#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bxr s MET 13 N 0.00 3.63 0.16 -1.40 -2.45 -1.26 -1.62 119.30 116.35 2bxr s MET 13 Ca 0.00 -0.50 -0.02 0.00 -1.25 0.00 0.00 55.69 53.92 2bxr s MET 13 Cb 0.00 -3.24 -0.04 0.00 1.25 0.00 0.00 34.83 32.80 2bxr s MET 13 CO 0.00 -0.14 0.11 -0.06 1.05 0.00 0.00 175.02 175.98 2bxr s PHE 14 N 1.45 0.92 -0.02 4.11 0.08 -0.69 -5.03 117.98 118.80 2bxr s PHE 14 Ca 0.05 -1.23 -0.21 0.00 0.12 0.00 0.00 56.93 55.66 2bxr s PHE 14 Cb -0.15 -0.45 -0.29 0.00 -0.57 0.00 0.00 43.02 41.56 2bxr s PHE 14 CO 0.02 -0.59 0.99 -0.44 -0.10 0.00 0.00 175.22 175.10 2bxr h ASP 15 N 2.73 0.53 -4.43 1.36 3.32 -0.75 -3.26 116.42 115.92 2bxr h ASP 15 Ca -0.35 -0.87 -0.29 0.00 0.02 0.00 0.00 57.03 55.53 2bxr h ASP 15 Cb 1.22 -0.17 -0.24 0.00 0.22 0.00 0.00 39.33 40.36 2bxr h ASP 15 CO 0.55 1.36 -0.74 0.68 -1.72 0.00 0.00 179.24 179.37 2bxr s VAL 16 N -2.75 0.49 -0.12 -1.35 -7.23 -0.60 -1.44 120.40 107.40 2bxr s VAL 16 Ca -0.13 -0.75 -0.02 0.00 -1.81 0.00 0.00 61.98 59.27 2bxr s VAL 16 Cb 0.02 -0.51 -0.03 0.00 0.56 0.00 0.00 36.38 36.42 2bxr s VAL 16 CO 0.84 -0.19 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.72 2bxr s VAL 17 N -0.89 4.03 -0.25 1.32 1.01 -0.76 -1.39 120.40 123.47 2bxr s VAL 17 Ca -0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 2bxr s VAL 17 Cb -0.07 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 2bxr s VAL 17 CO 0.00 0.55 0.11 -0.69 0.00 0.00 0.00 175.10 175.07 2bxr s VAL 18 N -0.23 4.69 -0.44 2.92 1.01 0.16 -1.59 120.40 126.92 2bxr s VAL 18 Ca 0.05 -0.04 -0.27 0.00 0.00 0.00 0.00 61.98 61.72 2bxr s VAL 18 Cb -0.13 -3.20 0.03 0.00 0.00 0.00 0.00 36.38 33.08 2bxr s VAL 18 CO 0.02 0.32 0.99 -0.63 0.00 0.00 0.00 175.10 175.80 2bxr s ILE 19 N 1.56 4.42 0.00 2.22 1.01 0.02 -1.69 121.20 128.75 2bxr s ILE 19 Ca 0.06 1.00 0.00 0.00 0.00 0.00 0.00 60.65 61.71 2bxr s ILE 19 Cb -0.15 -4.46 0.00 0.00 0.01 0.00 0.00 42.46 37.86 2bxr s ILE 19 CO 0.06 -0.81 0.00 0.61 0.00 0.00 0.00 174.94 174.79 2bxr n GLY 20 N 4.76 1.75 2.65 6.18 0.00 0.53 -0.92 105.19 120.15 2bxr n GLY 20 Ca 0.08 -1.41 -0.28 0.00 0.00 0.00 0.00 46.02 44.42 2bxr n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 21 N 2.88 5.87 0.88 -0.02 0.00 -1.26 -4.13 105.19 109.41 2bxr n GLY 21 Ca 0.00 -2.76 -0.06 0.00 0.00 0.00 0.00 46.02 43.20 2bxr n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 22 N -0.40 -0.19 0.37 -0.02 0.00 -1.26 -1.78 105.19 101.92 2bxr n GLY 22 Ca 0.37 -1.83 0.11 0.00 0.00 0.00 0.00 46.02 44.67 2bxr n GLY 22 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2bxr h ILE 23 N -0.78 0.84 0.50 -0.61 2.04 -1.95 -1.77 117.51 115.77 2bxr h ILE 23 Ca -0.09 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 2bxr h ILE 23 Cb 0.28 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 2bxr h ILE 23 CO 0.08 0.14 -0.24 -1.28 0.00 0.00 0.00 178.15 176.85 2bxr h SER 24 N 0.77 -0.57 -0.63 1.72 0.87 -1.90 0.06 113.55 113.87 2bxr h SER 24 Ca 0.48 -0.06 0.09 0.00 -1.23 0.00 0.00 61.79 61.06 2bxr h SER 24 Cb 0.70 0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 62.73 2bxr h SER 24 CO -0.24 -0.18 0.26 1.23 -0.53 0.00 0.00 176.83 177.37 2bxr h GLY 25 N -1.04 0.89 1.78 5.77 0.00 -1.69 -1.82 103.07 106.95 2bxr h GLY 25 Ca -0.07 -0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.08 2bxr h GLY 25 CO 0.11 0.00 -0.07 1.41 0.00 0.00 0.00 176.54 177.99 2bxr h LEU 26 N 0.45 0.26 -0.06 3.11 3.38 -1.30 -1.43 115.31 119.73 2bxr h LEU 26 Ca 0.31 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 2bxr h LEU 26 Cb 0.37 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 2bxr h LEU 26 CO -0.29 0.38 -0.05 0.28 0.09 0.00 0.00 178.44 178.85 2bxr h SER 27 N 0.27 0.15 -0.38 -0.43 0.02 -0.16 -0.99 113.55 112.03 2bxr h SER 27 Ca 0.06 -0.47 0.07 0.00 -0.84 0.00 0.00 61.79 60.61 2bxr h SER 27 Cb 0.31 -0.04 -0.09 0.00 0.14 0.00 0.00 62.40 62.72 2bxr h SER 27 CO 0.01 0.58 -0.37 0.00 -1.14 0.00 0.00 176.83 175.91 2bxr h ALA 28 N 0.57 -0.31 -0.85 3.77 0.00 -1.32 -1.53 119.26 119.59 2bxr h ALA 28 Ca 0.01 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.09 2bxr h ALA 28 Cb 0.54 0.79 -0.07 0.00 0.00 0.00 0.00 17.79 19.04 2bxr h ALA 28 CO 0.01 -0.80 0.50 0.00 0.00 0.00 0.00 179.25 178.97 2bxr h ALA 29 N 0.58 1.21 -0.27 0.00 0.00 -1.03 -0.68 119.26 119.07 2bxr h ALA 29 Ca 0.15 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2bxr h ALA 29 Cb 0.56 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2bxr h ALA 29 CO -0.54 0.14 -0.24 -0.22 0.00 0.00 0.00 179.25 178.40 2bxr h LYS 30 N 0.85 0.63 0.40 0.00 3.64 -0.62 0.63 116.57 122.11 2bxr h LYS 30 Ca 0.40 -0.32 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 2bxr h LYS 30 Cb 0.34 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2bxr h LYS 30 CO -0.24 0.92 -0.19 1.25 -2.27 0.00 0.00 179.45 178.92 2bxr h LEU 31 N 0.36 -0.46 -0.86 5.20 5.85 -0.75 0.21 115.31 124.86 2bxr h LEU 31 Ca 0.05 -0.07 0.21 0.00 0.84 0.00 0.00 57.88 58.92 2bxr h LEU 31 Cb 0.79 0.12 -0.13 0.00 0.37 0.00 0.00 40.66 41.81 2bxr h LEU 31 CO 0.06 -0.21 0.29 -0.07 -0.34 0.00 0.00 178.44 178.17 2bxr h LEU 32 N -0.70 0.14 -0.31 2.25 3.38 -1.08 0.18 115.31 119.17 2bxr h LEU 32 Ca -0.06 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2bxr h LEU 32 Cb 0.50 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2bxr h LEU 32 CO 0.09 -0.07 0.17 0.74 0.09 0.00 0.00 178.44 179.46 2bxr h THR 33 N 0.30 1.13 -1.22 0.22 2.02 -0.44 -1.78 112.91 113.14 2bxr h THR 33 Ca 0.53 -0.36 0.35 0.00 0.77 0.00 0.00 66.41 67.71 2bxr h THR 33 Cb 1.02 0.81 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 2bxr h THR 33 CO -0.58 0.14 0.89 -0.33 0.37 0.00 0.00 175.52 176.01 2bxr h GLU 34 N 0.38 0.00 -0.67 6.66 4.39 0.14 0.31 114.58 125.79 2bxr h GLU 34 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2bxr h GLU 34 Cb 0.07 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2bxr h GLU 34 CO -0.02 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.49 2bxr n TYR 35 N -4.13 1.26 -1.14 4.33 4.01 -0.86 -4.94 117.16 115.70 2bxr n TYR 35 Ca 0.26 -0.54 -0.05 0.00 -0.16 0.00 0.00 57.90 57.42 2bxr n TYR 35 Cb 1.29 -0.16 -0.02 0.00 -0.31 0.00 0.00 39.34 40.14 2bxr n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2bxr n GLY 36 N 1.29 0.75 3.76 2.72 0.00 0.11 -5.01 105.19 108.81 2bxr n GLY 36 Ca 0.24 -0.63 -0.40 0.00 0.00 0.00 0.00 46.02 45.24 2bxr n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bxr s VAL 37 N -2.13 4.50 -0.55 1.61 1.01 -0.73 -5.02 120.40 119.11 2bxr s VAL 37 Ca 0.00 1.68 -0.28 0.00 0.00 0.00 0.00 61.98 63.38 2bxr s VAL 37 Cb 0.00 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 32.27 2bxr s VAL 37 CO 0.00 0.46 1.25 -0.55 0.00 0.00 0.00 175.10 176.26 2bxr s SER 38 N -0.73 6.41 0.01 3.32 0.15 -1.26 -4.19 113.70 117.41 2bxr s SER 38 Ca 0.37 0.26 0.06 0.00 0.70 0.00 0.00 55.95 57.35 2bxr s SER 38 Cb -0.22 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.51 2bxr s SER 38 CO 0.25 -1.49 -0.18 -0.69 1.20 0.00 0.00 173.24 172.34 2bxr s VAL 39 N 5.13 2.77 -0.01 4.45 1.01 -1.26 -0.02 120.40 132.46 2bxr s VAL 39 Ca 0.47 -1.05 0.04 0.00 0.00 0.00 0.00 61.98 61.44 2bxr s VAL 39 Cb -0.08 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 2bxr s VAL 39 CO 0.27 0.44 -0.13 -0.22 0.00 0.00 0.00 175.10 175.46 2bxr s LEU 40 N -1.15 1.99 -0.22 3.92 2.96 -0.48 -4.85 118.68 120.84 2bxr s LEU 40 Ca 0.13 -0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 53.80 2bxr s LEU 40 Cb -0.10 -0.68 0.02 0.00 0.50 0.00 0.00 46.19 45.93 2bxr s LEU 40 CO 0.03 0.15 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.41 2bxr s VAL 41 N -0.22 2.60 -0.27 1.68 1.01 0.32 0.38 120.40 125.91 2bxr s VAL 41 Ca 0.03 -0.96 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 2bxr s VAL 41 Cb -0.06 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 2bxr s VAL 41 CO -0.00 0.34 0.22 -0.76 0.00 0.00 0.00 175.10 174.90 2bxr s LEU 42 N 1.32 4.05 -0.14 3.92 1.43 -0.68 0.19 118.68 128.77 2bxr s LEU 42 Ca 0.02 0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 53.21 2bxr s LEU 42 Cb -0.15 -2.18 0.03 0.00 0.03 0.00 0.00 46.19 43.91 2bxr s LEU 42 CO -0.07 -0.05 -0.10 -0.70 0.23 0.00 0.00 176.35 175.66 2bxr s GLU 43 N 1.62 1.88 0.20 1.70 2.56 -0.30 -0.35 118.70 126.02 2bxr s GLU 43 Ca 0.09 -0.44 -0.11 0.00 0.00 0.00 0.00 54.97 54.51 2bxr s GLU 43 Cb -0.15 -1.89 0.27 0.00 2.00 0.00 0.00 34.13 34.35 2bxr s GLU 43 CO 0.09 -0.28 1.69 0.00 -0.56 0.00 0.00 175.26 176.20 2bxr h ALA 44 N 8.11 0.62 -2.17 6.30 0.00 -1.84 -1.22 119.26 129.06 2bxr h ALA 44 Ca -0.33 0.15 -0.44 0.00 0.00 0.00 0.00 54.91 54.29 2bxr h ALA 44 Cb 1.13 0.23 0.17 0.00 0.00 0.00 0.00 17.79 19.32 2bxr h ALA 44 CO 0.46 -0.35 0.24 1.03 0.00 0.00 0.00 179.25 180.63 2bxr s ARG 45 N -6.13 -0.11 -0.12 0.00 0.52 -1.26 -3.33 118.95 108.52 2bxr s ARG 45 Ca -0.13 0.01 0.10 0.00 -0.52 0.00 0.00 55.73 55.18 2bxr s ARG 45 Cb 0.18 -1.72 0.49 0.00 0.52 0.00 0.00 34.95 34.41 2bxr s ARG 45 CO 0.73 -2.98 1.29 -0.40 0.02 0.00 0.00 175.30 173.96 2bxr n ASP 46 N -4.26 3.64 -3.82 0.23 5.75 -1.26 -0.31 116.55 116.53 2bxr n ASP 46 Ca 0.11 -2.46 -0.09 0.00 -0.01 0.00 0.00 54.79 52.34 2bxr n ASP 46 Cb 0.59 -0.55 -0.07 0.00 -1.03 0.00 0.00 41.12 40.06 2bxr n ASP 46 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bxr s ARG 47 N -1.95 0.90 0.78 0.11 1.70 -1.26 -4.96 118.95 114.27 2bxr s ARG 47 Ca 0.33 -0.92 -0.05 0.00 -0.47 0.00 0.00 55.73 54.62 2bxr s ARG 47 Cb 0.24 0.37 0.14 0.00 -0.57 0.00 0.00 34.95 35.12 2bxr s ARG 47 CO 0.12 -0.30 1.08 0.14 -1.08 0.00 0.00 175.30 175.26 2bxr s VAL 48 N -3.85 2.12 0.00 4.99 -7.23 -1.26 -4.71 120.40 110.46 2bxr s VAL 48 Ca 0.05 -0.40 0.00 0.00 -1.81 0.00 0.00 61.98 59.82 2bxr s VAL 48 Cb 0.04 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.26 2bxr s VAL 48 CO -0.11 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.29 2bxr n GLY 49 N -3.09 2.35 7.00 2.32 0.00 -0.73 -4.90 105.19 108.14 2bxr n GLY 49 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2bxr n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 50 N -0.35 2.98 0.00 -0.02 0.00 -1.26 0.02 105.19 106.56 2bxr n GLY 50 Ca 0.00 0.30 0.11 0.00 0.00 0.00 0.00 46.02 46.42 2bxr n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bxr n ARG 51 N 9.30 0.78 -4.76 1.61 1.74 -1.26 -4.36 116.66 119.71 2bxr n ARG 51 Ca 0.00 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 56.75 2bxr n ARG 51 Cb 0.00 -1.43 -0.13 0.00 -1.02 0.00 0.00 32.46 29.88 2bxr n ARG 51 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2bxr s THR 52 N -2.00 3.21 -0.29 0.55 -4.23 0.10 -0.79 115.64 112.19 2bxr s THR 52 Ca 0.32 -0.63 -0.10 0.00 -1.18 0.00 0.00 61.69 60.10 2bxr s THR 52 Cb 0.15 -2.32 0.12 0.00 1.34 0.00 0.00 72.50 71.79 2bxr s THR 52 CO 0.25 0.55 0.64 -0.47 -0.54 0.00 0.00 174.62 175.04 2bxr s TYR 53 N -0.14 -1.29 -0.30 3.99 5.04 -1.26 -4.41 117.35 118.98 2bxr s TYR 53 Ca -0.00 2.27 -0.05 0.00 -2.44 0.00 0.00 57.07 56.85 2bxr s TYR 53 Cb -0.13 0.76 0.03 0.00 0.35 0.00 0.00 41.96 42.97 2bxr s TYR 53 CO 0.03 -0.65 0.05 0.99 -1.34 0.00 0.00 175.55 174.63 2bxr s THR 54 N 2.81 3.55 0.15 4.34 2.01 -1.26 0.08 115.64 127.32 2bxr s THR 54 Ca -0.06 -0.97 -0.24 0.00 0.31 0.00 0.00 61.69 60.72 2bxr s THR 54 Cb -0.12 -2.90 -0.08 0.00 0.01 0.00 0.00 72.50 69.41 2bxr s THR 54 CO -0.19 0.01 0.75 -0.63 -0.69 0.00 0.00 174.62 173.87 2bxr s ILE 55 N 1.40 4.43 -0.10 1.82 1.01 -0.59 -4.84 121.20 124.34 2bxr s ILE 55 Ca -0.00 1.63 0.00 0.00 0.00 0.00 0.00 60.65 62.29 2bxr s ILE 55 Cb -0.18 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.21 2bxr s ILE 55 CO 0.01 0.52 -0.08 -0.13 0.00 0.00 0.00 174.94 175.26 2bxr s ARG 56 N -1.10 1.48 0.11 2.79 0.52 -1.26 -0.70 118.95 120.80 2bxr s ARG 56 Ca 0.35 -0.27 -0.25 0.00 -0.52 0.00 0.00 55.73 55.04 2bxr s ARG 56 Cb -0.23 -1.47 0.07 0.00 0.52 0.00 0.00 34.95 33.85 2bxr s ARG 56 CO 0.25 -0.19 0.79 0.54 0.02 0.00 0.00 175.30 176.72 2bxr s ASN 57 N 1.42 -0.38 0.57 0.23 2.20 -1.06 -4.99 114.94 112.93 2bxr s ASN 57 Ca -0.01 -0.15 0.32 0.00 -0.94 0.00 0.00 52.86 52.08 2bxr s ASN 57 Cb -0.13 0.51 1.74 0.00 -2.00 0.00 0.00 41.25 41.37 2bxr s ASN 57 CO -0.05 -0.87 2.18 -0.08 -2.94 0.00 0.00 177.10 175.34 2bxr h GLU 58 N 2.00 0.00 -0.14 3.55 4.22 -2.01 0.20 114.58 122.41 2bxr h GLU 58 Ca -0.26 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.05 2bxr h GLU 58 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2bxr h GLU 58 CO 0.31 0.05 -0.47 0.45 -2.18 0.00 0.00 179.01 177.17 2bxr h HIS 59 N 0.00 0.42 0.00 0.92 3.86 -2.02 -3.35 115.15 114.98 2bxr h HIS 59 Ca -0.00 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.08 2bxr h HIS 59 Cb 0.18 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.57 2bxr h HIS 59 CO 0.00 0.75 0.00 1.33 0.86 0.00 0.00 177.93 180.87 2bxr n VAL 60 N -3.98 0.00 0.00 2.45 0.24 -0.06 -5.00 118.33 111.98 2bxr n VAL 60 Ca -0.02 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2bxr n VAL 60 Cb 0.53 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.94 2bxr n VAL 60 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2bxr n ASP 61 N -0.13 0.00 -3.62 -1.34 -0.08 0.50 -4.48 116.55 107.40 2bxr n ASP 61 Ca 0.00 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.15 2bxr n ASP 61 Cb 0.01 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.41 2bxr n ASP 61 CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 2bxr s TYR 62 N 0.00 -0.32 -0.28 -0.67 -0.85 -1.26 -2.57 117.35 111.40 2bxr s TYR 62 Ca 0.00 0.25 -0.17 0.00 -0.52 0.00 0.00 57.07 56.62 2bxr s TYR 62 Cb 0.00 0.28 0.09 0.00 0.38 0.00 0.00 41.96 42.70 2bxr s TYR 62 CO 0.00 -0.63 0.72 0.54 -1.52 0.00 0.00 175.55 174.66 2bxr s VAL 63 N -2.76 0.00 -0.16 -3.49 0.11 0.13 -4.98 120.40 109.25 2bxr s VAL 63 Ca -0.03 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.72 2bxr s VAL 63 Cb -0.00 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.81 2bxr s VAL 63 CO -0.04 0.00 1.58 -1.81 -3.33 0.00 0.00 175.10 171.50 2bxr s ASP 64 N 1.45 6.54 0.00 3.54 1.01 -1.26 -1.54 116.67 126.41 2bxr s ASP 64 Ca -0.09 1.83 0.14 0.00 0.71 0.00 0.00 52.55 55.14 2bxr s ASP 64 Cb -0.05 -2.53 0.41 0.00 1.01 0.00 0.00 42.92 41.76 2bxr s ASP 64 CO -0.17 -1.09 1.33 1.33 0.21 0.00 0.00 175.17 176.79 2bxr n VAL 65 N 5.98 0.52 -0.30 -1.27 0.24 0.11 -4.94 118.33 118.67 2bxr n VAL 65 Ca 0.18 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 2bxr n VAL 65 Cb 0.44 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 33.12 2bxr n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bxr n GLY 66 N 1.17 5.49 3.66 7.63 0.00 -1.24 -4.61 105.19 117.28 2bxr n GLY 66 Ca 0.14 -1.19 -0.46 0.00 0.00 0.00 0.00 46.02 44.51 2bxr n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 67 N 1.89 0.99 0.00 -0.02 0.00 0.03 -4.86 105.19 103.23 2bxr n GLY 67 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 2bxr n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bxr n ALA 68 N 2.99 1.76 -2.73 4.61 0.00 -1.26 -4.69 120.51 121.19 2bxr n ALA 68 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.24 2bxr n ALA 68 Cb 0.29 0.13 -0.07 0.00 0.00 0.00 0.00 19.45 19.79 2bxr n ALA 68 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2bxr s TYR 69 N -1.31 3.44 -0.02 0.00 2.02 -1.26 -4.24 117.35 115.99 2bxr s TYR 69 Ca 0.00 0.48 0.06 0.00 -0.37 0.00 0.00 57.07 57.23 2bxr s TYR 69 Cb 0.00 -2.26 -0.01 0.00 -0.40 0.00 0.00 41.96 39.29 2bxr s TYR 69 CO 0.00 0.27 -0.18 0.14 -1.57 0.00 0.00 175.55 174.20 2bxr s VAL 70 N 0.40 1.45 0.58 0.71 -7.23 0.57 -4.90 120.40 111.98 2bxr s VAL 70 Ca 0.13 -0.78 0.08 0.00 -1.81 0.00 0.00 61.98 59.60 2bxr s VAL 70 Cb -0.12 -1.21 0.08 0.00 0.56 0.00 0.00 36.38 35.69 2bxr s VAL 70 CO 0.01 0.41 0.64 0.61 -0.31 0.00 0.00 175.10 176.46 2bxr n GLY 71 N 2.67 2.31 3.73 2.32 0.00 -1.26 -1.83 105.19 113.13 2bxr n GLY 71 Ca -0.15 -2.26 -0.30 0.00 0.00 0.00 0.00 46.02 43.31 2bxr n GLY 71 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bxr s PRO 72 N -4.52 -0.50 0.00 1.61 0.04 -1.26 -2.98 135.00 127.39 2bxr s PRO 72 Ca 0.49 -0.22 0.00 0.00 0.04 0.00 0.00 61.00 61.31 2bxr s PRO 72 Cb -0.04 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.81 2bxr s PRO 72 CO 0.31 -3.20 0.00 0.25 0.04 0.00 0.00 177.00 174.40 2bxr n THR 73 N -4.37 0.00 -1.68 1.26 -2.24 -1.26 -4.87 114.28 101.12 2bxr n THR 73 Ca 0.14 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.59 2bxr n THR 73 Cb 0.59 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.79 2bxr n THR 73 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bxr n GLN 74 N -1.48 3.61 0.24 -0.78 6.02 -1.16 -4.77 117.38 119.07 2bxr n GLN 74 Ca 0.00 -2.78 0.17 0.00 -0.01 0.00 0.00 57.00 54.38 2bxr n GLN 74 Cb 0.00 -2.45 0.82 0.00 1.02 0.00 0.00 30.24 29.63 2bxr n GLN 74 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2bxr h ASN 75 N 4.02 0.00 0.38 1.08 2.35 -1.89 -3.05 115.58 118.46 2bxr h ASN 75 Ca 0.59 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.32 2bxr h ASN 75 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2bxr h ASN 75 CO 1.22 0.00 -0.18 0.03 -1.65 0.00 0.00 177.43 176.85 2bxr h ARG 76 N 0.00 -0.49 0.00 0.81 2.47 -1.91 -1.91 114.38 113.35 2bxr h ARG 76 Ca 0.00 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.73 2bxr h ARG 76 Cb 0.17 0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.59 2bxr h ARG 76 CO 0.00 -0.18 -0.13 0.97 0.56 0.00 0.00 179.97 181.19 2bxr h ILE 77 N -0.88 0.43 -0.10 2.04 6.09 -1.85 -0.91 117.51 122.33 2bxr h ILE 77 Ca -0.05 -0.72 -0.13 0.00 -1.37 0.00 0.00 64.86 62.59 2bxr h ILE 77 Cb 0.54 1.51 0.01 0.00 0.47 0.00 0.00 36.82 39.35 2bxr h ILE 77 CO 0.09 0.13 -0.43 -0.07 -3.07 0.00 0.00 178.15 174.79 2bxr h LEU 78 N 0.00 0.54 -0.49 2.19 3.38 -1.54 -1.65 115.31 117.75 2bxr h LEU 78 Ca -0.00 -0.64 -0.08 0.00 0.09 0.00 0.00 57.88 57.25 2bxr h LEU 78 Cb 0.50 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2bxr h LEU 78 CO 0.02 1.09 0.01 -0.09 0.09 0.00 0.00 178.44 179.56 2bxr h ARG 79 N 0.03 0.86 0.48 1.13 2.43 -1.00 -1.52 114.38 116.79 2bxr h ARG 79 Ca -0.03 -0.27 -0.02 0.00 -0.81 0.00 0.00 59.98 58.85 2bxr h ARG 79 Cb 1.08 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2bxr h ARG 79 CO 0.09 0.89 -0.23 1.25 -1.51 0.00 0.00 179.97 180.46 2bxr h LEU 80 N 0.72 -0.54 -1.52 3.80 5.85 -1.23 -1.60 115.31 120.79 2bxr h LEU 80 Ca 0.14 -0.08 0.15 0.00 0.84 0.00 0.00 57.88 58.94 2bxr h LEU 80 Cb 0.50 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.62 2bxr h LEU 80 CO 0.02 -0.16 0.53 0.77 -0.34 0.00 0.00 178.44 179.26 2bxr h SER 81 N -1.01 0.44 -0.28 1.25 4.64 -1.35 1.00 113.55 118.24 2bxr h SER 81 Ca -0.07 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 2bxr h SER 81 Cb 0.59 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2bxr h SER 81 CO 0.11 0.22 -0.34 0.50 -0.87 0.00 0.00 176.83 176.46 2bxr h LYS 82 N 0.47 0.73 -0.41 4.77 3.64 -1.09 0.54 116.57 125.22 2bxr h LYS 82 Ca 0.39 -0.40 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2bxr h LYS 82 Cb 0.85 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.67 2bxr h LYS 82 CO -0.14 1.02 0.25 1.49 -2.27 0.00 0.00 179.45 179.81 2bxr h GLU 83 N 0.47 0.55 0.00 1.90 4.81 -0.08 -0.08 114.58 122.15 2bxr h GLU 83 Ca 0.04 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2bxr h GLU 83 Cb 0.92 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.18 2bxr h GLU 83 CO 0.08 0.40 0.00 1.28 -0.73 0.00 0.00 179.01 180.04 2bxr n LEU 84 N -4.77 0.00 -0.17 1.64 4.77 0.18 -4.84 117.00 113.82 2bxr n LEU 84 Ca 0.01 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2bxr n LEU 84 Cb 0.05 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2bxr n LEU 84 CO 0.35 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 2bxr n GLY 85 N -0.52 0.57 3.49 -0.72 0.00 -0.04 -5.04 105.19 102.93 2bxr n GLY 85 Ca 0.05 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.90 2bxr n GLY 85 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bxr s ILE 86 N -2.34 4.18 0.56 -0.61 1.01 0.08 -5.02 121.20 119.07 2bxr s ILE 86 Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 2bxr s ILE 86 Cb 0.00 -2.90 -0.01 0.00 0.01 0.00 0.00 42.46 39.56 2bxr s ILE 86 CO 0.00 0.42 0.89 -1.61 0.00 0.00 0.00 174.94 174.64 2bxr s GLU 87 N 0.97 3.24 0.35 2.79 0.41 -1.26 -4.13 118.70 121.07 2bxr s GLU 87 Ca 0.02 0.22 0.08 0.00 -0.41 0.00 0.00 54.97 54.88 2bxr s GLU 87 Cb -0.14 -2.26 -0.07 0.00 -1.78 0.00 0.00 34.13 29.88 2bxr s GLU 87 CO 0.02 -0.53 -0.05 0.95 -0.49 0.00 0.00 175.26 175.16 2bxr s THR 88 N -2.96 2.00 0.02 3.63 -4.23 -1.26 -1.60 115.64 111.25 2bxr s THR 88 Ca 0.52 -2.13 -0.00 0.00 -1.18 0.00 0.00 61.69 58.90 2bxr s THR 88 Cb -0.11 -2.71 -0.02 0.00 1.34 0.00 0.00 72.50 71.01 2bxr s THR 88 CO 0.47 -0.16 -0.02 -0.72 -0.54 0.00 0.00 174.62 173.65 2bxr s TYR 89 N -2.75 0.23 -0.18 3.99 -0.85 -0.46 -4.76 117.35 112.57 2bxr s TYR 89 Ca 0.33 -0.48 -0.29 0.00 -0.52 0.00 0.00 57.07 56.11 2bxr s TYR 89 Cb 0.05 -0.17 -0.02 0.00 0.38 0.00 0.00 41.96 42.20 2bxr s TYR 89 CO 0.16 -0.19 1.36 0.15 -1.52 0.00 0.00 175.55 175.51 2bxr s LYS 90 N -1.38 4.12 0.03 -3.49 1.02 -1.26 -1.75 119.74 117.02 2bxr s LYS 90 Ca -0.15 1.66 -0.30 0.00 0.02 0.00 0.00 55.97 57.20 2bxr s LYS 90 Cb -0.09 -3.84 -0.08 0.00 -0.52 0.00 0.00 37.83 33.29 2bxr s LYS 90 CO -0.01 -0.86 1.77 0.08 -0.92 0.00 0.00 175.35 175.42 2bxr s VAL 91 N 3.90 3.15 -0.16 3.17 1.01 0.26 -4.86 120.40 126.88 2bxr s VAL 91 Ca 0.59 0.36 -0.29 0.00 0.00 0.00 0.00 61.98 62.64 2bxr s VAL 91 Cb -0.23 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 32.87 2bxr s VAL 91 CO 0.20 -0.02 1.88 0.21 0.00 0.00 0.00 175.10 177.37 2bxr s ASN 92 N 3.40 6.12 -0.63 3.32 3.84 -1.26 -4.56 114.94 125.16 2bxr s ASN 92 Ca 0.79 1.96 0.03 0.00 0.21 0.00 0.00 52.86 55.85 2bxr s ASN 92 Cb -0.39 -2.53 0.38 0.00 -0.55 0.00 0.00 41.25 38.16 2bxr s ASN 92 CO 0.35 -1.42 1.38 0.52 -2.79 0.00 0.00 177.10 175.13 2bxr n VAL 93 N 6.60 3.20 -0.10 -5.21 0.31 -1.26 -4.66 118.33 117.21 2bxr n VAL 93 Ca 0.22 -5.02 -0.05 0.00 -0.01 0.00 0.00 64.34 59.48 2bxr n VAL 93 Cb 0.44 -1.32 0.01 0.00 -0.91 0.00 0.00 33.84 32.06 2bxr n VAL 93 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2bxr h SER 94 N 2.93 -0.42 0.00 4.52 0.02 -1.89 -3.47 113.55 115.24 2bxr h SER 94 Ca 0.36 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 2bxr h SER 94 Cb 0.56 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2bxr h SER 94 CO 1.02 -0.15 0.00 -0.62 -1.14 0.00 0.00 176.83 175.94 2bxr n GLU 95 N -5.31 1.36 -3.14 3.45 4.71 -1.26 -4.99 120.64 115.45 2bxr n GLU 95 Ca 0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 57.16 56.77 2bxr n GLU 95 Cb 0.23 0.00 -0.05 0.00 -1.01 0.00 0.00 31.44 30.60 2bxr n GLU 95 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2bxr s ARG 96 N 4.64 4.31 0.60 3.49 0.52 -1.18 -4.60 118.95 126.73 2bxr s ARG 96 Ca 0.00 0.66 -0.18 0.00 -0.52 0.00 0.00 55.73 55.69 2bxr s ARG 96 Cb 0.00 -3.50 -0.03 0.00 0.52 0.00 0.00 34.95 31.94 2bxr s ARG 96 CO 0.00 -0.05 1.16 -0.51 0.02 0.00 0.00 175.30 175.92 2bxr s LEU 97 N 1.26 3.61 -0.11 2.53 1.02 -1.26 -1.83 118.68 123.90 2bxr s LEU 97 Ca 0.31 2.23 0.03 0.00 0.02 0.00 0.00 54.13 56.73 2bxr s LEU 97 Cb -0.16 -4.58 0.00 0.00 0.02 0.00 0.00 46.19 41.47 2bxr s LEU 97 CO 0.13 -1.53 -0.22 -0.69 0.02 0.00 0.00 176.35 174.05 2bxr s VAL 98 N -1.84 1.99 0.01 -1.59 1.01 -0.97 -1.49 120.40 117.52 2bxr s VAL 98 Ca 0.73 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 2bxr s VAL 98 Cb -0.26 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2bxr s VAL 98 CO 0.34 0.54 0.10 -1.58 0.00 0.00 0.00 175.10 174.50 2bxr s GLN 99 N 0.54 3.11 -0.24 2.72 0.74 0.25 -1.21 119.66 125.56 2bxr s GLN 99 Ca -0.14 -0.48 0.02 0.00 0.05 0.00 0.00 55.36 54.81 2bxr s GLN 99 Cb -0.17 -2.89 0.05 0.00 1.10 0.00 0.00 33.01 31.11 2bxr s GLN 99 CO 0.05 0.64 -0.10 -0.47 -0.55 0.00 0.00 175.29 174.86 2bxr s TYR 100 N -1.24 2.91 -0.03 1.67 5.04 0.03 -0.36 117.35 125.37 2bxr s TYR 100 Ca 0.24 -2.05 -0.00 0.00 -2.44 0.00 0.00 57.07 52.83 2bxr s TYR 100 Cb -0.12 -1.81 0.03 0.00 0.35 0.00 0.00 41.96 40.41 2bxr s TYR 100 CO 0.16 -0.83 0.02 0.08 -1.34 0.00 0.00 175.55 173.64 2bxr s VAL 101 N 1.22 0.04 -1.26 3.14 1.01 -1.19 -1.17 120.40 122.20 2bxr s VAL 101 Ca -0.06 0.21 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 2bxr s VAL 101 Cb -0.19 -0.19 0.00 0.00 0.00 0.00 0.00 36.38 36.00 2bxr s VAL 101 CO -0.06 0.14 1.05 0.29 0.00 0.00 0.00 175.10 176.52 2bxr n LYS 102 N 4.46 -7.02 0.00 2.72 4.01 -1.26 -3.76 118.16 117.31 2bxr n LYS 102 Ca -0.21 0.84 0.00 0.00 -0.51 0.00 0.00 58.31 58.43 2bxr n LYS 102 Cb 0.50 -5.86 0.00 0.00 -0.51 0.00 0.00 35.03 29.16 2bxr n LYS 102 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2bxr n GLY 103 N -1.42 1.92 3.27 0.72 0.00 -1.26 -5.00 105.19 103.42 2bxr n GLY 103 Ca -0.19 -0.49 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 2bxr n GLY 103 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2bxr n LYS 104 N 0.00 -3.45 -3.94 1.61 -0.00 -1.25 -5.03 118.16 106.10 2bxr n LYS 104 Ca 0.00 -1.60 -0.12 0.00 -0.00 0.00 0.00 58.31 56.59 2bxr n LYS 104 Cb 0.00 -1.62 -0.13 0.00 -0.00 0.00 0.00 35.03 33.28 2bxr n LYS 104 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2bxr s THR 105 N -2.69 0.11 -0.07 0.58 -4.23 -1.26 -3.14 115.64 104.93 2bxr s THR 105 Ca 0.67 -0.30 0.03 0.00 -1.18 0.00 0.00 61.69 60.91 2bxr s THR 105 Cb -0.08 -0.15 0.00 0.00 1.34 0.00 0.00 72.50 73.62 2bxr s THR 105 CO 0.52 -0.12 -0.17 -0.31 -0.54 0.00 0.00 174.62 174.00 2bxr s TYR 106 N -0.44 1.85 -0.29 3.99 2.02 0.52 -4.97 117.35 120.03 2bxr s TYR 106 Ca -0.04 -0.66 -0.10 0.00 -0.37 0.00 0.00 57.07 55.89 2bxr s TYR 106 Cb -0.03 -1.28 -0.03 0.00 -0.40 0.00 0.00 41.96 40.22 2bxr s TYR 106 CO -0.00 -0.28 0.17 -1.25 -1.57 0.00 0.00 175.55 172.62 2bxr s PRO 107 N 0.37 3.66 0.00 -1.71 0.04 -1.26 0.84 135.00 136.95 2bxr s PRO 107 Ca -0.12 -0.51 0.00 0.00 0.04 0.00 0.00 61.00 60.41 2bxr s PRO 107 Cb -0.15 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.77 2bxr s PRO 107 CO 0.05 -0.29 0.00 1.19 0.04 0.00 0.00 177.00 177.98 2bxr n PHE 108 N 5.03 0.00 0.00 0.56 3.01 -0.55 -4.97 117.46 120.54 2bxr n PHE 108 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.32 2bxr n PHE 108 Cb 0.51 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.98 2bxr n PHE 108 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 2bxr n ARG 109 N 0.00 0.00 0.00 -1.08 -4.01 -1.26 -4.25 116.66 106.06 2bxr n ARG 109 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 2bxr n ARG 109 Cb 0.00 -0.15 0.00 0.00 -3.04 0.00 0.00 32.46 29.27 2bxr n ARG 109 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2bxr n GLY 110 N 0.62 -0.16 0.50 2.89 0.00 -1.26 -5.03 105.19 102.74 2bxr n GLY 110 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2bxr n GLY 110 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2bxr n TRP 116 N 0.00 0.00 -3.39 1.61 -0.00 -1.26 -5.07 117.44 109.33 2bxr n TRP 116 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 57.50 57.10 2bxr n TRP 116 Cb 0.00 0.10 -0.09 0.00 -0.00 0.00 0.00 31.31 31.32 2bxr n TRP 116 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 2bxr s ASN 117 N -0.50 6.21 0.00 5.87 2.47 -1.26 -5.04 114.94 122.68 2bxr s ASN 117 Ca 0.00 -0.03 0.00 0.00 0.42 0.00 0.00 52.86 53.25 2bxr s ASN 117 Cb 0.00 -2.20 0.00 0.00 -1.45 0.00 0.00 41.25 37.60 2bxr s ASN 117 CO 0.00 -0.29 0.15 -2.65 -3.72 0.00 0.00 177.10 170.59 2bxr n PRO 118 N 5.38 0.00 -0.46 0.43 -0.02 -1.26 0.51 135.00 139.59 2bxr n PRO 118 Ca -0.09 0.15 0.39 0.00 -2.02 0.00 0.00 63.50 61.93 2bxr n PRO 118 Cb 0.50 -0.48 0.71 0.00 -0.02 0.00 0.00 33.50 34.21 2bxr n PRO 118 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2bxr h ILE 119 N 0.00 0.24 0.00 4.25 2.10 -1.98 0.43 117.51 122.55 2bxr h ILE 119 Ca 0.00 -0.03 -0.14 0.00 1.08 0.00 0.00 64.86 65.77 2bxr h ILE 119 Cb 0.00 0.16 -0.02 0.00 -1.09 0.00 0.00 36.82 35.87 2bxr h ILE 119 CO 0.00 0.01 -0.67 0.00 -1.08 0.00 0.00 178.15 176.42 2bxr h ALA 120 N 1.38 0.63 0.06 0.18 0.00 -1.77 -1.59 119.26 118.15 2bxr h ALA 120 Ca 0.73 -0.61 -0.30 0.00 0.00 0.00 0.00 54.91 54.73 2bxr h ALA 120 Cb 2.65 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 20.30 2bxr h ALA 120 CO -0.15 0.83 -1.66 0.10 0.00 0.00 0.00 179.25 178.38 2bxr h TYR 121 N 0.00 0.21 -0.85 0.00 -0.00 0.44 0.14 116.97 116.91 2bxr h TYR 121 Ca -0.01 -0.16 0.10 0.00 0.00 0.00 0.00 58.73 58.67 2bxr h TYR 121 Cb 1.43 -0.01 -0.06 0.00 0.00 0.00 0.00 36.73 38.09 2bxr h TYR 121 CO 0.00 1.26 0.55 -0.07 -0.00 0.00 0.00 178.16 179.90 2bxr h LEU 122 N 0.03 0.72 -0.05 0.10 3.38 -0.96 0.45 115.31 118.98 2bxr h LEU 122 Ca -0.28 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2bxr h LEU 122 Cb 2.00 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.62 2bxr h LEU 122 CO 0.11 0.42 -0.00 -0.78 0.09 0.00 0.00 178.44 178.27 2bxr h ASP 123 N 0.79 0.09 -0.10 -0.43 3.58 -1.24 -2.98 116.42 116.13 2bxr h ASP 123 Ca 0.40 -0.34 0.01 0.00 0.42 0.00 0.00 57.03 57.52 2bxr h ASP 123 Cb 0.47 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.48 2bxr h ASP 123 CO -0.17 0.40 -0.06 -1.22 -2.88 0.00 0.00 179.24 175.32 2bxr n TYR 124 N -4.86 -0.04 0.21 0.28 4.02 0.49 -1.91 117.16 115.34 2bxr n TYR 124 Ca -0.07 0.12 0.11 0.00 -0.01 0.00 0.00 57.90 58.05 2bxr n TYR 124 Cb 0.20 -0.48 0.22 0.00 -0.02 0.00 0.00 39.34 39.25 2bxr n TYR 124 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 176.86 172.90 2bxr h ASN 125 N 0.00 0.00 -0.58 7.72 7.08 -1.18 -2.38 115.58 126.24 2bxr h ASN 125 Ca 0.02 0.00 0.07 0.00 -3.08 0.00 0.00 56.30 53.30 2bxr h ASN 125 Cb 0.04 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 36.25 2bxr h ASN 125 CO -0.09 0.11 0.39 -1.13 -2.08 0.00 0.00 177.43 174.62 2bxr h ASN 126 N 0.00 0.46 -0.32 6.14 -1.24 -1.29 0.99 115.58 120.32 2bxr h ASN 126 Ca -0.00 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.84 2bxr h ASN 126 Cb 1.00 -0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.96 2bxr h ASN 126 CO 0.01 0.30 -0.46 0.25 -1.29 0.00 0.00 177.43 176.24 2bxr h LEU 127 N 0.52 0.96 -0.28 0.34 5.85 -0.84 -0.45 115.31 121.41 2bxr h LEU 127 Ca 0.25 -0.50 -0.20 0.00 0.84 0.00 0.00 57.88 58.27 2bxr h LEU 127 Cb 0.33 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 2bxr h LEU 127 CO -0.07 1.28 -0.86 -0.50 -0.34 0.00 0.00 178.44 177.94 2bxr h TRP 128 N 0.67 0.46 0.10 1.25 6.55 -1.37 -1.43 115.95 122.19 2bxr h TRP 128 Ca 0.03 -0.24 0.02 0.00 0.95 0.00 0.00 58.89 59.65 2bxr h TRP 128 Cb 1.06 -0.06 -0.03 0.00 -0.86 0.00 0.00 29.16 29.28 2bxr h TRP 128 CO 0.07 1.04 -0.23 -0.09 -1.05 0.00 0.00 178.44 178.18 2bxr h ARG 129 N 0.19 -0.41 -0.80 0.49 2.43 -0.77 -2.44 114.38 113.07 2bxr h ARG 129 Ca -0.05 0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 2bxr h ARG 129 Cb 1.48 0.09 -0.07 0.00 -0.42 0.00 0.00 29.97 31.05 2bxr h ARG 129 CO 0.14 -0.27 0.46 1.15 -1.51 0.00 0.00 179.97 179.94 2bxr h THR 130 N -0.42 0.94 -0.42 0.20 2.02 -0.90 -0.74 112.91 113.59 2bxr h THR 130 Ca 0.03 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.91 2bxr h THR 130 Cb 0.45 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 2bxr h THR 130 CO -0.14 0.15 0.14 0.40 0.37 0.00 0.00 175.52 176.44 2bxr h ILE 131 N 0.80 1.17 0.04 3.11 2.04 -1.07 0.90 117.51 124.50 2bxr h ILE 131 Ca 0.38 -0.58 -0.10 0.00 1.00 0.00 0.00 64.86 65.55 2bxr h ILE 131 Cb 0.30 0.71 0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2bxr h ILE 131 CO -0.22 0.22 -0.43 0.44 0.00 0.00 0.00 178.15 178.15 2bxr h ASP 132 N 0.60 0.30 -0.92 1.72 3.32 -0.75 -0.99 116.42 119.71 2bxr h ASP 132 Ca 0.14 -0.87 0.14 0.00 0.02 0.00 0.00 57.03 56.46 2bxr h ASP 132 Cb 0.17 -0.10 -0.07 0.00 0.22 0.00 0.00 39.33 39.55 2bxr h ASP 132 CO -0.01 1.15 0.59 0.78 -1.72 0.00 0.00 179.24 180.02 2bxr h ASN 133 N -0.50 0.72 -0.20 6.45 2.35 -1.02 0.46 115.58 123.83 2bxr h ASN 133 Ca -0.07 0.04 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 2bxr h ASN 133 Cb 1.25 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.51 2bxr h ASN 133 CO 0.08 0.36 -0.17 0.24 -1.65 0.00 0.00 177.43 176.30 2bxr h MET 134 N 0.76 0.62 -0.65 0.81 2.86 -0.72 -2.76 114.93 115.85 2bxr h MET 134 Ca 0.46 -0.21 0.09 0.00 -2.06 0.00 0.00 59.70 57.98 2bxr h MET 134 Cb 0.67 -0.05 -0.07 0.00 0.06 0.00 0.00 31.60 32.21 2bxr h MET 134 CO -0.22 0.76 0.28 0.78 1.06 0.00 0.00 176.91 179.57 2bxr h GLY 135 N 0.98 0.94 -0.53 8.32 0.00 0.13 -2.72 103.07 110.19 2bxr h GLY 135 Ca 0.09 -0.17 0.28 0.00 0.00 0.00 0.00 47.33 47.54 2bxr h GLY 135 CO 0.04 0.02 0.40 0.50 0.00 0.00 0.00 176.54 177.50 2bxr h LYS 136 N 0.49 0.24 0.00 4.80 1.57 -1.03 0.11 116.57 122.75 2bxr h LYS 136 Ca 0.32 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2bxr h LYS 136 Cb 0.37 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2bxr h LYS 136 CO -0.29 0.16 0.00 0.93 -0.57 0.00 0.00 179.45 179.69 2bxr h GLU 137 N 0.25 0.00 -4.55 3.15 5.08 -1.61 -3.44 114.58 113.47 2bxr h GLU 137 Ca 0.65 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 58.30 2bxr h GLU 137 Cb 1.43 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.47 2bxr h GLU 137 CO -0.65 0.00 -0.44 0.42 -1.00 0.00 0.00 179.01 177.34 2bxr s ILE 138 N -3.59 5.25 -0.05 3.13 1.01 0.37 -4.26 121.20 123.06 2bxr s ILE 138 Ca 0.01 -0.57 -0.30 0.00 0.00 0.00 0.00 60.65 59.79 2bxr s ILE 138 Cb 0.09 -3.88 -0.07 0.00 0.01 0.00 0.00 42.46 38.62 2bxr s ILE 138 CO 0.42 -0.24 1.86 -2.16 0.00 0.00 0.00 174.94 174.82 2bxr s PRO 139 N 1.69 4.01 0.49 2.79 0.04 -1.26 -4.86 135.00 137.89 2bxr s PRO 139 Ca 0.05 2.32 0.17 0.00 0.04 0.00 0.00 61.00 63.58 2bxr s PRO 139 Cb -0.19 -4.12 1.20 0.00 0.04 0.00 0.00 34.50 31.44 2bxr s PRO 139 CO 0.10 -1.08 2.09 1.79 0.04 0.00 0.00 177.00 179.93 2bxr h THR 140 N 5.83 1.00 0.00 1.26 1.35 -1.95 0.12 112.91 120.53 2bxr h THR 140 Ca -0.44 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 2bxr h THR 140 Cb 1.21 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 2bxr h THR 140 CO 0.95 0.08 0.00 0.47 -0.25 0.00 0.00 175.52 176.78 2bxr n ASP 141 N -4.35 0.00 -2.69 5.36 8.00 -1.26 -4.54 116.55 117.08 2bxr n ASP 141 Ca -0.03 0.26 -0.05 0.00 0.71 0.00 0.00 54.79 55.68 2bxr n ASP 141 Cb 0.16 -0.41 0.09 0.00 -0.02 0.00 0.00 41.12 40.95 2bxr n ASP 141 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bxr n ALA 142 N -1.41 -2.45 0.19 2.24 0.00 0.28 -5.01 120.51 114.35 2bxr n ALA 142 Ca 0.08 -0.76 0.18 0.00 0.00 0.00 0.00 53.44 52.94 2bxr n ALA 142 Cb 0.24 -2.44 0.77 0.00 0.00 0.00 0.00 19.45 18.01 2bxr n ALA 142 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2bxr h PRO 143 N 2.84 0.00 0.00 0.00 0.13 -1.37 0.32 132.00 133.92 2bxr h PRO 143 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2bxr h PRO 143 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2bxr h PRO 143 CO 0.03 0.00 0.00 0.11 -0.23 0.00 0.00 178.00 177.91 2bxr h TRP 144 N 0.00 0.00 -0.00 1.56 0.09 -1.87 -2.06 115.95 113.66 2bxr h TRP 144 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.10 2bxr h TRP 144 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.17 2bxr h TRP 144 CO 0.00 0.00 -0.20 0.39 0.09 0.00 0.00 178.44 178.72 2bxr n GLU 145 N -2.65 0.03 -1.61 0.12 1.02 0.11 -4.79 120.64 112.86 2bxr n GLU 145 Ca -0.01 -0.01 -0.47 0.00 -0.02 0.00 0.00 57.16 56.65 2bxr n GLU 145 Cb 0.15 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.03 2bxr n GLU 145 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2bxr n ALA 146 N -1.48 -0.07 -0.33 0.62 0.00 -0.78 -4.82 120.51 113.65 2bxr n ALA 146 Ca 0.07 0.44 0.20 0.00 0.00 0.00 0.00 53.44 54.15 2bxr n ALA 146 Cb 0.34 -2.12 0.45 0.00 0.00 0.00 0.00 19.45 18.12 2bxr n ALA 146 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2bxr h GLN 147 N 3.67 0.48 -0.59 0.00 -0.00 -1.92 0.45 115.11 117.20 2bxr h GLN 147 Ca -0.44 -0.03 -0.16 0.00 -0.00 0.00 0.00 58.65 58.02 2bxr h GLN 147 Cb 1.32 -0.11 -0.09 0.00 0.00 0.00 0.00 27.48 28.60 2bxr h GLN 147 CO 0.72 0.31 0.16 0.72 0.00 0.00 0.00 178.83 180.75 2bxr n HIS 148 N -4.72 1.98 -0.22 3.99 8.25 -1.26 -4.76 115.22 118.48 2bxr n HIS 148 Ca 0.25 -1.17 -0.13 0.00 -0.26 0.00 0.00 57.72 56.42 2bxr n HIS 148 Cb 0.80 -0.58 -0.10 0.00 1.12 0.00 0.00 29.99 31.23 2bxr n HIS 148 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bxr h ALA 149 N 2.36 -0.70 0.37 -1.41 0.00 -0.39 -2.36 119.26 117.13 2bxr h ALA 149 Ca 0.20 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2bxr h ALA 149 Cb 2.07 1.20 0.00 0.00 0.00 0.00 0.00 17.79 21.06 2bxr h ALA 149 CO 0.59 -1.00 -0.18 -0.44 0.00 0.00 0.00 179.25 178.22 2bxr h ASP 150 N -0.26 -0.42 -0.72 0.00 3.32 -1.86 0.15 116.42 116.63 2bxr h ASP 150 Ca 0.10 0.01 0.16 0.00 0.02 0.00 0.00 57.03 57.32 2bxr h ASP 150 Cb 0.52 0.11 -0.11 0.00 0.22 0.00 0.00 39.33 40.06 2bxr h ASP 150 CO -0.69 -0.29 0.11 0.50 -1.72 0.00 0.00 179.24 177.15 2bxr h LYS 151 N -0.50 0.19 0.01 3.56 3.64 -1.93 -0.99 116.57 120.55 2bxr h LYS 151 Ca -0.05 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.13 2bxr h LYS 151 Cb 0.38 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 2bxr h LYS 151 CO 0.08 0.13 -0.87 -1.49 -2.27 0.00 0.00 179.45 175.03 2bxr h TRP 152 N 0.20 0.16 -0.09 1.91 4.06 -0.82 -3.07 115.95 118.30 2bxr h TRP 152 Ca 0.40 -0.09 -0.21 0.00 2.06 0.00 0.00 58.89 61.05 2bxr h TRP 152 Cb 0.70 -0.02 0.01 0.00 -1.00 0.00 0.00 29.16 28.85 2bxr h TRP 152 CO -0.32 0.92 -0.75 0.22 -3.56 0.00 0.00 178.44 174.96 2bxr h ASP 153 N 0.05 0.82 -0.24 -3.49 3.58 -0.27 -2.34 116.42 114.53 2bxr h ASP 153 Ca -0.03 -0.67 0.07 0.00 0.42 0.00 0.00 57.03 56.82 2bxr h ASP 153 Cb 1.52 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 42.31 2bxr h ASP 153 CO 0.12 1.36 0.18 0.11 -2.88 0.00 0.00 179.24 178.14 2bxr h LYS 154 N 0.34 0.00 -6.42 0.28 1.79 -1.23 -1.14 116.57 110.19 2bxr h LYS 154 Ca -0.07 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.86 2bxr h LYS 154 Cb 1.39 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.01 2bxr h LYS 154 CO 0.15 0.00 0.06 1.41 -1.08 0.00 0.00 179.45 179.99 2bxr s MET 155 N -4.96 4.28 0.36 3.15 1.75 -1.14 -4.77 119.30 117.98 2bxr s MET 155 Ca -0.05 0.85 -0.16 0.00 -1.25 0.00 0.00 55.69 55.08 2bxr s MET 155 Cb 0.18 -3.09 -0.09 0.00 2.84 0.00 0.00 34.83 34.67 2bxr s MET 155 CO 0.67 0.52 0.80 -0.08 -0.65 0.00 0.00 175.02 176.28 2bxr s THR 156 N -1.30 4.62 -0.19 10.11 -1.32 -1.26 -1.69 115.64 124.61 2bxr s THR 156 Ca 0.36 1.04 0.28 0.00 -1.21 0.00 0.00 61.69 62.16 2bxr s THR 156 Cb -0.19 -3.63 0.31 0.00 -1.51 0.00 0.00 72.50 67.49 2bxr s THR 156 CO 0.21 -0.28 1.84 -0.03 -2.21 0.00 0.00 174.62 174.16 2bxr h MET 157 N 2.00 0.00 0.06 7.08 4.05 -0.73 -2.53 114.93 124.86 2bxr h MET 157 Ca -0.48 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 58.94 2bxr h MET 157 Cb 1.18 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.98 2bxr h MET 157 CO 0.64 0.00 -0.03 -0.22 0.23 0.00 0.00 176.91 177.53 2bxr h LYS 158 N 0.00 -0.07 -0.86 0.39 3.64 -1.80 -2.81 116.57 115.05 2bxr h LYS 158 Ca 0.00 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2bxr h LYS 158 Cb 0.40 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.19 2bxr h LYS 158 CO 0.00 0.45 0.52 1.05 -2.27 0.00 0.00 179.45 179.20 2bxr h GLU 159 N -0.65 1.17 -0.34 1.90 4.11 -1.86 -0.20 114.58 118.71 2bxr h GLU 159 Ca -0.01 -0.11 0.07 0.00 0.07 0.00 0.00 59.36 59.39 2bxr h GLU 159 Cb 0.56 -0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.49 2bxr h GLU 159 CO 0.01 0.82 -0.17 1.25 0.07 0.00 0.00 179.01 180.99 2bxr h LEU 160 N 1.18 -0.58 -0.11 3.06 5.85 -1.53 0.80 115.31 123.98 2bxr h LEU 160 Ca 0.31 0.13 0.03 0.00 0.84 0.00 0.00 57.88 59.19 2bxr h LEU 160 Cb -0.05 0.32 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 2bxr h LEU 160 CO -0.06 -0.21 -0.06 0.40 -0.34 0.00 0.00 178.44 178.17 2bxr h ILE 161 N -0.12 0.80 -0.22 4.05 2.04 -0.96 -0.94 117.51 122.16 2bxr h ILE 161 Ca 0.17 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.04 2bxr h ILE 161 Cb 0.38 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 2bxr h ILE 161 CO -0.42 0.00 0.11 0.44 0.00 0.00 0.00 178.15 178.29 2bxr h ASP 162 N -0.07 0.18 -0.60 1.72 3.32 -0.48 0.27 116.42 120.76 2bxr h ASP 162 Ca 0.06 0.01 0.13 0.00 0.02 0.00 0.00 57.03 57.25 2bxr h ASP 162 Cb 0.16 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2bxr h ASP 162 CO -0.15 0.13 0.41 0.50 -1.72 0.00 0.00 179.24 178.42 2bxr h LYS 163 N 0.24 0.23 0.00 3.56 3.64 0.10 -3.26 116.57 121.08 2bxr h LYS 163 Ca 0.09 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.33 2bxr h LYS 163 Cb 0.01 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 2bxr h LYS 163 CO -0.05 0.15 -0.93 -0.89 -2.27 0.00 0.00 179.45 175.46 2bxr n ILE 164 N -4.44 1.48 -2.37 2.00 5.41 -0.40 -4.93 119.36 116.11 2bxr n ILE 164 Ca 0.11 0.08 -0.41 0.00 1.00 0.00 0.00 62.75 63.53 2bxr n ILE 164 Cb 0.51 -2.21 -0.03 0.00 -0.71 0.00 0.00 39.64 37.19 2bxr n ILE 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bxr h TRP 166 N 5.64 0.00 -2.10 0.00 4.06 -1.88 -3.44 115.95 118.22 2bxr h TRP 166 Ca -0.44 0.00 -0.51 0.00 2.06 0.00 0.00 58.89 60.00 2bxr h TRP 166 Cb 1.21 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.32 2bxr h TRP 166 CO 0.63 0.57 -0.52 0.95 -3.56 0.00 0.00 178.44 176.51 2bxr s THR 167 N -2.93 4.10 -0.79 1.49 -4.23 -1.26 -5.04 115.64 106.98 2bxr s THR 167 Ca -0.02 -1.45 0.26 0.00 -1.18 0.00 0.00 61.69 59.30 2bxr s THR 167 Cb 0.08 -3.29 0.18 0.00 1.34 0.00 0.00 72.50 70.82 2bxr s THR 167 CO 0.80 -0.31 1.64 0.29 -0.54 0.00 0.00 174.62 176.50 2bxr n LYS 168 N -1.20 0.19 0.13 3.99 5.02 -1.26 -2.51 118.16 122.52 2bxr n LYS 168 Ca -0.06 0.11 -0.09 0.00 -2.02 0.00 0.00 58.31 56.25 2bxr n LYS 168 Cb 0.59 -1.68 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 2bxr n LYS 168 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2bxr h THR 169 N 0.00 0.29 -0.12 -0.18 2.02 -1.96 -1.98 112.91 110.98 2bxr h THR 169 Ca 0.00 -0.79 0.02 0.00 0.77 0.00 0.00 66.41 66.41 2bxr h THR 169 Cb 0.67 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 2bxr h THR 169 CO 0.00 0.07 -0.41 0.00 0.37 0.00 0.00 175.52 175.56 2bxr h ALA 170 N -0.84 -0.77 -0.89 6.16 0.00 -1.81 0.42 119.26 121.53 2bxr h ALA 170 Ca -0.04 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 54.94 2bxr h ALA 170 Cb 0.44 0.91 -0.13 0.00 0.00 0.00 0.00 17.79 19.01 2bxr h ALA 170 CO 0.07 -0.92 -0.48 0.07 0.00 0.00 0.00 179.25 177.99 2bxr h ARG 171 N -0.43 -0.06 0.24 0.00 0.11 -1.61 0.22 114.38 112.86 2bxr h ARG 171 Ca 0.03 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.10 2bxr h ARG 171 Cb 0.50 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.60 2bxr h ARG 171 CO -0.34 -0.04 -0.12 0.07 0.10 0.00 0.00 179.97 179.64 2bxr h ARG 172 N -0.06 -0.32 -0.41 0.08 -0.00 -0.94 -2.18 114.38 110.54 2bxr h ARG 172 Ca 0.23 0.02 0.08 0.00 -0.00 0.00 0.00 59.98 60.32 2bxr h ARG 172 Cb 0.52 0.07 -0.02 0.00 -0.00 0.00 0.00 29.97 30.54 2bxr h ARG 172 CO -0.90 -0.21 0.29 0.35 -0.00 0.00 0.00 179.97 179.49 2bxr h PHE 173 N -0.33 0.20 -0.14 4.08 3.57 0.13 -2.15 116.94 122.30 2bxr h PHE 173 Ca -0.03 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.38 2bxr h PHE 173 Cb 0.26 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 38.94 2bxr h PHE 173 CO -0.07 0.10 -0.27 0.00 -2.23 0.00 0.00 178.31 175.85 2bxr h ALA 174 N 1.79 0.22 -0.79 2.41 0.00 -0.24 -2.61 119.26 120.04 2bxr h ALA 174 Ca 0.19 -0.40 0.19 0.00 0.00 0.00 0.00 54.91 54.90 2bxr h ALA 174 Cb 0.51 -0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.13 2bxr h ALA 174 CO -0.03 0.22 0.10 1.88 0.00 0.00 0.00 179.25 181.42 2bxr h TYR 175 N 0.04 0.12 -0.11 0.00 0.05 -0.77 0.77 116.97 117.07 2bxr h TYR 175 Ca 0.01 0.05 -0.11 0.00 0.05 0.00 0.00 58.73 58.73 2bxr h TYR 175 Cb 0.85 0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.65 2bxr h TYR 175 CO 0.10 -0.21 -0.43 1.25 -1.05 0.00 0.00 178.16 177.81 2bxr h LEU 176 N 0.16 0.27 -0.53 3.88 6.46 -1.40 0.28 115.31 124.43 2bxr h LEU 176 Ca 0.46 -0.12 0.01 0.00 -0.12 0.00 0.00 57.88 58.11 2bxr h LEU 176 Cb 0.85 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.67 2bxr h LEU 176 CO -0.65 0.68 0.34 0.15 -0.62 0.00 0.00 178.44 178.34 2bxr h PHE 177 N 0.22 0.64 -0.36 1.25 3.57 -0.54 0.21 116.94 121.93 2bxr h PHE 177 Ca 0.02 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 2bxr h PHE 177 Cb 0.85 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 2bxr h PHE 177 CO 0.02 0.39 0.14 0.28 -2.23 0.00 0.00 178.31 176.91 2bxr h VAL 178 N 0.69 1.19 -0.03 1.41 2.07 -0.29 -1.35 116.25 119.94 2bxr h VAL 178 Ca 0.20 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.15 2bxr h VAL 178 Cb -0.05 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 2bxr h VAL 178 CO -0.06 0.21 -0.41 0.78 0.02 0.00 0.00 177.57 178.12 2bxr h ASN 179 N 0.43 -1.24 -0.70 0.57 2.35 -0.03 -0.80 115.58 116.15 2bxr h ASN 179 Ca 0.12 0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2bxr h ASN 179 Cb 0.20 0.49 -0.03 0.00 0.05 0.00 0.00 38.32 39.03 2bxr h ASN 179 CO -0.01 -0.44 0.44 0.40 -1.65 0.00 0.00 177.43 176.17 2bxr h ILE 180 N -0.54 1.20 0.19 2.81 2.04 -0.42 0.14 117.51 122.92 2bxr h ILE 180 Ca 0.06 -0.41 -0.32 0.00 1.00 0.00 0.00 64.86 65.19 2bxr h ILE 180 Cb 0.64 0.20 0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2bxr h ILE 180 CO -0.33 0.20 -1.45 0.78 0.00 0.00 0.00 178.15 177.35 2bxr h ASN 181 N 0.96 0.63 0.00 1.72 2.35 -1.04 -3.37 115.58 116.83 2bxr h ASN 181 Ca 0.25 -0.73 -0.01 0.00 -0.55 0.00 0.00 56.30 55.26 2bxr h ASN 181 Cb -0.05 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.08 2bxr h ASN 181 CO -0.05 1.58 -0.41 1.33 -1.65 0.00 0.00 177.43 178.23 2bxr n VAL 182 N -3.61 1.87 -3.93 2.81 0.24 -0.33 -4.96 118.33 110.43 2bxr n VAL 182 Ca -0.15 -2.69 -0.30 0.00 -2.04 0.00 0.00 64.34 59.16 2bxr n VAL 182 Cb 1.07 -0.11 -0.07 0.00 -1.47 0.00 0.00 33.84 33.26 2bxr n VAL 182 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2bxr n THR 183 N -1.04 -0.32 -4.05 3.34 -2.24 0.03 -4.76 114.28 105.24 2bxr n THR 183 Ca 0.16 -0.16 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 2bxr n THR 183 Cb 0.71 -0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 68.33 2bxr n THR 183 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2bxr s SER 184 N -3.32 0.25 -0.13 3.42 0.01 -1.25 -1.98 113.70 110.71 2bxr s SER 184 Ca 0.40 -1.17 -0.14 0.00 1.31 0.00 0.00 55.95 56.34 2bxr s SER 184 Cb -0.23 0.58 -0.05 0.00 0.21 0.00 0.00 66.02 66.53 2bxr s SER 184 CO 0.81 -1.15 0.32 -1.61 0.41 0.00 0.00 173.24 172.02 2bxr s GLU 185 N -3.72 4.15 0.27 12.44 0.41 -1.26 -3.71 118.70 127.27 2bxr s GLU 185 Ca 0.27 0.17 -0.06 0.00 -0.41 0.00 0.00 54.97 54.94 2bxr s GLU 185 Cb 0.01 -3.38 0.47 0.00 -1.78 0.00 0.00 34.13 29.45 2bxr s GLU 185 CO 0.13 0.34 1.47 -2.30 -0.49 0.00 0.00 175.26 174.41 2bxr n PRO 186 N 3.19 -0.08 0.06 0.39 -0.02 -1.26 0.08 135.00 137.35 2bxr n PRO 186 Ca -0.12 1.46 0.05 0.00 -2.02 0.00 0.00 63.50 62.87 2bxr n PRO 186 Cb 0.52 -2.19 0.26 0.00 -0.02 0.00 0.00 33.50 32.07 2bxr n PRO 186 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 2bxr n HIS 187 N -5.51 0.29 0.83 6.00 1.44 -1.26 -2.67 115.22 114.34 2bxr n HIS 187 Ca 0.16 0.14 0.10 0.00 -2.01 0.00 0.00 57.72 56.11 2bxr n HIS 187 Cb 0.50 -0.73 -0.12 0.00 0.12 0.00 0.00 29.99 29.76 2bxr n HIS 187 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2bxr n GLU 188 N -1.80 0.29 -5.11 -1.40 1.02 0.11 -4.85 120.64 108.91 2bxr n GLU 188 Ca 0.00 -0.03 -0.32 0.00 -0.02 0.00 0.00 57.16 56.80 2bxr n GLU 188 Cb 0.05 -1.47 -0.15 0.00 -0.02 0.00 0.00 31.44 29.85 2bxr n GLU 188 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2bxr s VAL 189 N -3.01 2.46 0.20 2.62 -7.23 -1.09 -4.14 120.40 110.21 2bxr s VAL 189 Ca 0.06 -0.93 -0.33 0.00 -1.81 0.00 0.00 61.98 58.97 2bxr s VAL 189 Cb 0.15 -1.92 -0.13 0.00 0.56 0.00 0.00 36.38 35.04 2bxr s VAL 189 CO 0.85 0.57 1.63 -0.24 -0.31 0.00 0.00 175.10 177.60 2bxr n SER 190 N 2.67 3.52 0.02 4.85 2.88 0.53 -0.52 113.62 127.57 2bxr n SER 190 Ca -0.17 1.08 -0.12 0.00 -1.33 0.00 0.00 58.87 58.33 2bxr n SER 190 Cb 0.52 -1.50 -0.07 0.00 -0.75 0.00 0.00 64.21 62.41 2bxr n SER 190 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bxr h ALA 191 N 6.12 0.04 -0.37 -1.46 0.00 -1.27 -0.77 119.26 121.54 2bxr h ALA 191 Ca -0.44 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.53 2bxr h ALA 191 Cb 1.23 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 2bxr h ALA 191 CO 0.90 -0.45 -0.37 1.25 0.00 0.00 0.00 179.25 180.58 2bxr h LEU 192 N 0.02 -1.22 -0.50 0.00 5.85 -1.68 0.89 115.31 118.67 2bxr h LEU 192 Ca 0.01 0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.97 2bxr h LEU 192 Cb 0.01 0.55 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 2bxr h LEU 192 CO -0.00 -0.35 0.26 -0.25 -0.34 0.00 0.00 178.44 177.76 2bxr h TRP 193 N -0.30 0.48 -0.27 1.25 7.01 -1.81 -0.31 115.95 121.99 2bxr h TRP 193 Ca 0.15 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.15 2bxr h TRP 193 Cb 0.56 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.47 2bxr h TRP 193 CO -0.56 0.24 0.10 0.35 -2.79 0.00 0.00 178.44 175.78 2bxr h PHE 194 N 0.51 0.43 -0.97 2.65 3.57 -0.31 0.94 116.94 123.75 2bxr h PHE 194 Ca 0.22 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.71 2bxr h PHE 194 Cb 0.11 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 38.67 2bxr h PHE 194 CO -0.10 0.44 0.64 -0.07 -2.23 0.00 0.00 178.31 176.99 2bxr h LEU 195 N 0.29 1.07 -0.13 0.59 3.38 -0.50 -0.34 115.31 119.66 2bxr h LEU 195 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2bxr h LEU 195 Cb 0.21 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2bxr h LEU 195 CO -0.01 0.74 0.09 -0.25 0.09 0.00 0.00 178.44 179.10 2bxr h TRP 196 N 1.24 0.17 -0.23 1.13 7.01 -0.67 -2.69 115.95 121.91 2bxr h TRP 196 Ca 0.38 0.00 0.06 0.00 2.11 0.00 0.00 58.89 61.44 2bxr h TRP 196 Cb -0.02 -0.06 -0.06 0.00 -2.10 0.00 0.00 29.16 26.92 2bxr h TRP 196 CO -0.01 0.11 -0.18 -0.92 -2.79 0.00 0.00 178.44 174.66 2bxr h TYR 197 N 0.17 -0.47 0.18 2.65 3.20 0.83 0.15 116.97 123.69 2bxr h TYR 197 Ca 0.05 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2bxr h TYR 197 Cb -0.01 0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.50 2bxr h TYR 197 CO -0.07 -0.26 -0.09 0.28 -1.64 0.00 0.00 178.16 176.39 2bxr h VAL 198 N -0.18 0.91 -0.76 1.81 2.07 -1.30 -2.70 116.25 116.09 2bxr h VAL 198 Ca 0.13 -0.42 0.17 0.00 0.82 0.00 0.00 66.70 67.40 2bxr h VAL 198 Cb 0.38 1.17 -0.13 0.00 -1.52 0.00 0.00 31.29 31.19 2bxr h VAL 198 CO -0.34 0.10 0.00 0.50 0.02 0.00 0.00 177.57 177.85 2bxr h LYS 199 N -0.45 0.10 -0.05 1.57 3.11 -1.02 0.22 116.57 120.05 2bxr h LYS 199 Ca -0.02 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 2bxr h LYS 199 Cb 0.35 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.55 2bxr h LYS 199 CO 0.04 0.06 0.00 0.00 -2.81 0.00 0.00 179.45 176.74 2bxr n GLN 200 N -5.35 0.74 -0.01 1.90 -0.00 0.47 -0.68 117.38 114.45 2bxr n GLN 200 Ca 0.14 0.00 0.03 0.00 -0.00 0.00 0.00 57.00 57.17 2bxr n GLN 200 Cb 0.48 -1.03 0.04 0.00 -0.00 0.00 0.00 30.24 29.73 2bxr n GLN 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2bxr n GLY 202 N 0.35 0.93 4.87 0.00 0.00 0.15 -4.41 105.19 107.08 2bxr n GLY 202 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2bxr n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 203 N -2.12 -2.16 0.44 -0.02 0.00 -0.66 -4.19 105.19 96.47 2bxr n GLY 203 Ca 0.00 -1.51 -0.19 0.00 0.00 0.00 0.00 46.02 44.32 2bxr n GLY 203 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2bxr h THR 204 N 0.00 0.18 -0.08 2.61 1.35 -1.90 -2.41 112.91 112.66 2bxr h THR 204 Ca 0.00 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.87 2bxr h THR 204 Cb 0.00 0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 66.59 2bxr h THR 204 CO 0.00 0.00 -0.05 0.41 -0.25 0.00 0.00 175.52 175.63 2bxr n THR 205 N -5.56 -0.05 0.30 6.82 -1.04 -1.26 -2.71 114.28 110.78 2bxr n THR 205 Ca -0.14 0.82 -0.17 0.00 -2.04 0.00 0.00 64.05 62.52 2bxr n THR 205 Cb 0.44 -1.08 -0.08 0.00 -1.82 0.00 0.00 70.33 67.79 2bxr n THR 205 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 2bxr h ARG 206 N 0.00 -0.81 -0.84 -2.82 2.47 -1.65 -3.22 114.38 107.51 2bxr h ARG 206 Ca 0.01 0.06 0.14 0.00 -1.26 0.00 0.00 59.98 58.93 2bxr h ARG 206 Cb 0.03 0.18 -0.09 0.00 -1.65 0.00 0.00 29.97 28.44 2bxr h ARG 206 CO -0.08 -0.54 0.43 0.97 0.56 0.00 0.00 179.97 181.32 2bxr h ILE 207 N -0.84 0.73 -3.07 2.04 2.10 -1.23 -3.31 117.51 113.93 2bxr h ILE 207 Ca -0.06 -0.21 -0.58 0.00 1.08 0.00 0.00 64.86 65.08 2bxr h ILE 207 Cb 0.70 0.06 -0.40 0.00 -1.09 0.00 0.00 36.82 36.08 2bxr h ILE 207 CO 0.05 0.11 -0.76 0.12 -1.08 0.00 0.00 178.15 176.59 2bxr s PHE 208 N -5.97 1.57 -0.52 2.19 5.36 -1.16 -5.09 117.98 114.36 2bxr s PHE 208 Ca -0.12 -1.75 -0.29 0.00 -0.96 0.00 0.00 56.93 53.81 2bxr s PHE 208 Cb 0.22 -1.62 0.03 0.00 -0.34 0.00 0.00 43.02 41.30 2bxr s PHE 208 CO 0.78 -0.86 1.21 -1.54 -1.46 0.00 0.00 175.22 173.35 2bxr s SER 209 N 1.45 6.48 0.64 6.13 1.04 -1.25 -4.77 113.70 123.42 2bxr s SER 209 Ca 0.11 0.34 0.21 0.00 0.48 0.00 0.00 55.95 57.09 2bxr s SER 209 Cb -0.18 -2.55 1.06 0.00 0.10 0.00 0.00 66.02 64.44 2bxr s SER 209 CO -0.21 -1.41 1.57 0.58 0.98 0.00 0.00 173.24 174.75 2bxr h VAL 210 N 6.24 0.08 0.00 5.02 2.07 -1.93 -3.47 116.25 124.26 2bxr h VAL 210 Ca -0.25 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2bxr h VAL 210 Cb 1.07 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2bxr h VAL 210 CO 1.15 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.35 2bxr n GLY 214 N -1.44 -0.59 2.87 2.17 0.00 -1.26 -5.13 105.19 101.81 2bxr n GLY 214 Ca 0.05 0.32 -0.21 0.00 0.00 0.00 0.00 46.02 46.18 2bxr n GLY 214 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2bxr n GLN 215 N 0.00 0.00 -3.88 1.61 7.27 -1.26 -4.92 117.38 116.21 2bxr n GLN 215 Ca 0.00 0.00 -0.35 0.00 0.07 0.00 0.00 57.00 56.72 2bxr n GLN 215 Cb 0.00 -0.89 -0.05 0.00 2.41 0.00 0.00 30.24 31.71 2bxr n GLN 215 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 2bxr s GLU 216 N 6.01 3.46 0.09 3.69 0.41 -1.26 -4.37 118.70 126.73 2bxr s GLU 216 Ca 1.09 -0.20 0.04 0.00 -0.41 0.00 0.00 54.97 55.49 2bxr s GLU 216 Cb -0.75 -3.14 -0.03 0.00 -1.78 0.00 0.00 34.13 28.42 2bxr s GLU 216 CO 0.46 0.72 -0.11 1.03 -0.49 0.00 0.00 175.26 176.87 2bxr s ARG 217 N -1.49 0.83 0.24 1.61 0.52 -0.76 0.89 118.95 120.79 2bxr s ARG 217 Ca 0.21 -1.09 0.07 0.00 -0.52 0.00 0.00 55.73 54.40 2bxr s ARG 217 Cb -0.12 -0.60 -0.05 0.00 0.52 0.00 0.00 34.95 34.70 2bxr s ARG 217 CO 0.12 0.11 -0.09 0.15 0.02 0.00 0.00 175.30 175.60 2bxr s LYS 218 N -2.47 1.43 -0.10 3.54 1.02 -0.72 -0.31 119.74 122.13 2bxr s LYS 218 Ca 0.03 -1.68 -0.24 0.00 0.02 0.00 0.00 55.97 54.09 2bxr s LYS 218 Cb -0.05 -1.10 -0.03 0.00 -0.52 0.00 0.00 37.83 36.13 2bxr s LYS 218 CO 0.01 0.10 0.76 -0.06 -0.92 0.00 0.00 175.35 175.23 2bxr s PHE 219 N -3.02 3.53 -0.30 3.18 0.08 -1.26 -1.36 117.98 118.83 2bxr s PHE 219 Ca 0.26 1.27 -0.31 0.00 0.12 0.00 0.00 56.93 58.27 2bxr s PHE 219 Cb 0.02 -2.89 -0.08 0.00 -0.57 0.00 0.00 43.02 39.50 2bxr s PHE 219 CO 0.09 -0.03 2.23 0.28 -0.10 0.00 0.00 175.22 177.69 2bxr n VAL 220 N 4.10 0.25 -0.00 -0.44 0.31 -0.62 -1.48 118.33 120.44 2bxr n VAL 220 Ca 0.01 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.95 2bxr n VAL 220 Cb 0.51 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 31.29 2bxr n VAL 220 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bxr n GLY 221 N 6.15 0.17 0.00 2.92 0.00 -1.26 -4.65 105.19 108.52 2bxr n GLY 221 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2bxr n GLY 221 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 222 N -2.00 3.60 0.21 -0.02 0.00 -0.55 -4.81 105.19 101.63 2bxr n GLY 222 Ca 0.00 -1.59 0.14 0.00 0.00 0.00 0.00 46.02 44.57 2bxr n GLY 222 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bxr h SER 223 N 0.00 0.00 -0.03 1.61 4.64 -1.84 -2.91 113.55 115.02 2bxr h SER 223 Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2bxr h SER 223 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2bxr h SER 223 CO 0.00 0.00 0.05 1.23 -0.87 0.00 0.00 176.83 177.24 2bxr h GLY 224 N 3.40 0.00 1.45 -0.77 0.00 -1.89 -1.89 103.07 103.37 2bxr h GLY 224 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 2bxr h GLY 224 CO 0.00 0.00 0.29 1.46 0.00 0.00 0.00 176.54 178.29 2bxr h GLN 225 N 0.00 0.43 -0.49 4.80 4.20 -1.82 -1.96 115.11 120.26 2bxr h GLN 225 Ca 0.01 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.76 2bxr h GLN 225 Cb 0.12 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.75 2bxr h GLN 225 CO -0.00 0.28 0.20 0.28 -0.67 0.00 0.00 178.83 178.93 2bxr h VAL 226 N 0.44 0.88 0.23 -0.54 2.07 -1.56 0.12 116.25 117.89 2bxr h VAL 226 Ca 0.18 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 2bxr h VAL 226 Cb 0.16 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2bxr h VAL 226 CO -0.04 0.07 -0.11 0.28 0.02 0.00 0.00 177.57 177.79 2bxr h SER 227 N 0.40 -0.26 -0.96 0.57 0.02 -1.67 -3.11 113.55 108.53 2bxr h SER 227 Ca 0.23 -0.22 0.31 0.00 -0.84 0.00 0.00 61.79 61.27 2bxr h SER 227 Cb 0.21 0.07 -0.17 0.00 0.14 0.00 0.00 62.40 62.65 2bxr h SER 227 CO -0.21 0.26 0.31 -0.33 -1.14 0.00 0.00 176.83 175.72 2bxr h GLU 228 N -0.96 0.11 0.00 3.45 5.08 -1.20 -1.00 114.58 120.07 2bxr h GLU 228 Ca -0.03 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 2bxr h GLU 228 Cb 0.47 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2bxr h GLU 228 CO 0.05 0.07 -0.77 0.00 -1.00 0.00 0.00 179.01 177.36 2bxr h ARG 229 N 0.11 0.00 -0.30 2.33 2.47 -0.78 -0.30 114.38 117.91 2bxr h ARG 229 Ca 0.68 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 59.23 2bxr h ARG 229 Cb 1.56 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.87 2bxr h ARG 229 CO -0.76 0.77 -0.48 0.82 0.56 0.00 0.00 179.97 180.89 2bxr h ILE 230 N 0.00 1.28 -0.61 2.04 2.04 -1.17 -2.30 117.51 118.79 2bxr h ILE 230 Ca -0.01 -1.66 0.01 0.00 1.00 0.00 0.00 64.86 64.20 2bxr h ILE 230 Cb 1.40 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 39.01 2bxr h ILE 230 CO 0.10 0.54 0.40 -0.03 0.00 0.00 0.00 178.15 179.16 2bxr h MET 231 N 0.64 0.76 -0.91 2.37 4.05 -0.65 -0.26 114.93 120.93 2bxr h MET 231 Ca 0.03 -0.05 0.04 0.00 -0.28 0.00 0.00 59.70 59.45 2bxr h MET 231 Cb 1.06 -0.17 -0.06 0.00 -0.80 0.00 0.00 31.60 31.63 2bxr h MET 231 CO 0.10 0.51 0.59 -0.44 0.23 0.00 0.00 176.91 177.90 2bxr h ASP 232 N 0.79 0.98 0.30 1.39 3.32 -0.73 0.10 116.42 122.56 2bxr h ASP 232 Ca 0.23 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.14 2bxr h ASP 232 Cb -0.04 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 2bxr h ASP 232 CO -0.05 0.67 -0.52 -0.07 -1.72 0.00 0.00 179.24 177.54 2bxr h LEU 233 N 1.14 0.28 0.00 1.55 3.38 -0.60 -3.25 115.31 117.81 2bxr h LEU 233 Ca 0.37 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.20 2bxr h LEU 233 Cb 0.03 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2bxr h LEU 233 CO -0.13 0.75 -0.96 0.18 0.09 0.00 0.00 178.44 178.37 2bxr n LEU 234 N -3.93 0.65 0.00 1.67 4.77 -0.26 -5.03 117.00 114.87 2bxr n LEU 234 Ca -0.02 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2bxr n LEU 234 Cb 0.56 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 2bxr n LEU 234 CO 0.43 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2bxr n GLY 235 N 1.32 3.30 0.96 -0.72 0.00 0.32 -2.17 105.19 108.20 2bxr n GLY 235 Ca 0.02 -0.17 0.04 0.00 0.00 0.00 0.00 46.02 45.91 2bxr n GLY 235 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bxr n ASP 236 N 4.91 2.73 -0.45 1.61 5.68 -1.26 -3.21 116.55 126.56 2bxr n ASP 236 Ca 0.00 -2.27 0.11 0.00 -0.50 0.00 0.00 54.79 52.14 2bxr n ASP 236 Cb 0.00 -0.45 0.45 0.00 -1.14 0.00 0.00 41.12 39.98 2bxr n ASP 236 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2bxr n GLN 237 N 0.40 1.60 -3.93 0.11 6.02 -0.92 -4.66 117.38 115.99 2bxr n GLN 237 Ca 0.13 -0.90 -0.35 0.00 -0.01 0.00 0.00 57.00 55.87 2bxr n GLN 237 Cb 0.54 -1.40 -0.12 0.00 1.02 0.00 0.00 30.24 30.28 2bxr n GLN 237 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2bxr s VAL 238 N -1.86 4.35 -0.28 5.09 1.01 -1.20 -0.52 120.40 126.99 2bxr s VAL 238 Ca 0.33 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 62.13 2bxr s VAL 238 Cb 0.18 -3.00 0.04 0.00 0.00 0.00 0.00 36.38 33.60 2bxr s VAL 238 CO 0.27 0.40 -0.02 -0.54 0.00 0.00 0.00 175.10 175.21 2bxr s LYS 239 N 1.08 2.57 0.95 2.72 -0.14 0.13 -4.96 119.74 122.09 2bxr s LYS 239 Ca 0.04 -1.17 -0.14 0.00 -1.36 0.00 0.00 55.97 53.34 2bxr s LYS 239 Cb -0.14 -3.11 0.17 0.00 -1.68 0.00 0.00 37.83 33.06 2bxr s LYS 239 CO 0.03 -0.54 1.18 -0.51 -0.76 0.00 0.00 175.35 174.74 2bxr s LEU 240 N 1.28 2.04 -1.33 3.17 1.43 -1.26 -1.16 118.68 122.84 2bxr s LEU 240 Ca -0.04 0.74 -0.13 0.00 -1.03 0.00 0.00 54.13 53.67 2bxr s LEU 240 Cb -0.19 -2.94 0.12 0.00 0.03 0.00 0.00 46.19 43.21 2bxr s LEU 240 CO -0.02 -2.74 0.51 0.59 0.23 0.00 0.00 176.35 174.93 2bxr n ASN 241 N -3.85 -2.89 -3.27 2.29 3.02 0.58 -4.80 115.26 106.34 2bxr n ASN 241 Ca 0.10 -0.59 -0.26 0.00 -0.03 0.00 0.00 54.58 53.80 2bxr n ASN 241 Cb 0.60 -2.43 -0.07 0.00 -0.61 0.00 0.00 39.78 37.27 2bxr n ASN 241 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2bxr n HIS 242 N -3.87 2.88 -1.89 3.10 8.25 -0.53 -4.94 115.22 118.21 2bxr n HIS 242 Ca 0.04 -4.01 -0.42 0.00 -0.26 0.00 0.00 57.72 53.07 2bxr n HIS 242 Cb 0.51 -0.50 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 2bxr n HIS 242 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2bxr s PRO 243 N -2.48 4.17 0.03 -0.41 0.02 -1.26 -3.63 135.00 131.45 2bxr s PRO 243 Ca 0.41 2.34 -0.30 0.00 0.02 0.00 0.00 61.00 63.47 2bxr s PRO 243 Cb 0.19 -3.93 -0.05 0.00 0.02 0.00 0.00 34.50 30.73 2bxr s PRO 243 CO -0.06 -0.85 1.16 0.08 -0.33 0.00 0.00 177.00 177.01 2bxr s VAL 244 N 3.79 4.20 0.00 3.83 1.01 -1.26 -0.38 120.40 131.59 2bxr s VAL 244 Ca 0.78 1.57 0.00 0.00 0.00 0.00 0.00 61.98 64.33 2bxr s VAL 244 Cb -0.38 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.00 2bxr s VAL 244 CO 0.33 0.10 0.00 0.35 0.00 0.00 0.00 175.10 175.89 2bxr n THR 245 N 4.03 0.00 -4.24 3.92 -2.24 -0.20 -4.81 114.28 110.73 2bxr n THR 245 Ca 0.09 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.70 2bxr n THR 245 Cb 0.47 -0.35 -0.14 0.00 -2.10 0.00 0.00 70.33 68.20 2bxr n THR 245 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2bxr s HIS 246 N -1.98 0.61 -0.23 4.78 3.76 -1.05 -0.99 115.29 120.19 2bxr s HIS 246 Ca 0.00 -0.12 -0.01 0.00 -0.15 0.00 0.00 55.06 54.78 2bxr s HIS 246 Cb 0.00 -0.39 0.07 0.00 1.11 0.00 0.00 32.58 33.36 2bxr s HIS 246 CO 0.00 -0.01 0.01 0.08 -0.85 0.00 0.00 174.74 173.97 2bxr s VAL 247 N -0.17 1.07 -0.20 -0.90 1.01 -0.38 -1.40 120.40 119.43 2bxr s VAL 247 Ca 0.02 -1.03 -0.07 0.00 0.00 0.00 0.00 61.98 60.90 2bxr s VAL 247 Cb -0.03 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2bxr s VAL 247 CO -0.00 -0.24 0.05 -0.62 0.00 0.00 0.00 175.10 174.28 2bxr s ASP 248 N 1.59 5.35 0.00 3.32 -1.08 -0.36 -1.34 116.67 124.15 2bxr s ASP 248 Ca -0.01 -0.04 0.06 0.00 -0.52 0.00 0.00 52.55 52.03 2bxr s ASP 248 Cb -0.18 -1.93 -0.04 0.00 -1.46 0.00 0.00 42.92 39.32 2bxr s ASP 248 CO -0.10 0.11 0.35 1.67 0.52 0.00 0.00 175.17 177.72 2bxr n GLN 249 N 3.99 3.90 0.10 4.34 7.27 0.46 -1.82 117.38 135.62 2bxr n GLN 249 Ca -0.16 -0.21 0.07 0.00 0.07 0.00 0.00 57.00 56.77 2bxr n GLN 249 Cb 0.52 -0.85 0.38 0.00 2.41 0.00 0.00 30.24 32.69 2bxr n GLN 249 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 2bxr n SER 250 N -0.79 0.36 -3.49 1.69 3.41 -1.23 -3.95 113.62 109.62 2bxr n SER 250 Ca 0.02 0.66 -0.28 0.00 -0.26 0.00 0.00 58.87 59.01 2bxr n SER 250 Cb 0.11 -0.71 -0.11 0.00 -0.26 0.00 0.00 64.21 63.24 2bxr n SER 250 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2bxr s SER 251 N -3.66 2.43 0.00 4.04 1.04 -1.26 -5.03 113.70 111.26 2bxr s SER 251 Ca -0.01 -2.79 0.00 0.00 0.48 0.00 0.00 55.95 53.64 2bxr s SER 251 Cb 0.04 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.59 2bxr s SER 251 CO 0.15 -0.22 0.00 -0.90 0.98 0.00 0.00 173.24 173.25 2bxr n ASP 252 N 3.25 0.00 -4.66 7.02 5.75 -1.25 -4.42 116.55 122.24 2bxr n ASP 252 Ca 0.21 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.59 2bxr n ASP 252 Cb 0.42 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.44 2bxr n ASP 252 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2bxr s ASN 253 N 0.00 6.58 -0.21 -1.12 2.47 -1.26 -4.84 114.94 116.55 2bxr s ASN 253 Ca 0.00 0.69 -0.26 0.00 0.42 0.00 0.00 52.86 53.71 2bxr s ASN 253 Cb 0.00 -2.30 -0.00 0.00 -1.45 0.00 0.00 41.25 37.49 2bxr s ASN 253 CO 0.00 -0.20 0.89 -0.63 -3.72 0.00 0.00 177.10 173.44 2bxr s ILE 254 N 1.73 4.81 -0.24 -5.21 1.01 -0.60 -4.84 121.20 117.85 2bxr s ILE 254 Ca 0.25 1.72 -0.16 0.00 0.00 0.00 0.00 60.65 62.45 2bxr s ILE 254 Cb -0.15 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.10 2bxr s ILE 254 CO 0.10 -0.07 0.44 -0.63 0.00 0.00 0.00 174.94 174.78 2bxr s ILE 255 N 2.69 5.14 -0.14 2.92 1.01 -0.75 -2.47 121.20 129.59 2bxr s ILE 255 Ca 0.39 0.74 -0.01 0.00 0.00 0.00 0.00 60.65 61.77 2bxr s ILE 255 Cb -0.16 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 2bxr s ILE 255 CO 0.09 0.16 -0.11 -0.63 0.00 0.00 0.00 174.94 174.44 2bxr s ILE 256 N 1.94 3.16 -0.06 2.92 1.01 0.82 -1.23 121.20 129.76 2bxr s ILE 256 Ca 0.19 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.24 2bxr s ILE 256 Cb -0.15 -2.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2bxr s ILE 256 CO 0.09 0.51 -0.09 -0.70 0.00 0.00 0.00 174.94 174.75 2bxr s GLU 257 N 0.45 2.65 0.36 2.79 2.12 -0.49 -1.40 118.70 125.19 2bxr s GLU 257 Ca -0.09 -0.60 0.08 0.00 0.36 0.00 0.00 54.97 54.72 2bxr s GLU 257 Cb -0.16 -2.51 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 2bxr s GLU 257 CO 0.04 0.65 0.32 0.95 -0.54 0.00 0.00 175.26 176.69 2bxr s THR 258 N -0.79 3.23 0.36 -1.70 -4.23 -1.04 -1.03 115.64 110.44 2bxr s THR 258 Ca 0.12 -1.36 0.14 0.00 -1.18 0.00 0.00 61.69 59.42 2bxr s THR 258 Cb -0.11 -3.12 0.35 0.00 1.34 0.00 0.00 72.50 70.97 2bxr s THR 258 CO 0.01 -0.11 1.74 0.25 -0.54 0.00 0.00 174.62 175.97 2bxr h LEU 259 N 1.17 0.56 -1.77 4.79 5.85 -1.05 0.34 115.31 125.20 2bxr h LEU 259 Ca -0.44 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2bxr h LEU 259 Cb 1.26 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.32 2bxr h LEU 259 CO 0.58 0.07 0.00 -0.46 -0.34 0.00 0.00 178.44 178.29 2bxr n ASN 260 N -4.79 2.58 -1.97 1.25 6.94 -1.26 -4.89 115.26 113.12 2bxr n ASN 260 Ca 0.27 -2.25 -0.16 0.00 -0.02 0.00 0.00 54.58 52.42 2bxr n ASN 260 Cb 0.84 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.83 2bxr n ASN 260 CO 0.00 0.00 0.00 1.41 -1.03 0.00 0.00 177.26 177.64 2bxr n HIS 261 N 0.36 -1.00 -2.23 -2.53 8.25 0.12 -5.01 115.22 113.19 2bxr n HIS 261 Ca 0.12 0.14 -0.30 0.00 -0.26 0.00 0.00 57.72 57.41 2bxr n HIS 261 Cb 0.52 -3.37 -0.00 0.00 1.12 0.00 0.00 29.99 28.25 2bxr n HIS 261 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2bxr s GLU 262 N -5.00 3.67 0.03 -0.41 2.02 -1.25 -4.91 118.70 112.85 2bxr s GLU 262 Ca 0.08 0.64 0.04 0.00 0.02 0.00 0.00 54.97 55.76 2bxr s GLU 262 Cb -0.04 -2.18 -0.02 0.00 0.10 0.00 0.00 34.13 31.99 2bxr s GLU 262 CO 0.10 -0.39 -0.13 -1.01 0.02 0.00 0.00 175.26 173.85 2bxr s HIS 263 N -2.91 1.15 -0.04 1.61 3.76 -1.26 -2.49 115.29 115.12 2bxr s HIS 263 Ca 0.54 -0.33 -0.05 0.00 -0.15 0.00 0.00 55.06 55.07 2bxr s HIS 263 Cb -0.11 -0.69 0.01 0.00 1.11 0.00 0.00 32.58 32.90 2bxr s HIS 263 CO 0.46 0.02 0.12 0.71 -0.85 0.00 0.00 174.74 175.20 2bxr s TYR 264 N -0.79 -0.09 0.06 1.40 2.02 -0.49 -4.85 117.35 114.62 2bxr s TYR 264 Ca 0.01 0.21 0.05 0.00 -0.37 0.00 0.00 57.07 56.97 2bxr s TYR 264 Cb -0.07 0.02 -0.03 0.00 -0.40 0.00 0.00 41.96 41.48 2bxr s TYR 264 CO 0.01 -0.11 -0.14 -1.83 -1.57 0.00 0.00 175.55 171.90 2bxr s GLU 265 N -0.27 0.86 0.23 -0.62 -1.05 -0.64 -0.13 118.70 117.08 2bxr s GLU 265 Ca -0.03 -0.91 -0.23 0.00 -0.15 0.00 0.00 54.97 53.65 2bxr s GLU 265 Cb -0.03 -0.89 0.04 0.00 -0.44 0.00 0.00 34.13 32.82 2bxr s GLU 265 CO 0.00 0.20 0.82 0.00 0.95 0.00 0.00 175.26 177.24 2bxr n LYS 267 N -0.46 0.63 -4.05 0.00 5.02 -0.52 -1.56 118.16 117.21 2bxr n LYS 267 Ca -0.05 0.19 -0.09 0.00 -2.02 0.00 0.00 58.31 56.34 2bxr n LYS 267 Cb 0.60 -1.77 -0.11 0.00 -0.02 0.00 0.00 35.03 33.73 2bxr n LYS 267 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2bxr s TYR 268 N -2.91 0.47 0.08 2.13 2.02 -0.92 -4.85 117.35 113.36 2bxr s TYR 268 Ca -0.04 -0.80 0.09 0.00 -0.37 0.00 0.00 57.07 55.96 2bxr s TYR 268 Cb 0.09 -0.33 -0.03 0.00 -0.40 0.00 0.00 41.96 41.29 2bxr s TYR 268 CO 0.82 -0.26 -0.25 0.08 -1.57 0.00 0.00 175.55 174.37 2bxr s VAL 269 N -2.73 2.05 -0.24 0.71 1.01 -0.67 -1.83 120.40 118.69 2bxr s VAL 269 Ca -0.03 -1.48 0.02 0.00 0.00 0.00 0.00 61.98 60.49 2bxr s VAL 269 Cb -0.01 -1.79 0.06 0.00 0.00 0.00 0.00 36.38 34.64 2bxr s VAL 269 CO -0.05 0.21 -0.09 -0.63 0.00 0.00 0.00 175.10 174.55 2bxr s ILE 270 N -0.91 1.83 -0.14 2.22 1.01 -0.62 -0.71 121.20 123.88 2bxr s ILE 270 Ca 0.11 -1.37 -0.29 0.00 0.00 0.00 0.00 60.65 59.10 2bxr s ILE 270 Cb -0.10 -2.00 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 2bxr s ILE 270 CO 0.03 -0.02 1.45 0.21 0.00 0.00 0.00 174.94 176.61 2bxr s ASN 271 N 1.26 6.76 -0.22 3.58 2.47 0.78 -0.80 114.94 128.78 2bxr s ASN 271 Ca -0.06 1.85 0.13 0.00 0.42 0.00 0.00 52.86 55.19 2bxr s ASN 271 Cb -0.19 -2.54 0.45 0.00 -1.45 0.00 0.00 41.25 37.52 2bxr s ASN 271 CO -0.06 -0.90 1.19 0.00 -3.72 0.00 0.00 177.10 173.61 2bxr n ALA 272 N 7.08 3.89 -2.67 1.71 0.00 -0.10 -0.44 120.51 129.98 2bxr n ALA 272 Ca 0.16 -3.31 -0.16 0.00 0.00 0.00 0.00 53.44 50.13 2bxr n ALA 272 Cb 0.44 -0.44 -0.11 0.00 0.00 0.00 0.00 19.45 19.33 2bxr n ALA 272 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2bxr s ILE 273 N -3.42 0.94 0.90 0.00 -4.36 -1.24 -4.46 121.20 109.55 2bxr s ILE 273 Ca 0.41 -1.37 -0.11 0.00 -0.26 0.00 0.00 60.65 59.32 2bxr s ILE 273 Cb 0.38 -1.06 0.12 0.00 1.25 0.00 0.00 42.46 43.15 2bxr s ILE 273 CO -0.04 -0.36 1.05 -0.81 0.24 0.00 0.00 174.94 175.02 2bxr n PRO 274 N 1.09 -0.31 0.02 0.37 -0.04 -1.26 -4.46 135.00 130.40 2bxr n PRO 274 Ca -0.20 -0.02 -0.14 0.00 -0.04 0.00 0.00 63.50 63.10 2bxr n PRO 274 Cb 0.55 -2.31 -0.08 0.00 -0.04 0.00 0.00 33.50 31.62 2bxr n PRO 274 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 2bxr h PRO 275 N -1.64 -0.56 -0.90 0.54 0.11 -1.89 -0.43 132.00 127.22 2bxr h PRO 275 Ca -0.44 0.04 0.22 0.00 0.11 0.00 0.00 66.00 65.93 2bxr h PRO 275 Cb 1.28 0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.45 2bxr h PRO 275 CO 0.41 -0.37 0.61 0.00 -0.21 0.00 0.00 178.00 178.43 2bxr h THR 276 N -0.58 0.64 0.12 -1.15 1.03 -1.73 -1.86 112.91 109.38 2bxr h THR 276 Ca 0.04 -0.11 -0.26 0.00 -0.01 0.00 0.00 66.41 66.07 2bxr h THR 276 Cb 0.68 0.29 0.03 0.00 -1.07 0.00 0.00 68.15 68.08 2bxr h THR 276 CO -0.40 0.06 -1.09 -0.07 -0.01 0.00 0.00 175.52 174.02 2bxr h LEU 277 N 0.32 0.75 -1.12 0.00 3.38 -1.45 -3.13 115.31 114.06 2bxr h LEU 277 Ca 0.47 -0.85 0.19 0.00 0.09 0.00 0.00 57.88 57.78 2bxr h LEU 277 Cb 1.30 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.71 2bxr h LEU 277 CO -0.15 1.52 0.61 0.74 0.09 0.00 0.00 178.44 181.26 2bxr h THR 278 N 0.08 0.70 -0.00 0.22 2.02 -0.55 -0.67 112.91 114.70 2bxr h THR 278 Ca -0.17 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2bxr h THR 278 Cb 1.80 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 68.15 2bxr h THR 278 CO 0.21 0.13 0.01 0.00 0.37 0.00 0.00 175.52 176.23 2bxr h ALA 279 N 1.63 1.42 0.00 6.16 0.00 -1.30 -1.79 119.26 125.38 2bxr h ALA 279 Ca 0.56 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2bxr h ALA 279 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2bxr h ALA 279 CO -0.34 -0.01 -0.14 0.87 0.00 0.00 0.00 179.25 179.63 2bxr h LYS 280 N 0.00 0.00 -6.84 0.00 1.57 -1.18 -3.46 116.57 106.66 2bxr h LYS 280 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.29 2bxr h LYS 280 Cb 0.01 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.34 2bxr h LYS 280 CO -0.00 0.00 0.45 0.42 -0.57 0.00 0.00 179.45 179.75 2bxr s ILE 281 N -3.20 3.60 -0.21 1.86 1.01 -0.68 -5.00 121.20 118.58 2bxr s ILE 281 Ca 0.07 1.50 -0.21 0.00 0.00 0.00 0.00 60.65 62.01 2bxr s ILE 281 Cb 0.08 -3.92 -0.02 0.00 0.01 0.00 0.00 42.46 38.61 2bxr s ILE 281 CO 0.67 0.28 0.67 -1.00 0.00 0.00 0.00 174.94 175.56 2bxr s HIS 282 N -1.29 3.35 -0.20 3.97 3.76 -0.16 -4.98 115.29 119.73 2bxr s HIS 282 Ca 0.48 0.95 -0.03 0.00 -0.15 0.00 0.00 55.06 56.31 2bxr s HIS 282 Cb -0.29 -2.86 -0.01 0.00 1.11 0.00 0.00 32.58 30.54 2bxr s HIS 282 CO 0.37 -0.24 -0.08 -0.06 -0.85 0.00 0.00 174.74 173.88 2bxr s PHE 283 N 2.18 2.91 -0.19 1.40 0.40 -1.26 -1.25 117.98 122.17 2bxr s PHE 283 Ca 0.30 -0.99 0.00 0.00 -0.60 0.00 0.00 56.93 55.64 2bxr s PHE 283 Cb -0.16 -2.04 0.02 0.00 0.51 0.00 0.00 43.02 41.35 2bxr s PHE 283 CO 0.10 -0.53 -0.17 1.03 0.70 0.00 0.00 175.22 176.35 2bxr s ARG 284 N 1.27 3.02 0.86 0.44 0.52 -0.45 -1.19 118.95 123.42 2bxr s ARG 284 Ca 0.03 -0.82 -0.10 0.00 -0.52 0.00 0.00 55.73 54.32 2bxr s ARG 284 Cb -0.14 -2.66 0.11 0.00 0.52 0.00 0.00 34.95 32.78 2bxr s ARG 284 CO -0.03 -0.23 1.12 -2.14 0.02 0.00 0.00 175.30 174.04 2bxr s PRO 285 N 1.31 1.46 0.46 3.54 0.02 -1.26 0.17 135.00 140.71 2bxr s PRO 285 Ca 0.04 1.36 -0.20 0.00 0.02 0.00 0.00 61.00 62.22 2bxr s PRO 285 Cb -0.14 -1.79 -0.14 0.00 0.02 0.00 0.00 34.50 32.46 2bxr s PRO 285 CO -0.11 -2.26 0.22 0.39 -0.33 0.00 0.00 177.00 174.91 2bxr n GLU 286 N -3.96 0.22 -2.18 5.54 -0.58 -0.33 -4.94 120.64 114.40 2bxr n GLU 286 Ca 0.10 0.08 -0.38 0.00 -0.42 0.00 0.00 57.16 56.54 2bxr n GLU 286 Cb 0.53 -1.24 -0.01 0.00 -0.57 0.00 0.00 31.44 30.15 2bxr n GLU 286 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2bxr s LEU 287 N 3.29 4.12 0.40 -4.62 1.43 -1.26 -4.97 118.68 117.08 2bxr s LEU 287 Ca 0.61 2.44 -0.24 0.00 -1.03 0.00 0.00 54.13 55.91 2bxr s LEU 287 Cb -0.56 -4.08 -0.11 0.00 0.03 0.00 0.00 46.19 41.47 2bxr s LEU 287 CO 0.61 -0.86 0.90 -2.65 0.23 0.00 0.00 176.35 174.58 2bxr n PRO 288 N -0.16 1.14 -0.13 1.29 -0.02 -1.26 -4.51 135.00 131.35 2bxr n PRO 288 Ca 0.05 0.41 -0.05 0.00 -2.02 0.00 0.00 63.50 61.90 2bxr n PRO 288 Cb 0.46 -1.88 0.02 0.00 -0.02 0.00 0.00 33.50 32.08 2bxr n PRO 288 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bxr h ALA 289 N 1.41 0.18 -0.78 3.55 0.00 -1.98 0.13 119.26 121.76 2bxr h ALA 289 Ca -0.43 0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.72 2bxr h ALA 289 Cb 1.35 0.45 -0.09 0.00 0.00 0.00 0.00 17.79 19.49 2bxr h ALA 289 CO 0.56 -0.52 -0.47 1.49 0.00 0.00 0.00 179.25 180.31 2bxr h GLU 290 N -0.08 -0.02 -0.43 0.00 4.81 -1.99 -1.39 114.58 115.49 2bxr h GLU 290 Ca 0.21 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2bxr h GLU 290 Cb 0.41 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 2bxr h GLU 290 CO -0.49 -0.01 0.14 -0.09 -0.73 0.00 0.00 179.01 177.83 2bxr h ARG 291 N -0.02 0.66 -1.16 1.92 2.43 -1.58 -1.64 114.38 114.99 2bxr h ARG 291 Ca 0.12 -0.14 0.34 0.00 -0.81 0.00 0.00 59.98 59.50 2bxr h ARG 291 Cb 0.34 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.74 2bxr h ARG 291 CO -0.74 0.64 0.88 -0.97 -1.51 0.00 0.00 179.97 178.27 2bxr h ASN 292 N 0.55 0.00 0.09 -3.80 -0.73 -0.23 0.16 115.58 111.62 2bxr h ASN 292 Ca 0.14 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 58.10 2bxr h ASN 292 Cb 0.25 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.84 2bxr h ASN 292 CO -0.01 0.00 -1.03 1.56 -0.37 0.00 0.00 177.43 177.59 2bxr h GLN 293 N 0.00 0.19 0.32 6.67 1.08 -0.58 -3.29 115.11 119.51 2bxr h GLN 293 Ca 0.55 -0.33 -0.01 0.00 -1.45 0.00 0.00 58.65 57.42 2bxr h GLN 293 Cb 2.31 0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 29.84 2bxr h GLN 293 CO -0.01 1.16 -0.38 1.25 -0.95 0.00 0.00 178.83 179.90 2bxr h LEU 294 N -0.51 -1.07 -2.12 1.46 5.85 -0.08 -2.51 115.31 116.33 2bxr h LEU 294 Ca -0.22 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.61 2bxr h LEU 294 Cb 1.56 0.36 -0.00 0.00 0.37 0.00 0.00 40.66 42.95 2bxr h LEU 294 CO 0.04 -0.48 0.06 0.16 -0.34 0.00 0.00 178.44 177.88 2bxr h ILE 295 N -0.71 0.82 0.00 4.05 3.07 -1.59 0.57 117.51 123.72 2bxr h ILE 295 Ca -0.04 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 66.36 2bxr h ILE 295 Cb 0.63 0.95 -0.00 0.00 -0.27 0.00 0.00 36.82 38.14 2bxr h ILE 295 CO -0.08 0.00 -0.05 -0.61 -1.05 0.00 0.00 178.15 176.36 2bxr h GLN 296 N 0.00 0.00 0.00 0.16 5.75 -1.53 -3.14 115.11 116.35 2bxr h GLN 296 Ca 0.04 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2bxr h GLN 296 Cb 0.16 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.71 2bxr h GLN 296 CO -0.00 0.05 -0.01 0.54 -2.65 0.00 0.00 178.83 176.76 2bxr n ARG 297 N -3.71 2.29 -3.55 1.69 1.74 0.20 -4.88 116.66 110.45 2bxr n ARG 297 Ca -0.02 -1.69 -0.41 0.00 -0.77 0.00 0.00 57.85 54.95 2bxr n ARG 297 Cb 0.15 -1.08 -0.09 0.00 -1.02 0.00 0.00 32.46 30.43 2bxr n ARG 297 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2bxr s LEU 298 N -1.38 5.53 0.65 0.55 1.43 -1.20 -4.57 118.68 119.68 2bxr s LEU 298 Ca 0.08 -1.72 -0.14 0.00 -1.03 0.00 0.00 54.13 51.31 2bxr s LEU 298 Cb 0.07 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 2bxr s LEU 298 CO 0.01 -0.65 1.08 -2.84 0.23 0.00 0.00 176.35 174.18 2bxr s PRO 299 N 1.42 2.99 0.63 1.29 0.02 -1.25 -4.30 135.00 135.79 2bxr s PRO 299 Ca 0.04 1.23 -0.10 0.00 0.02 0.00 0.00 61.00 62.19 2bxr s PRO 299 Cb -0.25 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.26 2bxr s PRO 299 CO 0.01 -1.07 1.02 -1.64 -0.33 0.00 0.00 177.00 174.98 2bxr s MET 300 N -4.29 3.33 0.86 5.54 -1.94 -1.26 -1.36 119.30 120.18 2bxr s MET 300 Ca 0.64 0.56 -0.14 0.00 -1.71 0.00 0.00 55.69 55.04 2bxr s MET 300 Cb -0.17 -2.11 0.20 0.00 2.01 0.00 0.00 34.83 34.76 2bxr s MET 300 CO 0.43 -0.68 1.17 0.41 -0.01 0.00 0.00 175.02 176.34 2bxr n GLY 301 N -2.76 -1.28 2.93 -0.03 0.00 -0.43 -4.84 105.19 98.77 2bxr n GLY 301 Ca 0.06 -1.73 -0.25 0.00 0.00 0.00 0.00 46.02 44.10 2bxr n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bxr s ALA 302 N -3.90 1.15 -0.00 4.61 0.00 -0.84 -3.67 121.76 119.10 2bxr s ALA 302 Ca 0.67 -0.39 -0.02 0.00 0.00 0.00 0.00 51.96 52.22 2bxr s ALA 302 Cb -0.02 -0.70 -0.00 0.00 0.00 0.00 0.00 23.12 22.39 2bxr s ALA 302 CO 0.47 -0.18 0.04 0.14 0.00 0.00 0.00 175.76 176.23 2bxr s VAL 303 N 1.26 0.05 -0.15 0.00 -7.23 -1.26 -0.27 120.40 112.81 2bxr s VAL 303 Ca -0.04 -0.43 -0.00 0.00 -1.81 0.00 0.00 61.98 59.69 2bxr s VAL 303 Cb -0.14 -0.21 -0.01 0.00 0.56 0.00 0.00 36.38 36.58 2bxr s VAL 303 CO -0.03 -0.24 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.77 2bxr s ILE 304 N -0.73 2.97 -0.17 -0.62 1.01 0.23 -1.81 121.20 122.08 2bxr s ILE 304 Ca -0.08 -0.68 -0.09 0.00 0.00 0.00 0.00 60.65 59.80 2bxr s ILE 304 Cb -0.05 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 2bxr s ILE 304 CO -0.00 0.51 0.13 -0.75 0.00 0.00 0.00 174.94 174.83 2bxr s LYS 305 N 0.59 3.95 -0.15 2.79 2.20 -0.74 -1.46 119.74 126.92 2bxr s LYS 305 Ca -0.08 -0.19 -0.02 0.00 -0.36 0.00 0.00 55.97 55.32 2bxr s LYS 305 Cb -0.16 -3.34 0.05 0.00 -1.51 0.00 0.00 37.83 32.87 2bxr s LYS 305 CO 0.03 0.45 0.02 0.00 -0.36 0.00 0.00 175.35 175.49 2bxr s MET 307 N 1.89 3.11 -0.21 0.00 -1.94 0.48 -1.55 119.30 121.09 2bxr s MET 307 Ca 0.01 -0.87 -0.11 0.00 -1.71 0.00 0.00 55.69 53.01 2bxr s MET 307 Cb -0.15 -3.59 -0.05 0.00 2.01 0.00 0.00 34.83 33.05 2bxr s MET 307 CO -0.07 -0.52 0.20 1.41 -0.01 0.00 0.00 175.02 176.03 2bxr s MET 308 N 1.57 4.16 -0.08 2.03 1.75 -0.59 -1.80 119.30 126.35 2bxr s MET 308 Ca 0.03 -0.13 -0.00 0.00 -1.25 0.00 0.00 55.69 54.34 2bxr s MET 308 Cb -0.18 -3.47 -0.03 0.00 2.84 0.00 0.00 34.83 33.99 2bxr s MET 308 CO 0.06 0.18 -0.05 0.71 -0.65 0.00 0.00 175.02 175.26 2bxr s TYR 309 N 0.71 2.99 0.08 4.11 2.02 -0.66 -1.20 117.35 125.39 2bxr s TYR 309 Ca 0.11 0.03 0.03 0.00 -0.37 0.00 0.00 57.07 56.86 2bxr s TYR 309 Cb -0.13 -1.75 -0.03 0.00 -0.40 0.00 0.00 41.96 39.65 2bxr s TYR 309 CO 0.02 0.33 -0.08 0.71 -1.57 0.00 0.00 175.55 174.95 2bxr s TYR 310 N -0.72 0.88 0.17 2.71 2.02 -0.71 0.15 117.35 121.86 2bxr s TYR 310 Ca 0.11 -0.66 -0.13 0.00 -0.37 0.00 0.00 57.07 56.03 2bxr s TYR 310 Cb -0.11 -0.50 0.07 0.00 -0.40 0.00 0.00 41.96 41.02 2bxr s TYR 310 CO 0.02 -0.07 1.76 -0.22 -1.57 0.00 0.00 175.55 175.46 2bxr h LYS 311 N 3.79 0.83 -5.34 -0.62 3.64 -1.86 -3.32 116.57 113.69 2bxr h LYS 311 Ca -0.36 -0.12 -0.40 0.00 -1.27 0.00 0.00 60.65 58.50 2bxr h LYS 311 Cb 1.19 -0.15 -0.16 0.00 -0.41 0.00 0.00 32.23 32.70 2bxr h LYS 311 CO 0.51 0.68 -0.74 -1.21 -2.27 0.00 0.00 179.45 176.42 2bxr s GLU 312 N -5.71 1.12 0.00 1.90 2.02 -1.26 -4.66 118.70 112.11 2bxr s GLU 312 Ca -0.13 -1.40 -0.04 0.00 0.02 0.00 0.00 54.97 53.42 2bxr s GLU 312 Cb 0.13 -0.87 -0.18 0.00 0.10 0.00 0.00 34.13 33.30 2bxr s GLU 312 CO 0.78 0.14 3.10 0.00 0.02 0.00 0.00 175.26 179.30 2bxr n ALA 313 N 0.05 5.60 -0.55 5.21 0.00 -1.26 -4.75 120.51 124.80 2bxr n ALA 313 Ca -0.12 -1.23 0.44 0.00 0.00 0.00 0.00 53.44 52.53 2bxr n ALA 313 Cb 0.59 -1.89 0.73 0.00 0.00 0.00 0.00 19.45 18.88 2bxr n ALA 313 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2bxr h PHE 314 N 2.36 0.28 -0.24 0.00 -5.15 -1.97 0.18 116.94 112.40 2bxr h PHE 314 Ca 0.13 0.01 -0.02 0.00 -0.20 0.00 0.00 57.97 57.89 2bxr h PHE 314 Cb 1.35 -0.07 -0.01 0.00 0.22 0.00 0.00 35.95 37.44 2bxr h PHE 314 CO 1.28 -0.13 0.08 0.11 -2.00 0.00 0.00 178.31 177.65 2bxr h TRP 315 N 0.03 0.38 -0.91 6.09 0.09 -1.85 -2.01 115.95 117.76 2bxr h TRP 315 Ca 0.87 -0.04 0.25 0.00 0.09 0.00 0.00 58.89 60.07 2bxr h TRP 315 Cb 3.11 -0.11 -0.15 0.00 0.08 0.00 0.00 29.16 32.09 2bxr h TRP 315 CO -0.00 0.42 0.23 0.87 0.09 0.00 0.00 178.44 180.05 2bxr h LYS 316 N 0.22 0.16 0.00 0.12 1.79 -0.65 0.62 116.57 118.83 2bxr h LYS 316 Ca 0.08 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.52 2bxr h LYS 316 Cb 0.22 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2bxr h LYS 316 CO -0.00 0.11 -0.08 0.87 -1.08 0.00 0.00 179.45 179.26 2bxr h LYS 317 N 0.17 0.00 -0.62 3.15 1.57 -1.40 -1.09 116.57 118.34 2bxr h LYS 317 Ca 0.58 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 2bxr h LYS 317 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2bxr h LYS 317 CO -0.70 0.08 0.00 1.63 -0.57 0.00 0.00 179.45 179.89 2bxr n LYS 318 N -3.71 4.38 -2.84 3.15 5.02 -0.48 -4.90 118.16 118.77 2bxr n LYS 318 Ca -0.02 -2.94 -0.21 0.00 -2.02 0.00 0.00 58.31 53.12 2bxr n LYS 318 Cb 0.19 -2.12 0.01 0.00 -0.02 0.00 0.00 35.03 33.09 2bxr n LYS 318 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2bxr n ASP 319 N 0.78 -5.28 -4.57 4.39 -0.08 -0.41 -4.98 116.55 106.41 2bxr n ASP 319 Ca 0.26 -0.16 -0.39 0.00 -1.51 0.00 0.00 54.79 52.99 2bxr n ASP 319 Cb 1.06 -4.34 -0.11 0.00 2.34 0.00 0.00 41.12 40.08 2bxr n ASP 319 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 2bxr s TYR 320 N -3.01 3.22 0.28 -0.67 2.02 0.09 -3.09 117.35 116.19 2bxr s TYR 320 Ca 0.20 -0.01 -0.03 0.00 -0.37 0.00 0.00 57.07 56.87 2bxr s TYR 320 Cb -0.09 -2.42 0.59 0.00 -0.40 0.00 0.00 41.96 39.63 2bxr s TYR 320 CO 0.25 -0.24 1.61 0.00 -1.57 0.00 0.00 175.55 175.60 2bxr n GLY 322 N -1.45 0.78 3.45 0.00 0.00 -1.26 -4.60 105.19 102.10 2bxr n GLY 322 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2bxr n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bxr s MET 324 N 0.61 0.60 -0.37 0.00 0.23 -1.19 -2.30 119.30 116.88 2bxr s MET 324 Ca -0.03 -0.10 -0.14 0.00 -1.03 0.00 0.00 55.69 54.39 2bxr s MET 324 Cb -0.14 -0.63 -0.00 0.00 -1.53 0.00 0.00 34.83 32.52 2bxr s MET 324 CO 0.03 -0.02 0.28 0.42 -2.03 0.00 0.00 175.02 173.70 2bxr s ILE 325 N 0.57 5.26 -0.27 3.16 1.09 -0.35 -1.13 121.20 129.53 2bxr s ILE 325 Ca -0.07 -0.38 -0.07 0.00 -1.10 0.00 0.00 60.65 59.04 2bxr s ILE 325 Cb -0.10 -3.83 -0.01 0.00 -1.06 0.00 0.00 42.46 37.47 2bxr s ILE 325 CO -0.00 -0.16 0.06 -0.63 -0.10 0.00 0.00 174.94 174.11 2bxr s ILE 326 N 1.75 3.99 -0.57 2.92 1.01 -0.84 -0.79 121.20 128.66 2bxr s ILE 326 Ca 0.06 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.29 2bxr s ILE 326 Cb -0.18 -2.95 0.33 0.00 0.01 0.00 0.00 42.46 39.67 2bxr s ILE 326 CO 0.11 0.22 0.92 1.21 0.00 0.00 0.00 174.94 177.40 2bxr n GLU 327 N 4.88 3.07 -4.53 2.79 2.13 -0.32 -4.65 120.64 124.01 2bxr n GLU 327 Ca -0.16 -4.77 -0.33 0.00 0.66 0.00 0.00 57.16 52.56 2bxr n GLU 327 Cb 0.50 -2.21 -0.11 0.00 0.27 0.00 0.00 31.44 29.89 2bxr n GLU 327 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2bxr s ASP 328 N -3.35 4.67 0.05 4.31 2.15 -1.26 -4.48 116.67 118.75 2bxr s ASP 328 Ca 0.48 -0.07 -0.18 0.00 0.43 0.00 0.00 52.55 53.20 2bxr s ASP 328 Cb 0.28 -1.14 -0.08 0.00 -0.30 0.00 0.00 42.92 41.68 2bxr s ASP 328 CO -0.13 0.32 1.28 -0.08 -0.17 0.00 0.00 175.17 176.40 2bxr h GLU 329 N 4.88 -0.42 -2.08 4.34 4.57 -1.97 -3.24 114.58 120.66 2bxr h GLU 329 Ca -0.49 0.03 -0.78 0.00 -1.18 0.00 0.00 59.36 56.94 2bxr h GLU 329 Cb 1.17 0.09 -0.27 0.00 -0.16 0.00 0.00 28.75 29.58 2bxr h GLU 329 CO 0.53 -0.28 1.05 -0.25 -1.18 0.00 0.00 179.01 178.89 2bxr n ASP 330 N -3.98 7.47 -4.10 1.04 10.43 -1.26 -4.90 116.55 121.25 2bxr n ASP 330 Ca -0.05 -3.79 -0.29 0.00 2.57 0.00 0.00 54.79 53.23 2bxr n ASP 330 Cb 0.22 -1.10 -0.17 0.00 1.84 0.00 0.00 41.12 41.91 2bxr n ASP 330 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2bxr s ALA 331 N -4.16 1.80 0.04 2.24 0.00 -1.23 -5.07 121.76 115.38 2bxr s ALA 331 Ca 0.48 -0.78 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 2bxr s ALA 331 Cb 0.36 -0.80 -0.07 0.00 0.00 0.00 0.00 23.12 22.61 2bxr s ALA 331 CO -0.33 0.05 1.24 -1.00 0.00 0.00 0.00 175.76 175.72 2bxr h PRO 332 N 7.16 -0.36 -6.67 0.00 0.13 -1.92 -3.43 132.00 126.92 2bxr h PRO 332 Ca -0.28 0.02 -0.51 0.00 -0.87 0.00 0.00 66.00 64.36 2bxr h PRO 332 Cb 1.19 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2bxr h PRO 332 CO 0.49 -0.24 0.41 0.42 -0.23 0.00 0.00 178.00 178.85 2bxr s ILE 333 N -4.19 4.07 -0.14 -3.56 -1.09 -1.26 -4.51 121.20 110.52 2bxr s ILE 333 Ca -0.07 1.86 0.17 0.00 -2.23 0.00 0.00 60.65 60.38 2bxr s ILE 333 Cb 0.02 -4.19 -0.24 0.00 -1.58 0.00 0.00 42.46 36.48 2bxr s ILE 333 CO 0.26 0.36 0.15 -1.20 -1.23 0.00 0.00 174.94 173.28 2bxr n SER 334 N 2.14 0.63 -3.74 3.58 7.64 -0.19 -4.72 113.62 118.96 2bxr n SER 334 Ca 0.01 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.76 2bxr n SER 334 Cb 0.47 1.18 -0.10 0.00 -1.01 0.00 0.00 64.21 64.75 2bxr n SER 334 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2bxr s ILE 335 N -2.66 0.01 0.16 0.44 2.07 -1.24 -1.99 121.20 118.00 2bxr s ILE 335 Ca -0.08 -0.07 0.08 0.00 -1.41 0.00 0.00 60.65 59.17 2bxr s ILE 335 Cb 0.07 -0.57 -0.04 0.00 0.13 0.00 0.00 42.46 42.05 2bxr s ILE 335 CO 0.74 -0.04 -0.17 -0.89 -1.91 0.00 0.00 174.94 172.67 2bxr s THR 336 N -0.05 1.76 -0.02 4.00 2.01 -0.29 -1.53 115.64 121.52 2bxr s THR 336 Ca -0.02 -1.93 -0.09 0.00 0.31 0.00 0.00 61.69 59.96 2bxr s THR 336 Cb -0.03 -1.83 0.01 0.00 0.01 0.00 0.00 72.50 70.66 2bxr s THR 336 CO 0.01 -0.35 0.19 -0.76 -0.69 0.00 0.00 174.62 173.02 2bxr s LEU 337 N -2.71 1.31 0.46 4.42 1.43 0.20 -3.13 118.68 120.66 2bxr s LEU 337 Ca 0.16 -0.01 -0.24 0.00 -1.03 0.00 0.00 54.13 53.01 2bxr s LEU 337 Cb -0.05 0.83 -0.07 0.00 0.03 0.00 0.00 46.19 46.93 2bxr s LEU 337 CO 0.06 -0.33 1.25 -0.62 0.23 0.00 0.00 176.35 176.94 2bxr s ASP 338 N -1.07 6.01 0.00 2.29 -1.08 -1.21 0.28 116.67 121.88 2bxr s ASP 338 Ca -0.11 2.51 0.16 0.00 -0.52 0.00 0.00 52.55 54.59 2bxr s ASP 338 Cb -0.06 -2.62 0.27 0.00 -1.46 0.00 0.00 42.92 39.05 2bxr s ASP 338 CO 0.02 -1.05 1.11 -0.67 0.52 0.00 0.00 175.17 175.10 2bxr n ASP 339 N -0.42 0.62 -4.74 -0.34 2.03 -0.07 -4.75 116.55 108.88 2bxr n ASP 339 Ca 0.07 -2.00 -0.36 0.00 0.52 0.00 0.00 54.79 53.02 2bxr n ASP 339 Cb 0.46 -0.26 0.06 0.00 -0.72 0.00 0.00 41.12 40.66 2bxr n ASP 339 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2bxr s THR 340 N 0.00 2.29 0.82 5.18 2.01 -1.24 -4.55 115.64 120.14 2bxr s THR 340 Ca 0.21 0.17 -0.13 0.00 0.31 0.00 0.00 61.69 62.25 2bxr s THR 340 Cb 0.24 -2.98 0.09 0.00 0.01 0.00 0.00 72.50 69.87 2bxr s THR 340 CO -0.11 -0.05 1.21 -0.54 -0.69 0.00 0.00 174.62 174.44 2bxr s LYS 341 N -3.51 1.58 0.65 4.92 -0.14 -0.98 -4.84 119.74 117.42 2bxr s LYS 341 Ca 0.79 1.76 0.35 0.00 -1.36 0.00 0.00 55.97 57.51 2bxr s LYS 341 Cb -0.33 -1.77 1.92 0.00 -1.68 0.00 0.00 37.83 35.98 2bxr s LYS 341 CO 0.39 -2.26 2.11 -1.00 -0.76 0.00 0.00 175.35 173.83 2bxr h PRO 342 N -0.97 0.00 -0.02 -1.68 0.13 -1.93 0.19 132.00 127.72 2bxr h PRO 342 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2bxr h PRO 342 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2bxr h PRO 342 CO 0.46 0.00 -0.28 -0.40 -0.23 0.00 0.00 178.00 177.55 2bxr n ASP 343 N -3.14 1.81 0.00 1.44 5.75 -1.26 -4.97 116.55 116.18 2bxr n ASP 343 Ca -0.02 -1.40 0.00 0.00 -0.01 0.00 0.00 54.79 53.37 2bxr n ASP 343 Cb 0.27 0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 2bxr n ASP 343 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bxr n GLY 344 N 1.36 0.58 3.83 6.12 0.00 0.05 -5.08 105.19 112.04 2bxr n GLY 344 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2bxr n GLY 344 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bxr s SER 345 N -2.88 6.52 -0.84 1.61 1.04 -1.26 -4.42 113.70 113.47 2bxr s SER 345 Ca 0.00 1.66 -0.03 0.00 0.48 0.00 0.00 55.95 58.06 2bxr s SER 345 Cb 0.00 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.60 2bxr s SER 345 CO 0.00 -0.65 0.66 0.18 0.98 0.00 0.00 173.24 174.40 2bxr n LEU 346 N -1.42 -3.57 -4.63 2.42 4.32 -1.26 -2.33 117.00 110.53 2bxr n LEU 346 Ca 0.07 -0.69 -0.41 0.00 -0.02 0.00 0.00 56.01 54.96 2bxr n LEU 346 Cb 0.54 -2.27 0.01 0.00 -1.62 0.00 0.00 43.42 40.08 2bxr n LEU 346 CO 0.44 -0.10 0.65 -0.81 -1.22 0.00 0.00 177.39 176.36 2bxr n PRO 347 N -2.57 1.45 -3.49 3.23 -0.04 -1.25 -4.14 135.00 128.19 2bxr n PRO 347 Ca -0.19 0.52 -0.16 0.00 -0.04 0.00 0.00 63.50 63.64 2bxr n PRO 347 Cb 0.62 -2.12 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 2bxr n PRO 347 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bxr s ALA 348 N -1.27 -1.69 -0.15 0.55 0.00 -1.26 -1.73 121.76 116.21 2bxr s ALA 348 Ca 0.63 1.00 0.01 0.00 0.00 0.00 0.00 51.96 53.59 2bxr s ALA 348 Cb -0.54 0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.93 2bxr s ALA 348 CO 0.57 -0.52 -0.15 0.42 0.00 0.00 0.00 175.76 176.07 2bxr s ILE 349 N -2.16 1.65 -0.16 0.00 1.01 -0.34 -0.89 121.20 120.31 2bxr s ILE 349 Ca -0.06 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 59.76 2bxr s ILE 349 Cb -0.00 -1.54 -0.05 0.00 0.01 0.00 0.00 42.46 40.89 2bxr s ILE 349 CO 0.01 0.47 0.31 -0.32 0.00 0.00 0.00 174.94 175.41 2bxr s MET 350 N 1.41 4.27 0.01 2.79 -2.45 0.14 -1.54 119.30 123.93 2bxr s MET 350 Ca 0.04 0.12 0.01 0.00 -1.25 0.00 0.00 55.69 54.61 2bxr s MET 350 Cb -0.13 -3.43 -0.01 0.00 1.25 0.00 0.00 34.83 32.51 2bxr s MET 350 CO -0.10 0.23 -0.03 0.20 1.05 0.00 0.00 175.02 176.36 2bxr s GLY 351 N 0.50 0.19 -0.16 2.11 0.00 -0.59 0.62 107.32 109.99 2bxr s GLY 351 Ca 0.17 -0.27 -0.09 0.00 0.00 0.00 0.00 44.72 44.54 2bxr s GLY 351 CO 0.04 -0.27 0.14 -1.36 0.00 0.00 0.00 173.10 171.65 2bxr s PHE 352 N -0.44 3.51 -0.27 1.90 0.08 -0.59 -1.35 117.98 120.83 2bxr s PHE 352 Ca -0.03 0.45 -0.03 0.00 0.12 0.00 0.00 56.93 57.43 2bxr s PHE 352 Cb -0.04 -2.05 0.02 0.00 -0.57 0.00 0.00 43.02 40.38 2bxr s PHE 352 CO -0.00 0.52 -0.00 -1.50 -0.10 0.00 0.00 175.22 174.14 2bxr s ILE 353 N -0.37 3.27 0.14 0.64 -1.16 -0.53 -1.02 121.20 122.18 2bxr s ILE 353 Ca 0.12 -0.96 -0.03 0.00 -0.51 0.00 0.00 60.65 59.27 2bxr s ILE 353 Cb -0.12 -2.70 -0.03 0.00 0.61 0.00 0.00 42.46 40.22 2bxr s ILE 353 CO 0.01 0.11 0.11 -1.48 -2.81 0.00 0.00 174.94 170.88 2bxr s LEU 354 N 1.38 1.57 0.00 8.50 0.05 -1.26 -0.60 118.68 128.31 2bxr s LEU 354 Ca 0.00 -1.14 0.00 0.00 0.05 0.00 0.00 54.13 53.04 2bxr s LEU 354 Cb -0.17 0.50 0.00 0.00 -2.05 0.00 0.00 46.19 44.47 2bxr s LEU 354 CO -0.02 -0.77 0.00 0.00 -0.55 0.00 0.00 176.35 175.01 2bxr n ALA 355 N -0.13 0.00 0.28 1.48 0.00 0.63 -2.79 120.51 119.98 2bxr n ALA 355 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.50 2bxr n ALA 355 Cb 0.64 0.00 0.77 0.00 0.00 0.00 0.00 19.45 20.86 2bxr n ALA 355 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2bxr h ARG 356 N 0.00 0.00 -0.74 0.00 -0.00 -1.89 -0.73 114.38 111.02 2bxr h ARG 356 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 59.98 59.92 2bxr h ARG 356 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 29.94 2bxr h ARG 356 CO 0.00 0.03 0.24 0.87 -0.00 0.00 0.00 179.97 181.11 2bxr h LYS 357 N 0.00 1.15 -0.01 0.08 1.57 -1.90 -1.21 116.57 116.25 2bxr h LYS 357 Ca -0.00 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2bxr h LYS 357 Cb 0.07 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 2bxr h LYS 357 CO 0.00 0.97 -0.01 0.00 -0.57 0.00 0.00 179.45 179.85 2bxr h ALA 358 N 1.12 -0.00 -0.16 3.86 0.00 -1.19 0.00 119.26 122.89 2bxr h ALA 358 Ca 0.24 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.18 2bxr h ALA 358 Cb 0.30 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2bxr h ALA 358 CO -0.01 -0.51 -0.02 -0.44 0.00 0.00 0.00 179.25 178.28 2bxr h ASP 359 N -0.02 -0.10 0.04 0.00 3.32 -1.29 0.19 116.42 118.57 2bxr h ASP 359 Ca 0.01 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.11 2bxr h ASP 359 Cb 0.03 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2bxr h ASP 359 CO -0.02 -0.03 -0.09 -0.09 -1.72 0.00 0.00 179.24 177.30 2bxr h ARG 360 N 0.03 -0.17 -0.00 3.56 2.43 -1.13 -3.19 114.38 115.92 2bxr h ARG 360 Ca 0.08 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2bxr h ARG 360 Cb 0.10 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2bxr h ARG 360 CO -0.15 -0.11 -0.31 1.28 -1.51 0.00 0.00 179.97 179.17 2bxr n LEU 361 N -5.21 0.42 -0.13 3.80 4.77 -0.02 -3.93 117.00 116.71 2bxr n LEU 361 Ca -0.06 0.10 -0.06 0.00 -0.03 0.00 0.00 56.01 55.95 2bxr n LEU 361 Cb 0.13 -0.29 0.02 0.00 -2.33 0.00 0.00 43.42 40.95 2bxr n LEU 361 CO 0.30 0.10 0.99 0.00 -1.33 0.00 0.00 177.39 177.44 2bxr h ALA 362 N 3.13 0.50 -1.06 -1.18 0.00 -0.62 -1.78 119.26 118.25 2bxr h ALA 362 Ca 0.00 0.02 0.41 0.00 0.00 0.00 0.00 54.91 55.34 2bxr h ALA 362 Cb 0.48 -0.05 -0.16 0.00 0.00 0.00 0.00 17.79 18.07 2bxr h ALA 362 CO 0.00 -0.17 0.62 1.63 0.00 0.00 0.00 179.25 181.33 2bxr n LYS 363 N -4.93 -0.05 -1.28 0.00 4.76 -1.25 -4.74 118.16 110.67 2bxr n LYS 363 Ca 0.02 1.26 -0.31 0.00 -2.87 0.00 0.00 58.31 56.40 2bxr n LYS 363 Cb 0.11 -2.33 0.09 0.00 -1.84 0.00 0.00 35.03 31.06 2bxr n LYS 363 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2bxr s LEU 364 N -9.88 3.05 0.33 -0.35 1.43 -0.67 -4.99 118.68 107.59 2bxr s LEU 364 Ca -0.08 1.84 -0.28 0.00 -1.03 0.00 0.00 54.13 54.58 2bxr s LEU 364 Cb 0.31 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.91 2bxr s LEU 364 CO 0.75 -2.03 1.21 -2.28 0.23 0.00 0.00 176.35 174.22 2bxr s HIS 365 N -2.87 3.25 0.25 0.29 5.65 -1.26 -4.91 115.29 115.69 2bxr s HIS 365 Ca 0.62 1.55 -0.13 0.00 0.25 0.00 0.00 55.06 57.34 2bxr s HIS 365 Cb -0.17 -3.48 0.33 0.00 -1.18 0.00 0.00 32.58 28.08 2bxr s HIS 365 CO 0.55 -1.28 1.57 -0.22 -0.65 0.00 0.00 174.74 174.71 2bxr h LYS 366 N 3.40 -0.02 -0.48 2.88 3.64 -1.94 0.92 116.57 124.98 2bxr h LYS 366 Ca -0.48 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 58.96 2bxr h LYS 366 Cb 1.22 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.02 2bxr h LYS 366 CO 0.65 -0.01 0.32 0.93 -2.27 0.00 0.00 179.45 179.08 2bxr h GLU 367 N -0.02 0.38 0.01 1.90 4.39 -2.00 -1.63 114.58 117.61 2bxr h GLU 367 Ca 0.39 -0.02 -0.22 0.00 0.34 0.00 0.00 59.36 59.85 2bxr h GLU 367 Cb 0.64 -0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2bxr h GLU 367 CO -0.94 0.25 -0.94 0.82 -1.16 0.00 0.00 179.01 177.04 2bxr h ILE 368 N 0.39 1.43 -0.34 3.13 2.04 -1.21 -2.75 117.51 120.20 2bxr h ILE 368 Ca 0.21 -2.51 0.01 0.00 1.00 0.00 0.00 64.86 63.57 2bxr h ILE 368 Cb 0.34 2.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.84 2bxr h ILE 368 CO -0.05 0.74 0.19 0.03 0.00 0.00 0.00 178.15 179.07 2bxr h ARG 369 N 0.19 0.38 -0.24 2.37 3.08 -0.70 -1.98 114.38 117.48 2bxr h ARG 369 Ca -0.07 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.00 2bxr h ARG 369 Cb 1.57 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 31.49 2bxr h ARG 369 CO 0.16 0.25 -0.06 -0.22 -1.07 0.00 0.00 179.97 179.03 2bxr h LYS 370 N 0.40 0.00 -0.31 0.04 3.64 -1.22 0.24 116.57 119.35 2bxr h LYS 370 Ca 0.13 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 2bxr h LYS 370 Cb 0.01 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 2bxr h LYS 370 CO -0.06 0.00 0.19 -0.22 -2.27 0.00 0.00 179.45 177.09 2bxr h LYS 371 N 0.00 0.38 0.14 1.90 3.64 -1.50 -0.14 116.57 120.99 2bxr h LYS 371 Ca 0.12 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2bxr h LYS 371 Cb 0.18 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2bxr h LYS 371 CO -0.25 0.25 -0.14 0.87 -2.27 0.00 0.00 179.45 177.91 2bxr h LYS 372 N 0.39 -0.30 -0.13 1.90 1.57 -0.46 -2.37 116.57 117.17 2bxr h LYS 372 Ca 0.12 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.97 2bxr h LYS 372 Cb -0.02 0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 2bxr h LYS 372 CO -0.05 -0.20 -0.27 0.82 -0.57 0.00 0.00 179.45 179.18 2bxr h ILE 373 N -0.31 0.36 -0.98 1.86 2.04 -0.51 -2.35 117.51 117.61 2bxr h ILE 373 Ca 0.00 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.06 2bxr h ILE 373 Cb 0.30 0.36 -0.09 0.00 -0.74 0.00 0.00 36.82 36.64 2bxr h ILE 373 CO -0.04 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.73 2bxr n GLU 375 N -4.67 0.18 -0.04 0.00 0.28 -0.94 -1.13 120.64 114.33 2bxr n GLU 375 Ca 0.22 0.11 -0.12 0.00 -0.16 0.00 0.00 57.16 57.21 2bxr n GLU 375 Cb 0.61 -1.67 -0.07 0.00 1.43 0.00 0.00 31.44 31.74 2bxr n GLU 375 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2bxr h LEU 376 N 0.00 0.25 -0.90 -1.84 5.85 -0.06 -3.02 115.31 115.59 2bxr h LEU 376 Ca 0.00 -0.40 -0.08 0.00 0.84 0.00 0.00 57.88 58.24 2bxr h LEU 376 Cb 0.66 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2bxr h LEU 376 CO 0.00 0.59 -0.05 1.88 -0.34 0.00 0.00 178.44 180.53 2bxr h TYR 377 N -0.10 0.81 -0.20 1.25 0.99 -1.17 0.15 116.97 118.71 2bxr h TYR 377 Ca 0.03 -0.13 0.04 0.00 2.00 0.00 0.00 58.73 60.68 2bxr h TYR 377 Cb 0.50 -0.22 -0.04 0.00 1.00 0.00 0.00 36.73 37.97 2bxr h TYR 377 CO 0.06 0.78 -0.07 0.00 -0.00 0.00 0.00 178.16 178.93 2bxr h ALA 378 N 1.25 0.10 -0.00 3.88 0.00 -1.15 0.16 119.26 123.49 2bxr h ALA 378 Ca 0.13 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2bxr h ALA 378 Cb 0.50 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2bxr h ALA 378 CO 0.03 -0.50 -0.47 0.36 0.00 0.00 0.00 179.25 178.66 2bxr n LYS 379 N -5.22 0.14 0.07 0.00 2.85 -0.90 0.98 118.16 116.08 2bxr n LYS 379 Ca -0.02 -0.08 -0.19 0.00 -1.05 0.00 0.00 58.31 56.97 2bxr n LYS 379 Cb 0.15 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 32.89 2bxr n LYS 379 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2bxr h VAL 380 N 0.20 1.13 -0.02 0.58 2.07 -0.51 -3.35 116.25 116.35 2bxr h VAL 380 Ca 0.00 -2.74 0.00 0.00 0.82 0.00 0.00 66.70 64.78 2bxr h VAL 380 Cb 0.50 2.79 0.00 0.00 -1.52 0.00 0.00 31.29 33.06 2bxr h VAL 380 CO 0.00 0.83 -0.23 0.18 0.02 0.00 0.00 177.57 178.37 2bxr n LEU 381 N -3.51 2.19 -4.07 2.57 4.77 0.53 -4.96 117.00 114.51 2bxr n LEU 381 Ca -0.18 -0.75 -0.32 0.00 -0.03 0.00 0.00 56.01 54.73 2bxr n LEU 381 Cb 1.06 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 42.12 2bxr n LEU 381 CO 0.52 0.38 -0.03 0.61 -1.33 0.00 0.00 177.39 177.54 2bxr n GLY 382 N 1.36 -0.41 2.84 -0.72 0.00 0.28 -4.96 105.19 103.57 2bxr n GLY 382 Ca 0.12 0.15 -0.22 0.00 0.00 0.00 0.00 46.02 46.08 2bxr n GLY 382 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bxr s SER 383 N -3.52 1.38 0.43 1.61 0.01 -0.56 -5.01 113.70 108.04 2bxr s SER 383 Ca 0.57 -0.13 0.11 0.00 1.31 0.00 0.00 55.95 57.80 2bxr s SER 383 Cb -0.30 -0.49 0.97 0.00 0.21 0.00 0.00 66.02 66.41 2bxr s SER 383 CO 0.89 -0.12 2.05 -0.61 0.41 0.00 0.00 173.24 175.85 2bxr h GLN 384 N 7.82 0.42 0.00 12.44 5.75 -1.93 -2.33 115.11 137.28 2bxr h GLN 384 Ca -0.29 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.19 2bxr h GLN 384 Cb 1.14 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.59 2bxr h GLN 384 CO 0.37 0.28 0.00 -0.85 -2.65 0.00 0.00 178.83 175.97 2bxr n GLU 385 N -4.48 0.16 0.26 1.69 0.28 -1.26 -1.58 120.64 115.71 2bxr n GLU 385 Ca 0.04 0.46 0.18 0.00 -0.16 0.00 0.00 57.16 57.68 2bxr n GLU 385 Cb 0.17 -1.85 0.89 0.00 1.43 0.00 0.00 31.44 32.08 2bxr n GLU 385 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2bxr h ALA 386 N 2.22 1.00 -0.00 -1.84 0.00 -1.75 -2.49 119.26 116.39 2bxr h ALA 386 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bxr h ALA 386 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2bxr h ALA 386 CO 0.00 0.00 -0.24 1.28 0.00 0.00 0.00 179.25 180.29 2bxr n LEU 387 N -2.78 0.60 -3.20 0.00 4.32 -0.61 -4.47 117.00 110.85 2bxr n LEU 387 Ca -0.01 -0.03 -0.28 0.00 -0.02 0.00 0.00 56.01 55.67 2bxr n LEU 387 Cb 0.12 -0.21 -0.06 0.00 -1.62 0.00 0.00 43.42 41.64 2bxr n LEU 387 CO 0.18 0.12 0.16 1.41 -1.22 0.00 0.00 177.39 178.05 2bxr n HIS 388 N -1.06 3.81 -1.05 -1.77 8.25 -0.94 -5.07 115.22 117.40 2bxr n HIS 388 Ca 0.11 -4.02 -0.31 0.00 -0.26 0.00 0.00 57.72 53.24 2bxr n HIS 388 Cb 0.32 -0.55 0.12 0.00 1.12 0.00 0.00 29.99 31.00 2bxr n HIS 388 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2bxr s PRO 389 N -3.02 1.77 -0.04 -0.41 0.04 -1.26 -4.75 135.00 127.34 2bxr s PRO 389 Ca 0.44 1.33 0.16 0.00 0.04 0.00 0.00 61.00 62.98 2bxr s PRO 389 Cb 0.21 -1.83 -0.25 0.00 0.04 0.00 0.00 34.50 32.67 2bxr s PRO 389 CO -0.07 -2.03 0.33 0.28 0.04 0.00 0.00 177.00 175.55 2bxr n VAL 390 N -3.78 0.11 -3.65 -0.36 0.31 0.41 -4.95 118.33 106.42 2bxr n VAL 390 Ca 0.10 -0.41 -0.04 0.00 -0.01 0.00 0.00 64.34 63.98 2bxr n VAL 390 Cb 0.53 0.05 -0.01 0.00 -0.91 0.00 0.00 33.84 33.49 2bxr n VAL 390 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 2bxr s HIS 391 N -3.08 -0.18 -0.18 3.52 5.65 -1.20 -5.01 115.29 114.80 2bxr s HIS 391 Ca -0.06 -0.03 -0.09 0.00 0.25 0.00 0.00 55.06 55.13 2bxr s HIS 391 Cb 0.10 0.59 0.07 0.00 -1.18 0.00 0.00 32.58 32.16 2bxr s HIS 391 CO 0.69 -0.62 0.42 -0.47 -0.65 0.00 0.00 174.74 174.11 2bxr s TYR 392 N -3.06 -0.68 0.04 3.88 5.04 -1.26 -1.65 117.35 119.66 2bxr s TYR 392 Ca 0.10 1.39 0.09 0.00 -2.44 0.00 0.00 57.07 56.22 2bxr s TYR 392 Cb -0.00 0.29 -0.03 0.00 0.35 0.00 0.00 41.96 42.57 2bxr s TYR 392 CO -0.02 -0.39 -0.26 -1.21 -1.34 0.00 0.00 175.55 172.32 2bxr s GLU 393 N 1.77 1.84 -0.16 4.97 0.41 -0.75 -5.01 118.70 121.79 2bxr s GLU 393 Ca -0.07 -1.09 -0.26 0.00 -0.41 0.00 0.00 54.97 53.13 2bxr s GLU 393 Cb -0.09 -1.99 0.07 0.00 -1.78 0.00 0.00 34.13 30.33 2bxr s GLU 393 CO -0.13 0.52 0.66 -1.83 -0.49 0.00 0.00 175.26 173.99 2bxr s GLU 394 N -1.19 0.90 -0.06 1.61 -1.05 -1.26 -0.39 118.70 117.25 2bxr s GLU 394 Ca 0.12 0.59 0.03 0.00 -0.15 0.00 0.00 54.97 55.56 2bxr s GLU 394 Cb -0.10 0.43 -0.03 0.00 -0.44 0.00 0.00 34.13 33.99 2bxr s GLU 394 CO 0.02 -0.20 -0.13 0.21 0.95 0.00 0.00 175.26 176.11 2bxr s LYS 395 N -0.38 2.67 -0.36 -4.83 2.20 -1.12 -5.00 119.74 112.92 2bxr s LYS 395 Ca -0.05 -0.67 -0.13 0.00 -0.36 0.00 0.00 55.97 54.76 2bxr s LYS 395 Cb -0.03 -2.45 -0.00 0.00 -1.51 0.00 0.00 37.83 33.84 2bxr s LYS 395 CO 0.05 0.58 0.24 1.21 -0.36 0.00 0.00 175.35 177.07 2bxr s ASN 396 N -0.60 5.98 0.08 1.43 3.84 -1.26 -1.79 114.94 122.63 2bxr s ASN 396 Ca 0.09 -0.63 0.28 0.00 0.21 0.00 0.00 52.86 52.80 2bxr s ASN 396 Cb -0.11 -2.12 1.07 0.00 -0.55 0.00 0.00 41.25 39.54 2bxr s ASN 396 CO 0.01 -0.31 1.87 0.79 -2.79 0.00 0.00 177.10 176.67 2bxr n TRP 397 N 5.10 0.36 0.09 0.43 7.02 -0.75 -3.62 117.44 126.07 2bxr n TRP 397 Ca -0.12 0.11 -0.13 0.00 -1.02 0.00 0.00 57.50 56.33 2bxr n TRP 397 Cb 0.48 -0.67 -0.08 0.00 -2.42 0.00 0.00 31.31 28.62 2bxr n TRP 397 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2bxr n GLU 399 N -5.10 0.50 -3.45 0.00 0.28 -1.24 -4.65 120.64 106.98 2bxr n GLU 399 Ca -0.09 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.48 2bxr n GLU 399 Cb 0.16 -1.25 -0.07 0.00 1.43 0.00 0.00 31.44 31.71 2bxr n GLU 399 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2bxr s GLU 400 N 0.86 2.75 0.23 3.44 0.41 -0.84 -4.96 118.70 120.59 2bxr s GLU 400 Ca 0.00 -1.64 -0.07 0.00 -0.41 0.00 0.00 54.97 52.85 2bxr s GLU 400 Cb 0.00 -4.06 0.22 0.00 -1.78 0.00 0.00 34.13 28.51 2bxr s GLU 400 CO 0.00 -1.18 1.90 0.37 -0.49 0.00 0.00 175.26 175.86 2bxr h GLN 401 N 8.64 1.22 -0.42 1.61 4.15 -1.89 0.22 115.11 128.64 2bxr h GLN 401 Ca -0.26 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.06 2bxr h GLN 401 Cb 1.09 -0.27 -0.01 0.00 0.21 0.00 0.00 27.48 28.51 2bxr h GLN 401 CO 0.91 0.83 0.01 0.66 -1.93 0.00 0.00 178.83 179.31 2bxr n TYR 402 N -4.42 1.53 0.00 3.99 4.01 -1.26 -4.35 117.16 116.66 2bxr n TYR 402 Ca 0.10 -0.83 0.00 0.00 -0.16 0.00 0.00 57.90 57.01 2bxr n TYR 402 Cb 0.03 -0.42 0.00 0.00 -0.31 0.00 0.00 39.34 38.64 2bxr n TYR 402 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2bxr n SER 403 N 0.01 0.83 0.00 7.72 7.64 -1.04 -4.97 113.62 123.82 2bxr n SER 403 Ca 0.25 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2bxr n SER 403 Cb 1.06 0.12 0.00 0.00 -1.01 0.00 0.00 64.21 64.38 2bxr n SER 403 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bxr n GLY 404 N 0.69 1.60 0.00 0.23 0.00 0.75 -4.80 105.19 103.66 2bxr n GLY 404 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2bxr n GLY 404 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bxr n GLY 405 N 0.00 -0.51 3.68 -0.02 0.00 -1.24 -4.62 105.19 102.48 2bxr n GLY 405 Ca 0.00 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 2bxr n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bxr h TYR 407 N 1.59 0.97 -1.21 0.00 0.05 -1.89 -3.03 116.97 113.44 2bxr h TYR 407 Ca -0.44 -0.62 0.00 0.00 0.05 0.00 0.00 58.73 57.72 2bxr h TYR 407 Cb 1.26 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.93 2bxr h TYR 407 CO 0.91 1.47 0.00 -2.37 -1.05 0.00 0.00 178.16 177.12 2bxr n THR 408 N -3.76 0.00 -3.72 -2.88 5.66 -1.26 -4.95 114.28 103.37 2bxr n THR 408 Ca -0.14 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.54 2bxr n THR 408 Cb 1.00 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.73 2bxr n THR 408 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bxr s ALA 409 N -2.00 3.83 0.33 1.79 0.00 -1.26 -1.32 121.76 123.13 2bxr s ALA 409 Ca 0.00 -0.59 0.09 0.00 0.00 0.00 0.00 51.96 51.46 2bxr s ALA 409 Cb 0.00 -2.08 -0.05 0.00 0.00 0.00 0.00 23.12 20.99 2bxr s ALA 409 CO 0.00 0.69 -0.01 1.52 0.00 0.00 0.00 175.76 177.96 2bxr s TYR 410 N -1.56 2.54 -0.30 0.00 -0.85 -0.46 -4.93 117.35 111.80 2bxr s TYR 410 Ca 0.37 -0.40 -0.12 0.00 -0.52 0.00 0.00 57.07 56.40 2bxr s TYR 410 Cb -0.13 -1.41 -0.04 0.00 0.38 0.00 0.00 41.96 40.77 2bxr s TYR 410 CO 0.23 0.51 0.20 -0.06 -1.52 0.00 0.00 175.55 174.92 2bxr s PHE 411 N -2.49 3.22 0.86 -3.49 0.40 -1.26 -3.88 117.98 111.33 2bxr s PHE 411 Ca 0.34 -0.04 -0.10 0.00 -0.60 0.00 0.00 56.93 56.53 2bxr s PHE 411 Cb -0.01 -2.41 0.11 0.00 0.51 0.00 0.00 43.02 41.22 2bxr s PHE 411 CO 0.19 -0.25 1.12 -2.14 0.70 0.00 0.00 175.22 174.84 2bxr s PRO 412 N 1.74 1.52 0.30 0.24 0.02 -1.26 -0.35 135.00 137.21 2bxr s PRO 412 Ca 0.07 1.37 -0.28 0.00 0.02 0.00 0.00 61.00 62.17 2bxr s PRO 412 Cb -0.17 -1.80 -0.14 0.00 0.02 0.00 0.00 34.50 32.42 2bxr s PRO 412 CO 0.10 -2.22 1.04 -2.30 -0.33 0.00 0.00 177.00 173.29 2bxr n PRO 413 N -3.94 1.44 0.00 5.54 -0.02 -1.26 -2.67 135.00 134.09 2bxr n PRO 413 Ca 0.10 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2bxr n PRO 413 Cb 0.53 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 2bxr n PRO 413 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bxr n GLY 414 N 1.17 3.00 0.11 -1.23 0.00 -0.43 -4.82 105.19 102.99 2bxr n GLY 414 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 2bxr n GLY 414 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2bxr h ILE 415 N 0.00 1.38 -0.92 -0.61 1.08 -1.82 -1.52 117.51 115.11 2bxr h ILE 415 Ca 0.00 -1.39 0.24 0.00 -0.39 0.00 0.00 64.86 63.32 2bxr h ILE 415 Cb 0.00 2.07 -0.13 0.00 -3.07 0.00 0.00 36.82 35.69 2bxr h ILE 415 CO 0.00 0.39 0.41 -0.03 -0.69 0.00 0.00 178.15 178.24 2bxr h MET 416 N -0.17 0.37 0.00 2.37 1.85 -1.88 -1.61 114.93 115.86 2bxr h MET 416 Ca 0.01 -0.02 -0.20 0.00 -0.61 0.00 0.00 59.70 58.88 2bxr h MET 416 Cb 0.70 -0.08 -0.04 0.00 0.43 0.00 0.00 31.60 32.61 2bxr h MET 416 CO 0.03 0.25 -1.68 0.25 -0.40 0.00 0.00 176.91 175.36 2bxr n THR 417 N -5.05 1.13 -0.12 -0.77 -2.24 -1.19 -1.61 114.28 104.42 2bxr n THR 417 Ca 0.24 -0.71 -0.12 0.00 -2.27 0.00 0.00 64.05 61.18 2bxr n THR 417 Cb 0.71 -0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 68.28 2bxr n THR 417 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2bxr h GLN 418 N 0.00 0.85 0.00 -0.78 4.20 -0.83 -3.43 115.11 115.13 2bxr h GLN 418 Ca -0.23 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.08 2bxr h GLN 418 Cb 1.68 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.45 2bxr h GLN 418 CO 0.04 1.05 -0.14 0.66 -0.67 0.00 0.00 178.83 179.77 2bxr n TYR 419 N -4.18 0.00 0.26 2.96 4.02 -0.64 -4.91 117.16 114.66 2bxr n TYR 419 Ca -0.02 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.99 2bxr n TYR 419 Cb 0.47 0.00 0.63 0.00 -0.02 0.00 0.00 39.34 40.42 2bxr n TYR 419 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2bxr h GLY 420 N 0.00 0.00 2.00 2.72 0.00 -1.04 -2.25 103.07 104.50 2bxr h GLY 420 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2bxr h GLY 420 CO 0.00 0.00 -0.06 0.07 0.00 0.00 0.00 176.54 176.55 2bxr h ARG 421 N 0.00 0.00 -0.67 4.80 0.11 -1.89 -2.74 114.38 113.99 2bxr h ARG 421 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bxr h ARG 421 Cb 0.62 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.70 2bxr h ARG 421 CO 0.00 0.06 0.00 1.55 0.10 0.00 0.00 179.97 181.68 2bxr n VAL 422 N -3.92 1.96 0.04 0.08 3.14 -0.85 -4.63 118.33 114.15 2bxr n VAL 422 Ca -0.03 -1.03 0.00 0.00 -2.96 0.00 0.00 64.34 60.33 2bxr n VAL 422 Cb 0.15 -0.26 0.32 0.00 -1.06 0.00 0.00 33.84 32.99 2bxr n VAL 422 CO 0.00 0.00 0.00 -0.29 -6.46 0.00 0.00 176.83 170.08 2bxr h ILE 423 N 3.07 1.20 -0.61 1.55 -0.00 -1.71 -3.10 117.51 117.91 2bxr h ILE 423 Ca 0.00 -0.84 -0.34 0.00 -0.00 0.00 0.00 64.86 63.68 2bxr h ILE 423 Cb 1.54 1.08 -0.41 0.00 -0.00 0.00 0.00 36.82 39.03 2bxr h ILE 423 CO 0.34 0.28 -1.04 -2.11 -0.00 0.00 0.00 178.15 175.62 2bxr n ARG 424 N -4.26 2.22 -3.99 2.19 1.85 -1.26 -4.92 116.66 108.49 2bxr n ARG 424 Ca 0.01 -3.69 -0.36 0.00 -1.00 0.00 0.00 57.85 52.80 2bxr n ARG 424 Cb 0.27 -1.77 -0.07 0.00 -1.05 0.00 0.00 32.46 29.84 2bxr n ARG 424 CO 0.00 0.00 0.00 -1.14 -0.01 0.00 0.00 177.63 176.48 2bxr s GLN 425 N -3.68 3.36 0.72 2.89 0.74 -1.17 -4.80 119.66 117.71 2bxr s GLN 425 Ca 0.34 -0.20 -0.14 0.00 0.05 0.00 0.00 55.36 55.41 2bxr s GLN 425 Cb 0.36 -3.11 0.03 0.00 1.10 0.00 0.00 33.01 31.39 2bxr s GLN 425 CO -0.02 0.75 1.16 -2.14 -0.55 0.00 0.00 175.29 174.49 2bxr s PRO 426 N -0.96 2.33 -0.23 1.67 0.02 -1.26 -4.77 135.00 131.79 2bxr s PRO 426 Ca 0.14 1.58 0.02 0.00 0.02 0.00 0.00 61.00 62.76 2bxr s PRO 426 Cb -0.12 -1.87 0.05 0.00 0.02 0.00 0.00 34.50 32.58 2bxr s PRO 426 CO 0.03 -1.65 -0.12 0.14 -0.33 0.00 0.00 177.00 175.07 2bxr s VAL 427 N -2.21 2.00 0.00 3.83 -7.23 -0.38 -4.97 120.40 111.45 2bxr s VAL 427 Ca 0.70 -1.39 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 2bxr s VAL 427 Cb -0.25 -2.07 0.00 0.00 0.56 0.00 0.00 36.38 34.62 2bxr s VAL 427 CO 0.45 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.94 2bxr n GLY 428 N 4.53 0.77 0.51 2.32 0.00 -1.26 -0.17 105.19 111.89 2bxr n GLY 428 Ca -0.15 0.69 0.08 0.00 0.00 0.00 0.00 46.02 46.64 2bxr n GLY 428 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bxr n ARG 429 N 0.00 2.42 -3.85 1.61 1.74 -1.26 -4.94 116.66 112.38 2bxr n ARG 429 Ca 0.00 -2.51 -0.36 0.00 -0.77 0.00 0.00 57.85 54.21 2bxr n ARG 429 Cb 0.00 -1.57 -0.11 0.00 -1.02 0.00 0.00 32.46 29.76 2bxr n ARG 429 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2bxr s ILE 430 N -2.40 4.73 0.24 0.55 1.01 0.76 -1.67 121.20 124.41 2bxr s ILE 430 Ca 0.32 -0.04 0.10 0.00 0.00 0.00 0.00 60.65 61.03 2bxr s ILE 430 Cb 0.26 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 2bxr s ILE 430 CO 0.07 0.38 -0.10 -0.36 0.00 0.00 0.00 174.94 174.94 2bxr s PHE 431 N 1.02 2.54 -0.26 3.97 0.40 0.11 -1.24 117.98 124.52 2bxr s PHE 431 Ca 0.05 -0.26 0.03 0.00 -0.60 0.00 0.00 56.93 56.14 2bxr s PHE 431 Cb -0.14 -1.16 0.06 0.00 0.51 0.00 0.00 43.02 42.29 2bxr s PHE 431 CO 0.03 0.61 -0.09 -0.06 0.70 0.00 0.00 175.22 176.40 2bxr s PHE 432 N -2.15 3.14 0.00 0.36 0.40 -1.26 -0.15 117.98 118.32 2bxr s PHE 432 Ca 0.28 -2.26 0.00 0.00 -0.60 0.00 0.00 56.93 54.36 2bxr s PHE 432 Cb -0.07 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.56 2bxr s PHE 432 CO 0.16 -0.87 0.00 0.00 0.70 0.00 0.00 175.22 175.22 2bxr n ALA 433 N 4.46 0.00 0.00 5.36 0.00 0.42 -4.82 120.51 125.93 2bxr n ALA 433 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2bxr n ALA 433 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2bxr n ALA 433 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bxr n GLY 434 N 5.00 0.43 0.47 0.00 0.00 -1.26 -4.61 105.19 105.22 2bxr n GLY 434 Ca 0.00 -1.43 0.29 0.00 0.00 0.00 0.00 46.02 44.88 2bxr n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bxr h THR 435 N 0.00 0.51 0.00 2.61 1.03 -1.81 0.71 112.91 115.96 2bxr h THR 435 Ca 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 66.36 2bxr h THR 435 Cb 0.00 0.40 0.00 0.00 -1.07 0.00 0.00 68.15 67.48 2bxr h THR 435 CO 0.00 0.02 0.00 -0.62 -0.01 0.00 0.00 175.52 174.91 2bxr n GLU 436 N -4.32 0.29 0.00 0.00 -0.58 -1.26 -1.60 120.64 113.17 2bxr n GLU 436 Ca 0.22 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.96 2bxr n GLU 436 Cb 1.02 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.70 2bxr n GLU 436 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2bxr n THR 437 N -0.68 0.60 -1.81 2.62 -2.24 0.24 -5.02 114.28 107.99 2bxr n THR 437 Ca 0.03 -0.62 -0.31 0.00 -2.27 0.00 0.00 64.05 60.87 2bxr n THR 437 Cb 0.01 0.72 0.03 0.00 -2.10 0.00 0.00 70.33 69.00 2bxr n THR 437 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bxr s ALA 438 N -0.60 2.93 -0.17 6.98 0.00 -0.62 -4.86 121.76 125.41 2bxr s ALA 438 Ca 0.00 -0.14 0.02 0.00 0.00 0.00 0.00 51.96 51.84 2bxr s ALA 438 Cb 0.00 -3.08 0.05 0.00 0.00 0.00 0.00 23.12 20.09 2bxr s ALA 438 CO 0.00 -0.96 1.00 0.25 0.00 0.00 0.00 175.76 176.06 2bxr n THR 439 N -2.92 0.91 -3.75 0.00 -2.24 -1.26 -4.56 114.28 100.46 2bxr n THR 439 Ca 0.07 -0.96 -0.12 0.00 -2.27 0.00 0.00 64.05 60.77 2bxr n THR 439 Cb 0.55 0.55 -0.12 0.00 -2.10 0.00 0.00 70.33 69.20 2bxr n THR 439 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2bxr s LYS 440 N -0.93 0.25 -1.63 -0.78 2.20 -1.26 -4.87 119.74 112.72 2bxr s LYS 440 Ca 0.04 0.48 -0.12 0.00 -0.36 0.00 0.00 55.97 56.01 2bxr s LYS 440 Cb 0.02 -0.02 0.11 0.00 -1.51 0.00 0.00 37.83 36.42 2bxr s LYS 440 CO 0.03 -0.12 0.53 0.91 -0.36 0.00 0.00 175.35 176.34 2bxr n TRP 441 N 3.77 -1.54 -1.82 4.03 7.02 -0.47 -3.89 117.44 124.54 2bxr n TRP 441 Ca -0.21 0.74 -0.42 0.00 -1.02 0.00 0.00 57.50 56.59 2bxr n TRP 441 Cb 0.55 -2.95 -0.03 0.00 -2.42 0.00 0.00 31.31 26.46 2bxr n TRP 441 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2bxr s SER 442 N -3.75 6.51 0.00 -0.99 0.15 -1.26 -1.80 113.70 112.56 2bxr s SER 442 Ca 0.45 2.63 0.00 0.00 0.70 0.00 0.00 55.95 59.73 2bxr s SER 442 Cb -0.25 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.49 2bxr s SER 442 CO 0.95 -0.94 0.00 0.61 1.20 0.00 0.00 173.24 175.06 2bxr n GLY 443 N 4.09 2.12 3.88 9.45 0.00 -1.24 -4.98 105.19 118.52 2bxr n GLY 443 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2bxr n GLY 443 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bxr s TYR 444 N -2.18 2.54 0.20 1.61 1.51 -0.74 -4.59 117.35 115.69 2bxr s TYR 444 Ca 0.00 -0.55 -0.11 0.00 -1.01 0.00 0.00 57.07 55.40 2bxr s TYR 444 Cb 0.00 -2.13 0.23 0.00 -0.11 0.00 0.00 41.96 39.95 2bxr s TYR 444 CO 0.00 -0.18 1.73 0.52 -1.11 0.00 0.00 175.55 176.51 2bxr h MET 445 N 0.99 0.31 -0.71 -0.62 2.86 -1.91 -0.76 114.93 115.09 2bxr h MET 445 Ca -0.41 -0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.35 2bxr h MET 445 Cb 1.27 -0.07 -0.13 0.00 0.06 0.00 0.00 31.60 32.73 2bxr h MET 445 CO 0.58 0.20 -0.26 1.49 1.06 0.00 0.00 176.91 179.97 2bxr h GLU 446 N 0.32 -0.06 -0.62 1.72 4.57 -1.93 -1.11 114.58 117.46 2bxr h GLU 446 Ca 0.28 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.44 2bxr h GLU 446 Cb 0.35 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.93 2bxr h GLU 446 CO -0.31 -0.04 0.30 0.78 -1.18 0.00 0.00 179.01 178.56 2bxr h GLY 447 N -0.06 0.93 0.54 1.92 0.00 -0.46 -2.16 103.07 103.77 2bxr h GLY 447 Ca 0.31 -0.43 0.05 0.00 0.00 0.00 0.00 47.33 47.26 2bxr h GLY 447 CO -0.76 0.41 -0.04 0.00 0.00 0.00 0.00 176.54 176.16 2bxr h ALA 448 N 1.46 0.20 -0.02 3.60 0.00 -0.39 -0.96 119.26 123.15 2bxr h ALA 448 Ca 0.22 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.24 2bxr h ALA 448 Cb 0.08 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2bxr h ALA 448 CO -0.03 -0.45 -0.17 0.28 0.00 0.00 0.00 179.25 178.89 2bxr h VAL 449 N 0.03 0.59 -0.49 0.00 2.07 -0.91 -2.00 116.25 115.55 2bxr h VAL 449 Ca 0.12 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.72 2bxr h VAL 449 Cb 0.18 0.59 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 2bxr h VAL 449 CO -0.24 0.00 0.10 -0.08 0.02 0.00 0.00 177.57 177.37 2bxr h GLU 450 N -0.26 0.24 0.21 1.57 4.81 -1.04 -0.12 114.58 119.97 2bxr h GLU 450 Ca 0.06 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2bxr h GLU 450 Cb 0.34 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2bxr h GLU 450 CO -0.17 0.16 -0.24 0.00 -0.73 0.00 0.00 179.01 178.02 2bxr h ALA 451 N 1.38 -0.91 -0.97 2.92 0.00 -1.02 -0.54 119.26 120.12 2bxr h ALA 451 Ca 0.24 -0.08 0.16 0.00 0.00 0.00 0.00 54.91 55.23 2bxr h ALA 451 Cb 0.32 0.51 -0.16 0.00 0.00 0.00 0.00 17.79 18.46 2bxr h ALA 451 CO -0.31 -0.94 -0.36 0.78 0.00 0.00 0.00 179.25 178.42 2bxr h GLY 452 N -0.46 0.16 0.72 0.00 0.00 -1.03 0.14 103.07 102.60 2bxr h GLY 452 Ca -0.03 0.49 -0.00 0.00 0.00 0.00 0.00 47.33 47.79 2bxr h GLY 452 CO -0.05 -0.23 -0.02 0.83 0.00 0.00 0.00 176.54 177.08 2bxr h GLU 453 N -0.01 -0.05 -0.59 4.80 5.08 -0.86 0.15 114.58 123.11 2bxr h GLU 453 Ca 0.36 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.84 2bxr h GLU 453 Cb 0.61 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.76 2bxr h GLU 453 CO -0.98 0.24 -0.22 -0.09 -1.00 0.00 0.00 179.01 176.96 2bxr h ARG 454 N -0.33 -0.07 -0.39 2.33 2.43 -0.68 0.47 114.38 118.13 2bxr h ARG 454 Ca -0.01 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 2bxr h ARG 454 Cb 0.31 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.84 2bxr h ARG 454 CO 0.01 -0.05 0.18 0.00 -1.51 0.00 0.00 179.97 178.60 2bxr h ALA 455 N 1.36 0.48 -0.09 2.80 0.00 -0.34 -1.43 119.26 122.04 2bxr h ALA 455 Ca 0.27 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.24 2bxr h ALA 455 Cb 0.50 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 2bxr h ALA 455 CO -0.64 -0.18 -0.20 0.00 0.00 0.00 0.00 179.25 178.22 2bxr h ALA 456 N 1.22 -0.18 -0.34 0.00 0.00 0.55 -1.54 119.26 118.96 2bxr h ALA 456 Ca 0.17 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2bxr h ALA 456 Cb 0.10 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2bxr h ALA 456 CO -0.13 -0.67 0.15 0.00 0.00 0.00 0.00 179.25 178.60 2bxr h ARG 457 N -0.28 0.31 -0.57 0.00 3.08 -0.62 -0.66 114.38 115.65 2bxr h ARG 457 Ca 0.09 -0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.22 2bxr h ARG 457 Cb 0.40 -0.07 -0.11 0.00 0.08 0.00 0.00 29.97 30.27 2bxr h ARG 457 CO -0.25 0.20 -0.30 0.93 -1.07 0.00 0.00 179.97 179.48 2bxr h GLU 458 N 0.32 -0.14 -0.52 0.04 5.08 -0.71 0.15 114.58 118.79 2bxr h GLU 458 Ca 0.15 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.61 2bxr h GLU 458 Cb 0.09 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.30 2bxr h GLU 458 CO -0.13 -0.09 0.13 0.28 -1.00 0.00 0.00 179.01 178.20 2bxr h VAL 459 N -0.14 0.74 -0.41 3.13 2.07 -0.23 -2.36 116.25 119.04 2bxr h VAL 459 Ca 0.24 -0.10 0.08 0.00 0.82 0.00 0.00 66.70 67.75 2bxr h VAL 459 Cb 0.53 0.43 -0.08 0.00 -1.52 0.00 0.00 31.29 30.66 2bxr h VAL 459 CO -0.65 0.05 -0.15 -0.07 0.02 0.00 0.00 177.57 176.77 2bxr h LEU 460 N 0.28 -0.51 -0.82 2.57 3.38 0.68 -0.80 115.31 120.08 2bxr h LEU 460 Ca 0.26 0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.47 2bxr h LEU 460 Cb 0.34 0.31 -0.08 0.00 0.09 0.00 0.00 40.66 41.32 2bxr h LEU 460 CO -0.32 -0.18 0.47 0.78 0.09 0.00 0.00 178.44 179.28 2bxr h ASN 461 N -0.06 0.65 0.00 -0.43 2.35 -0.89 -0.88 115.58 116.33 2bxr h ASN 461 Ca 0.20 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.99 2bxr h ASN 461 Cb 0.36 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 2bxr h ASN 461 CO -0.45 0.36 0.05 0.61 -1.65 0.00 0.00 177.43 176.35 2bxr n GLY 462 N -1.32 1.32 2.80 2.83 0.00 -0.31 -4.70 105.19 105.80 2bxr n GLY 462 Ca 0.14 -0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 2bxr n GLY 462 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bxr n LEU 463 N 2.07 0.00 0.00 0.99 4.77 -0.33 -4.99 117.00 119.51 2bxr n LEU 463 Ca 0.04 -1.96 0.00 0.00 -0.03 0.00 0.00 56.01 54.06 2bxr n LEU 463 Cb 0.21 2.79 0.00 0.00 -2.33 0.00 0.00 43.42 44.09 2bxr n LEU 463 CO 0.05 -0.63 0.00 0.61 -1.33 0.00 0.00 177.39 176.09