.24 -0.87 119.26 121.04 2uxr h ALA 373 Ca -0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2uxr h ALA 373 Cb 1.96 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.57 2uxr h ALA 373 CO 0.17 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.55 2uxr h ARG 374 N 0.77 0.00 0.00 0.00 3.08 -1.53 -3.31 114.38 113.40 2uxr h ARG 374 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 2uxr h ARG 374 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2uxr h ARG 374 CO -0.14 0.00 0.00 0.44 -1.07 0.00 0.00 179.97 179.20 2uxr n ILE 375 N -2.99 0.00 -1.67 2.04 -5.35 -0.67 -5.08 119.36 105.64 2uxr n ILE 375 Ca -0.02 -0.17 -0.31 0.00 -0.27 0.00 0.00 62.75 61.98 2uxr n ILE 375 Cb 0.09 1.54 0.05 0.00 -1.74 0.00 0.00 39.64 39.58 2uxr n ILE 375 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2uxr s GLU 377 N -5.12 -0.01 1.10 0.00 2.02 0.37 -4.42 118.70 112.65 2uxr s GLU 377 Ca 0.58 0.47 -0.18 0.00 0.02 0.00 0.00 54.97 55.86 2uxr s GLU 377 Cb -0.13 -0.42 0.25 0.00 0.10 0.00 0.00 34.13 33.93 2uxr s GLU 377 CO 0.54 -0.33 1.21 -1.25 0.02 0.00 0.00 175.26 175.45 2uxr s PRO 378 N 2.24 -0.47 0.66 0.39 0.04 -1.26 -4.61 135.00 131.98 2uxr s PRO 378 Ca 0.04 -0.24 -0.18 0.00 0.04 0.00 0.00 61.00 60.66 2uxr s PRO 378 Cb -0.12 -1.70 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 2uxr s PRO 378 CO -0.05 -3.18 1.18 0.00 0.04 0.00 0.00 177.00 174.99 2uxr n ALA 379 N -4.35 0.74 -1.32 8.56 0.00 -1.26 -4.95 120.51 117.92 2uxr n ALA 379 Ca 0.14 -0.04 -0.35 0.00 0.00 0.00 0.00 53.44 53.20 2uxr n ALA 379 Cb 0.59 -2.25 0.10 0.00 0.00 0.00 0.00 19.45 17.89 2uxr n ALA 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uxr n ALA 380 N -2.02 0.11 0.02 0.00 0.00 -1.26 -4.96 120.51 112.41 2uxr n ALA 380 Ca 0.15 -0.21 -0.21 0.00 0.00 0.00 0.00 53.44 53.17 2uxr n ALA 380 Cb 0.48 -2.21 -0.14 0.00 0.00 0.00 0.00 19.45 17.58 2uxr n ALA 380 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2uxr h ILE 381 N -0.38 1.20 -3.35 0.00 2.04 -0.68 -3.47 117.51 112.87 2uxr h ILE 381 Ca -0.48 -2.45 -0.27 0.00 1.00 0.00 0.00 64.86 62.67 2uxr h ILE 381 Cb 1.32 2.88 -0.33 0.00 -0.74 0.00 0.00 36.82 39.96 2uxr h ILE 381 CO 0.48 0.70 -0.65 -0.54 0.00 0.00 0.00 178.15 178.14 2uxr s LYS 382 N -2.46 0.04 -0.62 2.37 1.02 -0.81 -5.05 119.74 114.23 2uxr s LYS 382 Ca -0.18 0.31 -0.19 0.00 0.02 0.00 0.00 55.97 55.93 2uxr s LYS 382 Cb 0.03 -0.21 0.11 0.00 -0.52 0.00 0.00 37.83 37.23 2uxr s LYS 382 CO 0.79 -0.17 0.75 0.08 -0.92 0.00 0.00 175.35 175.87 2uxr s VAL 383 N 1.19 4.80 0.19 3.17 1.01 -1.26 -1.82 120.40 127.69 2uxr s VAL 383 Ca -0.09 -1.03 -0.19 0.00 0.00 0.00 0.00 61.98 60.67 2uxr s VAL 383 Cb -0.12 -4.52 -0.08 0.00 0.00 0.00 0.00 36.38 31.66 2uxr s VAL 383 CO -0.05 -1.17 0.69 -0.76 0.00 0.00 0.00 175.10 173.81 2uxr s LEU 384 N 2.70 4.39 0.75 3.92 1.43 0.91 -4.93 118.68 127.86 2uxr s LEU 384 Ca 0.14 1.38 -0.12 0.00 -1.03 0.00 0.00 54.13 54.50 2uxr s LEU 384 Cb -0.22 -3.43 0.04 0.00 0.03 0.00 0.00 46.19 42.61 2uxr s LEU 384 CO 0.05 0.09 1.13 1.51 0.23 0.00 0.00 176.35 179.36 2uxr s ASP 385 N -1.55 5.00 0.20 2.29 1.47 -1.26 -4.16 116.67 118.66 2uxr s ASP 385 Ca 0.40 1.02 -0.15 0.00 1.18 0.00 0.00 52.55 54.99 2uxr s ASP 385 Cb -0.17 -1.70 0.20 0.00 -0.34 0.00 0.00 42.92 40.91 2uxr s ASP 385 CO 0.21 -1.62 1.62 0.28 0.68 0.00 0.00 175.17 176.35 2uxr h SER 386 N -0.85 -0.67 -0.48 2.11 0.02 -0.84 -1.16 113.55 111.67 2uxr h SER 386 Ca -0.46 0.19 0.01 0.00 -0.84 0.00 0.00 61.79 60.69 2uxr h SER 386 Cb 1.28 0.41 -0.02 0.00 0.14 0.00 0.00 62.40 64.21 2uxr h SER 386 CO 0.64 -0.22 0.32 0.40 -1.14 0.00 0.00 176.83 176.83 2uxr h ILE 387 N -0.04 1.12 -0.29 3.27 2.04 -1.92 -1.16 117.51 120.53 2uxr h ILE 387 Ca 0.28 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 2uxr h ILE 387 Cb 0.47 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2uxr h ILE 387 CO -0.63 0.12 0.14 -0.33 0.00 0.00 0.00 178.15 177.45 2uxr h GLU 388 N 0.65 0.41 -0.29 2.37 5.08 -1.81 0.38 114.58 121.38 2uxr h GLU 388 Ca 0.18 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.52 2uxr h GLU 388 Cb -0.07 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 2uxr h GLU 388 CO -0.04 0.40 0.03 0.35 -1.00 0.00 0.00 179.01 178.74 2uxr h PHE 389 N 0.33 0.04 -0.45 4.33 3.57 -1.09 0.14 116.94 123.82 2uxr h PHE 389 Ca 0.10 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 2uxr h PHE 389 Cb 0.12 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 2uxr h PHE 389 CO -0.02 -0.01 0.02 0.82 -2.23 0.00 0.00 178.31 176.89 2uxr h ILE 390 N 0.12 1.26 -1.01 1.41 2.04 -1.04 -2.04 117.51 118.26 2uxr h ILE 390 Ca 0.14 -1.00 0.07 0.00 1.00 0.00 0.00 64.86 65.07 2uxr h ILE 390 Cb 0.16 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 37.20 2uxr h ILE 390 CO -0.20 0.35 0.65 0.44 0.00 0.00 0.00 178.15 179.38 2uxr h ASP 391 N 0.63 1.03 -0.25 1.72 3.32 -0.71 -1.08 116.42 121.08 2uxr h ASP 391 Ca 0.13 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2uxr h ASP 391 Cb 0.46 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2uxr h ASP 391 CO 0.02 0.65 0.16 -0.08 -1.72 0.00 0.00 179.24 178.27 2uxr h GLU 392 N 1.16 0.33 -0.49 3.56 4.57 -0.33 0.19 114.58 123.56 2uxr h GLU 392 Ca 0.44 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.55 2uxr h GLU 392 Cb 0.20 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.69 2uxr h GLU 392 CO -0.18 0.23 0.11 -0.07 -1.18 0.00 0.00 179.01 177.92 2uxr h LEU 393 N 0.33 0.69 0.04 1.64 3.38 -1.24 -1.56 115.31 118.58 2uxr h LEU 393 Ca 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2uxr h LEU 393 Cb -0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 2uxr h LEU 393 CO -0.02 0.69 -0.05 1.23 0.09 0.00 0.00 178.44 180.38 2uxr h GLY 394 N 0.92 -0.08 0.19 0.83 0.00 -0.81 -0.46 103.07 103.66 2uxr h GLY 394 Ca 0.16 0.05 0.08 0.00 0.00 0.00 0.00 47.33 47.63 2uxr h GLY 394 CO -0.00 -0.05 -0.10 1.70 0.00 0.00 0.00 176.54 178.09 2uxr h LYS 395 N -0.10 0.00 -0.60 4.80 3.64 -0.46 -1.52 116.57 122.34 2uxr h LYS 395 Ca 0.01 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2uxr h LYS 395 Cb 0.11 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 2uxr h LYS 395 CO -0.02 0.00 0.28 0.00 -2.27 0.00 0.00 179.45 177.44 2uxr h ARG 396 N 0.00 0.84 -0.32 1.90 3.08 -1.09 -1.00 114.38 117.79 2uxr h ARG 396 Ca 0.19 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 2uxr h ARG 396 Cb 0.30 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 2uxr h ARG 396 CO -0.42 0.66 0.19 -0.07 -1.07 0.00 0.00 179.97 179.26 2uxr h LEU 397 N 0.84 0.39 -0.83 3.04 3.38 -0.72 -3.07 115.31 118.34 2uxr h LEU 397 Ca 0.21 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2uxr h LEU 397 Cb 0.10 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 2uxr h LEU 397 CO -0.03 0.34 0.40 1.56 0.09 0.00 0.00 178.44 180.80 2uxr h GLN 398 N 0.41 1.19 -0.62 1.13 4.20 -0.80 -2.84 115.11 117.78 2uxr h GLN 398 Ca 0.11 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2uxr h GLN 398 Cb 0.02 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.59 2uxr h GLN 398 CO -0.02 0.92 0.00 0.94 -0.67 0.00 0.00 178.83 180.00 2uxr n GLN 399 N -4.33 0.49 0.00 1.46 -0.06 -0.42 0.17 117.38 114.69 2uxr n GLN 399 Ca 0.08 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.08 2uxr n GLN 399 Cb 0.14 -1.25 0.00 0.00 -4.06 0.00 0.00 30.24 25.07 2uxr n GLN 399 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 2uxr n LEU 400 N 0.32 0.07 -3.10 1.69 4.77 -1.07 -5.05 117.00 114.63 2uxr n LEU 400 Ca 0.00 -0.33 -0.07 0.00 -0.03 0.00 0.00 56.01 55.58 2uxr n LEU 400 Cb 0.14 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2uxr n LEU 400 CO 0.00 0.02 -0.42 0.59 -1.33 0.00 0.00 177.39 176.25 2uxr n ASN 401 N -0.51 -6.86 -0.17 -1.43 3.02 0.13 -5.15 115.26 104.28 2uxr n ASN 401 Ca 0.00 0.57 0.02 0.00 -0.03 0.00 0.00 54.58 55.14 2uxr n ASN 401 Cb 0.01 -2.81 0.02 0.00 -0.61 0.00 0.00 39.78 36.39 2uxr n ASN 401 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81