#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 3.96 0.11 -1.40 -2.45 -1.26 -1.99 119.30 116.27 2bxr s MET 13 Ca 0.00 -0.33 -0.08 0.00 -1.25 0.00 0.00 55.69 54.02 2bxr s MET 13 Cb 0.00 -3.37 -0.01 0.00 1.25 0.00 0.00 34.83 32.70 2bxr s MET 13 CO 0.00 0.11 0.20 -0.06 1.05 0.00 0.00 175.02 176.32 2bxr s PHE 14 N 0.86 0.24 -0.03 4.11 0.08 -0.78 -5.03 117.98 117.43 2bxr s PHE 14 Ca 0.05 -0.65 -0.23 0.00 0.12 0.00 0.00 56.93 56.22 2bxr s PHE 14 Cb -0.13 -0.08 -0.22 0.00 -0.57 0.00 0.00 43.02 42.02 2bxr s PHE 14 CO 0.03 -0.58 1.09 -0.44 -0.10 0.00 0.00 175.22 175.21 2bxr h ASP 15 N 2.71 0.29 -4.36 1.36 3.32 -0.84 -3.22 116.42 115.69 2bxr h ASP 15 Ca -0.33 -0.73 -0.34 0.00 0.02 0.00 0.00 57.03 55.65 2bxr h ASP 15 Cb 1.20 -0.09 -0.25 0.00 0.22 0.00 0.00 39.33 40.42 2bxr h ASP 15 CO 0.55 0.98 -0.76 0.54 -1.72 0.00 0.00 179.24 178.83 2bxr s VAL 16 N -3.33 0.65 -0.11 -1.35 0.11 -0.65 -1.08 120.40 114.65 2bxr s VAL 16 Ca -0.15 -0.77 -0.03 0.00 -2.93 0.00 0.00 61.98 58.09 2bxr s VAL 16 Cb 0.02 -0.63 -0.03 0.00 -1.53 0.00 0.00 36.38 34.20 2bxr s VAL 16 CO 0.76 -0.11 0.02 -0.69 -3.33 0.00 0.00 175.10 171.75 2bxr s VAL 17 N -0.82 4.46 -0.24 2.04 1.01 -0.72 -0.99 120.40 125.15 2bxr s VAL 17 Ca -0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 61.98 61.72 2bxr s VAL 17 Cb -0.07 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 2bxr s VAL 17 CO 0.00 0.57 0.02 -0.69 0.00 0.00 0.00 175.10 175.00 2bxr s VAL 18 N -0.56 3.83 -0.42 2.92 1.01 0.15 -1.30 120.40 126.03 2bxr s VAL 18 Ca 0.10 -0.36 -0.26 0.00 0.00 0.00 0.00 61.98 61.46 2bxr s VAL 18 Cb -0.12 -2.78 0.02 0.00 0.00 0.00 0.00 36.38 33.50 2bxr s VAL 18 CO 0.02 0.37 0.94 -0.63 0.00 0.00 0.00 175.10 175.80 2bxr s ILE 19 N 1.54 4.51 0.00 2.22 1.01 0.22 -1.57 121.20 129.13 2bxr s ILE 19 Ca 0.06 0.99 0.00 0.00 0.00 0.00 0.00 60.65 61.70 2bxr s ILE 19 Cb -0.15 -4.40 0.00 0.00 0.01 0.00 0.00 42.46 37.92 2bxr s ILE 19 CO 0.00 -0.71 0.00 0.61 0.00 0.00 0.00 174.94 174.84 2bxr n GLY 20 N 4.67 1.67 2.74 6.18 0.00 0.63 -0.72 105.19 120.36 2bxr n GLY 20 Ca 0.07 -1.32 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 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 2.87 5.82 0.00 -0.02 0.00 -1.26 -4.03 105.19 108.58 2bxr n GLY 21 Ca 0.00 -2.69 0.00 0.00 0.00 0.00 0.00 46.02 43.33 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 -0.34 0.65 0.36 -0.02 0.00 -1.26 -1.27 105.19 103.32 2bxr n GLY 22 Ca 0.41 -1.92 0.01 0.00 0.00 0.00 0.00 46.02 44.52 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 -0.34 1.15 0.27 -0.61 2.04 -1.95 -2.11 117.51 115.97 2bxr h ILE 23 Ca 0.00 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 2bxr h ILE 23 Cb 0.00 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.04 2bxr h ILE 23 CO 0.00 0.20 -0.13 -1.28 0.00 0.00 0.00 178.15 176.94 2bxr h SER 24 N 1.10 -0.31 -0.77 1.72 0.87 -1.91 -0.57 113.55 113.68 2bxr h SER 24 Ca 0.34 -0.20 0.05 0.00 -1.23 0.00 0.00 61.79 60.76 2bxr h SER 24 Cb 0.01 0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 2bxr h SER 24 CO -0.10 0.06 0.47 1.23 -0.53 0.00 0.00 176.83 177.95 2bxr h GLY 25 N -0.72 1.13 1.57 5.77 0.00 -1.68 -2.13 103.07 107.00 2bxr h GLY 25 Ca -0.04 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 2bxr h GLY 25 CO 0.06 0.25 -0.08 1.41 0.00 0.00 0.00 176.54 178.19 2bxr h LEU 26 N 0.88 0.50 -0.21 3.11 3.38 -1.34 -1.50 115.31 120.13 2bxr h LEU 26 Ca 0.32 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 2bxr h LEU 26 Cb 0.11 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2bxr h LEU 26 CO -0.15 0.63 -0.09 0.28 0.09 0.00 0.00 178.44 179.20 2bxr h SER 27 N 0.49 0.45 -0.13 -0.43 0.02 -0.46 0.10 113.55 113.59 2bxr h SER 27 Ca 0.10 -0.40 0.05 0.00 -0.84 0.00 0.00 61.79 60.69 2bxr h SER 27 Cb 0.44 -0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.80 2bxr h SER 27 CO 0.02 0.75 -0.26 0.00 -1.14 0.00 0.00 176.83 176.21 2bxr h ALA 28 N 0.71 -0.26 -0.56 3.77 0.00 -1.34 -1.65 119.26 119.92 2bxr h ALA 28 Ca 0.05 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.06 2bxr h ALA 28 Cb 0.58 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 2bxr h ALA 28 CO 0.03 -0.73 0.26 0.00 0.00 0.00 0.00 179.25 178.81 2bxr h ALA 29 N 0.58 0.73 -0.36 0.00 0.00 -0.85 -0.62 119.26 118.74 2bxr h ALA 29 Ca 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2bxr h ALA 29 Cb 0.48 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2bxr h ALA 29 CO -0.31 -0.11 0.17 -0.22 0.00 0.00 0.00 179.25 178.77 2bxr h LYS 30 N 0.49 0.52 0.72 0.00 3.64 -0.42 0.16 116.57 121.69 2bxr h LYS 30 Ca 0.26 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2bxr h LYS 30 Cb 0.22 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2bxr h LYS 30 CO -0.21 0.48 -0.35 1.25 -2.27 0.00 0.00 179.45 178.35 2bxr h LEU 31 N 0.44 -0.82 -0.95 5.20 5.85 -0.84 0.31 115.31 124.50 2bxr h LEU 31 Ca 0.12 0.01 0.29 0.00 0.84 0.00 0.00 57.88 59.15 2bxr h LEU 31 Cb 0.14 0.21 -0.15 0.00 0.37 0.00 0.00 40.66 41.23 2bxr h LEU 31 CO -0.01 -0.55 0.41 -0.07 -0.34 0.00 0.00 178.44 177.88 2bxr h LEU 32 N -1.03 0.25 -0.27 2.25 3.38 -1.03 0.21 115.31 119.06 2bxr h LEU 32 Ca -0.10 0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2bxr h LEU 32 Cb 0.76 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2bxr h LEU 32 CO 0.16 -0.17 0.07 0.74 0.09 0.00 0.00 178.44 179.33 2bxr h THR 33 N 0.25 1.21 -0.86 0.22 2.02 -0.07 -1.47 112.91 114.21 2bxr h THR 33 Ca 0.66 -0.70 0.25 0.00 0.77 0.00 0.00 66.41 67.39 2bxr h THR 33 Cb 1.46 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 68.99 2bxr h THR 33 CO -0.65 0.23 0.66 -0.33 0.37 0.00 0.00 175.52 175.80 2bxr h GLU 34 N 0.28 0.00 -0.63 6.66 4.39 0.15 0.38 114.58 125.81 2bxr h GLU 34 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2bxr h GLU 34 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2bxr h GLU 34 CO 0.00 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.51 2bxr n TYR 35 N -4.13 1.14 -1.60 4.33 4.01 -0.83 -4.93 117.16 115.15 2bxr n TYR 35 Ca 0.18 -0.47 -0.08 0.00 -0.16 0.00 0.00 57.90 57.37 2bxr n TYR 35 Cb 0.97 -0.16 -0.02 0.00 -0.31 0.00 0.00 39.34 39.81 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 1.11 0.60 3.79 2.72 0.00 0.13 -5.02 105.19 108.53 2bxr n GLY 36 Ca 0.21 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.33 4.84 -0.62 1.61 1.01 -0.62 -5.02 120.40 119.27 2bxr s VAL 37 Ca 0.00 1.18 -0.27 0.00 0.00 0.00 0.00 61.98 62.89 2bxr s VAL 37 Cb 0.00 -3.89 0.03 0.00 0.00 0.00 0.00 36.38 32.53 2bxr s VAL 37 CO 0.00 0.50 1.16 -0.55 0.00 0.00 0.00 175.10 176.21 2bxr s SER 38 N -0.72 6.34 -0.06 3.32 0.15 -1.26 -4.21 113.70 117.26 2bxr s SER 38 Ca 0.29 -0.17 0.01 0.00 0.70 0.00 0.00 55.95 56.78 2bxr s SER 38 Cb -0.19 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.57 2bxr s SER 38 CO 0.17 -1.52 -0.07 -0.69 1.20 0.00 0.00 173.24 172.33 2bxr s VAL 39 N 4.91 3.66 -0.02 4.45 1.01 -1.26 -0.13 120.40 133.03 2bxr s VAL 39 Ca 0.38 -0.50 0.07 0.00 0.00 0.00 0.00 61.98 61.92 2bxr s VAL 39 Cb -0.09 -2.50 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 2bxr s VAL 39 CO 0.21 0.59 -0.22 -0.22 0.00 0.00 0.00 175.10 175.47 2bxr s LEU 40 N -0.82 2.04 -0.20 3.92 2.96 -0.16 -4.86 118.68 121.56 2bxr s LEU 40 Ca 0.12 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 2bxr s LEU 40 Cb -0.11 -1.12 0.02 0.00 0.50 0.00 0.00 46.19 45.49 2bxr s LEU 40 CO 0.02 0.27 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.45 2bxr s VAL 41 N -0.51 2.20 -0.26 1.68 1.01 -0.11 0.34 120.40 124.74 2bxr s VAL 41 Ca 0.08 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 2bxr s VAL 41 Cb -0.08 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.26 2bxr s VAL 41 CO -0.01 0.44 0.24 -0.76 0.00 0.00 0.00 175.10 175.02 2bxr s LEU 42 N 1.28 4.05 -0.12 3.92 1.43 -0.61 0.25 118.68 128.89 2bxr s LEU 42 Ca 0.03 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 2bxr s LEU 42 Cb -0.14 -2.22 0.02 0.00 0.03 0.00 0.00 46.19 43.88 2bxr s LEU 42 CO -0.11 -0.06 -0.13 -0.70 0.23 0.00 0.00 176.35 175.58 2bxr s GLU 43 N 1.66 2.11 0.21 1.70 2.56 -0.29 -0.27 118.70 126.38 2bxr s GLU 43 Ca 0.10 -0.50 -0.10 0.00 0.00 0.00 0.00 54.97 54.47 2bxr s GLU 43 Cb -0.15 -1.91 0.26 0.00 2.00 0.00 0.00 34.13 34.33 2bxr s GLU 43 CO 0.09 -0.17 1.76 0.00 -0.56 0.00 0.00 175.26 176.38 2bxr h ALA 44 N 7.80 0.78 -2.17 6.30 0.00 -1.83 0.12 119.26 130.25 2bxr h ALA 44 Ca -0.34 0.07 -0.45 0.00 0.00 0.00 0.00 54.91 54.19 2bxr h ALA 44 Cb 1.15 0.02 0.15 0.00 0.00 0.00 0.00 17.79 19.11 2bxr h ALA 44 CO 0.49 -0.16 0.41 1.03 0.00 0.00 0.00 179.25 181.03 2bxr s ARG 45 N -6.10 0.90 -0.11 0.00 0.52 -1.26 -3.40 118.95 109.51 2bxr s ARG 45 Ca -0.13 -0.27 0.08 0.00 -0.52 0.00 0.00 55.73 54.90 2bxr s ARG 45 Cb 0.17 -1.86 0.44 0.00 0.52 0.00 0.00 34.95 34.21 2bxr s ARG 45 CO 0.75 -2.26 1.21 -0.40 0.02 0.00 0.00 175.30 174.61 2bxr n ASP 46 N -3.69 3.40 -3.72 0.23 5.75 -1.26 -0.46 116.55 116.80 2bxr n ASP 46 Ca 0.13 -2.43 -0.12 0.00 -0.01 0.00 0.00 54.79 52.36 2bxr n ASP 46 Cb 0.60 -0.55 -0.07 0.00 -1.03 0.00 0.00 41.12 40.07 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 -1.89 0.86 0.74 0.11 1.70 -1.26 -4.95 118.95 114.27 2bxr s ARG 47 Ca 0.30 -0.46 -0.07 0.00 -0.47 0.00 0.00 55.73 55.02 2bxr s ARG 47 Cb 0.22 0.38 0.09 0.00 -0.57 0.00 0.00 34.95 35.06 2bxr s ARG 47 CO 0.10 -0.29 1.06 0.14 -1.08 0.00 0.00 175.30 175.23 2bxr s VAL 48 N -2.59 2.21 0.00 4.99 -7.23 -1.26 -4.67 120.40 111.85 2bxr s VAL 48 Ca -0.05 -0.27 0.00 0.00 -1.81 0.00 0.00 61.98 59.85 2bxr s VAL 48 Cb -0.01 -2.95 0.00 0.00 0.56 0.00 0.00 36.38 33.99 2bxr s VAL 48 CO -0.03 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.37 2bxr n GLY 49 N -3.03 2.65 7.00 2.32 0.00 -0.40 -4.88 105.19 108.85 2bxr n GLY 49 Ca 0.10 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 0.00 3.20 0.00 -0.02 0.00 -1.26 -0.90 105.19 106.20 2bxr n GLY 50 Ca 0.00 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 9.68 0.58 -4.69 1.61 1.74 -1.26 -4.39 116.66 119.93 2bxr n ARG 51 Ca 0.00 0.03 -0.34 0.00 -0.77 0.00 0.00 57.85 56.77 2bxr n ARG 51 Cb 0.00 -1.50 -0.12 0.00 -1.02 0.00 0.00 32.46 29.82 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 -2.22 3.52 -0.30 0.55 -4.23 -0.08 -0.88 115.64 112.00 2bxr s THR 52 Ca 0.30 -0.54 -0.10 0.00 -1.18 0.00 0.00 61.69 60.17 2bxr s THR 52 Cb 0.16 -2.43 0.16 0.00 1.34 0.00 0.00 72.50 71.73 2bxr s THR 52 CO 0.31 0.59 0.81 -0.47 -0.54 0.00 0.00 174.62 175.31 2bxr s TYR 53 N -0.63 -1.05 -0.30 3.99 5.04 -1.26 -4.43 117.35 118.70 2bxr s TYR 53 Ca 0.09 1.57 -0.07 0.00 -2.44 0.00 0.00 57.07 56.22 2bxr s TYR 53 Cb -0.11 0.54 0.01 0.00 0.35 0.00 0.00 41.96 42.74 2bxr s TYR 53 CO 0.02 -0.54 0.10 0.99 -1.34 0.00 0.00 175.55 174.77 2bxr s THR 54 N 2.74 4.08 0.21 4.34 2.01 -1.26 -0.63 115.64 127.12 2bxr s THR 54 Ca 0.01 -0.69 -0.26 0.00 0.31 0.00 0.00 61.69 61.06 2bxr s THR 54 Cb -0.10 -3.12 -0.08 0.00 0.01 0.00 0.00 72.50 69.20 2bxr s THR 54 CO -0.18 0.05 0.83 -0.63 -0.69 0.00 0.00 174.62 174.00 2bxr s ILE 55 N 1.51 4.29 -0.07 1.82 1.01 -0.28 -4.85 121.20 124.64 2bxr s ILE 55 Ca 0.03 1.77 0.01 0.00 0.00 0.00 0.00 60.65 62.46 2bxr s ILE 55 Cb -0.17 -4.14 0.02 0.00 0.01 0.00 0.00 42.46 38.17 2bxr s ILE 55 CO 0.03 0.44 -0.07 -0.13 0.00 0.00 0.00 174.94 175.21 2bxr s ARG 56 N -1.35 1.23 -0.01 2.79 0.52 -1.26 -1.14 118.95 119.74 2bxr s ARG 56 Ca 0.39 -0.22 -0.29 0.00 -0.52 0.00 0.00 55.73 55.10 2bxr s ARG 56 Cb -0.23 -1.18 0.10 0.00 0.52 0.00 0.00 34.95 34.17 2bxr s ARG 56 CO 0.27 -0.10 0.95 0.54 0.02 0.00 0.00 175.30 176.99 2bxr s ASN 57 N 1.06 -0.30 0.56 0.23 2.20 -1.11 -5.00 114.94 112.59 2bxr s ASN 57 Ca -0.08 -0.06 0.33 0.00 -0.94 0.00 0.00 52.86 52.10 2bxr s ASN 57 Cb -0.14 0.36 1.62 0.00 -2.00 0.00 0.00 41.25 41.09 2bxr s ASN 57 CO -0.01 -0.60 2.11 -0.08 -2.94 0.00 0.00 177.10 175.58 2bxr h GLU 58 N 2.00 0.00 -0.11 3.55 4.22 -2.00 0.12 114.58 122.36 2bxr h GLU 58 Ca -0.21 0.00 -0.18 0.00 0.08 0.00 0.00 59.36 59.05 2bxr h GLU 58 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 2bxr h GLU 58 CO 0.29 0.07 -0.67 0.45 -2.18 0.00 0.00 179.01 176.97 2bxr h HIS 59 N 0.00 0.59 -0.00 0.92 3.86 -2.02 -3.36 115.15 115.14 2bxr h HIS 59 Ca -0.00 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 58.97 2bxr h HIS 59 Cb 0.32 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.70 2bxr h HIS 59 CO 0.00 0.98 -0.04 1.33 0.86 0.00 0.00 177.93 181.06 2bxr n VAL 60 N -3.88 0.00 0.00 2.45 0.24 -0.39 -5.01 118.33 111.74 2bxr n VAL 60 Ca -0.04 -0.48 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 2bxr n VAL 60 Cb 0.67 1.04 0.00 0.00 -1.47 0.00 0.00 33.84 34.09 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 -0.21 0.00 -3.69 -1.34 -0.08 0.29 -4.47 116.55 107.05 2bxr n ASP 61 Ca 0.01 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.18 2bxr n ASP 61 Cb 0.07 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.46 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 -0.19 -0.25 -0.67 -0.85 -1.26 -2.73 117.35 111.39 2bxr s TYR 62 Ca 0.00 0.06 -0.17 0.00 -0.52 0.00 0.00 57.07 56.44 2bxr s TYR 62 Cb 0.00 0.18 0.07 0.00 0.38 0.00 0.00 41.96 42.59 2bxr s TYR 62 CO 0.00 -0.58 0.64 0.54 -1.52 0.00 0.00 175.55 174.63 2bxr s VAL 63 N -2.79 -0.00 -0.24 -3.49 0.11 -0.29 -4.98 120.40 108.72 2bxr s VAL 63 Ca -0.03 0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 58.74 2bxr s VAL 63 Cb -0.00 -0.92 -0.02 0.00 -1.53 0.00 0.00 36.38 33.92 2bxr s VAL 63 CO -0.05 0.01 1.45 -1.81 -3.33 0.00 0.00 175.10 171.37 2bxr s ASP 64 N 1.19 6.58 -0.00 3.54 1.01 -1.26 -1.12 116.67 126.60 2bxr s ASP 64 Ca -0.07 1.49 0.12 0.00 0.71 0.00 0.00 52.55 54.80 2bxr s ASP 64 Cb -0.05 -2.54 0.33 0.00 1.01 0.00 0.00 42.92 41.68 2bxr s ASP 64 CO -0.12 -1.11 1.28 1.33 0.21 0.00 0.00 175.17 176.75 2bxr n VAL 65 N 6.16 0.52 -0.52 -1.27 0.24 0.19 -4.94 118.33 118.71 2bxr n VAL 65 Ca 0.16 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 2bxr n VAL 65 Cb 0.46 0.24 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 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 1.09 5.53 3.69 7.63 0.00 -1.24 -4.59 105.19 117.29 2bxr n GLY 66 Ca 0.13 -1.13 -0.44 0.00 0.00 0.00 0.00 46.02 44.58 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 1.22 1.07 0.00 -0.02 0.00 -0.05 -4.85 105.19 102.56 2bxr n GLY 67 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 46.02 46.55 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 2.50 1.67 -2.72 4.61 0.00 -1.26 -4.69 120.51 120.62 2bxr n ALA 68 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.20 2bxr n ALA 68 Cb 0.33 0.04 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 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 -1.10 3.44 0.03 0.00 2.02 -1.26 -4.22 117.35 116.25 2bxr s TYR 69 Ca 0.00 0.58 0.08 0.00 -0.37 0.00 0.00 57.07 57.36 2bxr s TYR 69 Cb 0.00 -2.36 -0.02 0.00 -0.40 0.00 0.00 41.96 39.17 2bxr s TYR 69 CO 0.00 0.19 -0.23 0.14 -1.57 0.00 0.00 175.55 174.08 2bxr s VAL 70 N 0.61 1.85 0.53 0.71 -7.23 0.25 -4.92 120.40 112.20 2bxr s VAL 70 Ca 0.16 -1.19 0.07 0.00 -1.81 0.00 0.00 61.98 59.22 2bxr s VAL 70 Cb -0.13 -1.57 0.05 0.00 0.56 0.00 0.00 36.38 35.28 2bxr s VAL 70 CO 0.04 0.35 0.53 -0.83 -0.31 0.00 0.00 175.10 174.88 2bxr s GLY 71 N -1.00 2.11 1.22 2.32 0.00 -1.26 -1.69 107.32 109.02 2bxr s GLY 71 Ca 0.09 -1.66 -0.20 0.00 0.00 0.00 0.00 44.72 42.96 2bxr s GLY 71 CO 0.01 -1.81 1.12 2.56 0.00 0.00 0.00 173.10 174.98 2bxr s PRO 72 N -4.39 -1.34 0.00 2.90 0.04 -1.26 -2.90 135.00 128.04 2bxr s PRO 72 Ca 0.46 -0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.34 2bxr s PRO 72 Cb -0.04 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.91 2bxr s PRO 72 CO 0.28 -3.78 0.00 0.25 0.04 0.00 0.00 177.00 173.80 2bxr n THR 73 N -4.79 0.00 -1.59 1.26 -2.24 -1.26 -4.85 114.28 100.82 2bxr n THR 73 Ca 0.14 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.62 2bxr n THR 73 Cb 0.60 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 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 -1.37 3.11 0.34 -0.78 6.02 -1.14 -4.80 117.38 118.76 2bxr n GLN 74 Ca 0.00 -2.54 0.22 0.00 -0.01 0.00 0.00 57.00 54.66 2bxr n GLN 74 Cb 0.00 -2.31 1.16 0.00 1.02 0.00 0.00 30.24 30.11 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 3.60 0.00 0.33 1.08 2.35 -1.88 -3.08 115.58 117.97 2bxr h ASN 75 Ca 0.49 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.23 2bxr h ASN 75 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 2bxr h ASN 75 CO 1.04 0.00 -0.16 0.03 -1.65 0.00 0.00 177.43 176.69 2bxr h ARG 76 N 0.00 -0.43 0.00 0.81 2.47 -1.92 -1.51 114.38 113.81 2bxr h ARG 76 Ca 0.00 0.03 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 2bxr h ARG 76 Cb 0.10 0.10 -0.00 0.00 -1.65 0.00 0.00 29.97 28.51 2bxr h ARG 76 CO -0.00 -0.10 -0.12 0.97 0.56 0.00 0.00 179.97 181.28 2bxr h ILE 77 N -0.85 0.41 0.02 2.04 6.09 -1.85 -0.07 117.51 123.31 2bxr h ILE 77 Ca -0.05 -0.66 -0.19 0.00 -1.37 0.00 0.00 64.86 62.59 2bxr h ILE 77 Cb 0.53 1.47 0.02 0.00 0.47 0.00 0.00 36.82 39.30 2bxr h ILE 77 CO 0.07 0.12 -0.74 -0.07 -3.07 0.00 0.00 178.15 174.47 2bxr h LEU 78 N 0.00 0.62 -0.39 2.19 3.38 -1.51 -1.33 115.31 118.26 2bxr h LEU 78 Ca -0.00 -0.78 -0.11 0.00 0.09 0.00 0.00 57.88 57.08 2bxr h LEU 78 Cb 0.46 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2bxr h LEU 78 CO 0.02 1.32 -0.20 -0.09 0.09 0.00 0.00 178.44 179.57 2bxr h ARG 79 N -0.01 0.83 0.84 1.13 2.43 -0.79 -1.50 114.38 117.31 2bxr h ARG 79 Ca -0.10 -0.37 -0.04 0.00 -0.81 0.00 0.00 59.98 58.66 2bxr h ARG 79 Cb 1.44 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.98 2bxr h ARG 79 CO 0.14 1.00 -0.40 1.25 -1.51 0.00 0.00 179.97 180.45 2bxr h LEU 80 N 0.64 -0.95 -1.30 3.80 5.85 -1.08 -1.60 115.31 120.67 2bxr h LEU 80 Ca 0.09 0.03 0.16 0.00 0.84 0.00 0.00 57.88 59.00 2bxr h LEU 80 Cb 0.76 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.96 2bxr h LEU 80 CO 0.06 -0.65 0.58 0.77 -0.34 0.00 0.00 178.44 178.86 2bxr h SER 81 N -1.20 0.62 -0.42 1.25 4.64 -1.27 0.37 113.55 117.54 2bxr h SER 81 Ca -0.12 0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.14 2bxr h SER 81 Cb 0.86 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 2bxr h SER 81 CO 0.19 0.29 -0.16 0.50 -0.87 0.00 0.00 176.83 176.79 2bxr h LYS 82 N 0.65 0.85 -0.35 4.77 3.64 -1.18 0.11 116.57 125.05 2bxr h LYS 82 Ca 0.46 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2bxr h LYS 82 Cb 0.82 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.59 2bxr h LYS 82 CO -0.22 0.99 0.23 1.49 -2.27 0.00 0.00 179.45 179.67 2bxr h GLU 83 N 0.68 0.47 0.00 1.90 4.81 -0.11 -1.28 114.58 121.05 2bxr h GLU 83 Ca 0.10 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2bxr h GLU 83 Cb 0.71 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2bxr h GLU 83 CO 0.05 0.32 0.00 1.28 -0.73 0.00 0.00 179.01 179.93 2bxr n LEU 84 N -4.84 0.00 0.00 1.64 4.77 -0.03 -4.83 117.00 113.71 2bxr n LEU 84 Ca -0.00 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2bxr n LEU 84 Cb 0.03 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2bxr n LEU 84 CO 0.34 -0.29 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 2bxr n GLY 85 N -0.77 0.56 3.69 -0.72 0.00 -0.48 -5.04 105.19 102.42 2bxr n GLY 85 Ca 0.03 -0.79 -0.36 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 -2.00 5.38 0.53 -0.61 1.01 0.30 -5.01 121.20 120.79 2bxr s ILE 86 Ca 0.00 0.19 -0.05 0.00 0.00 0.00 0.00 60.65 60.79 2bxr s ILE 86 Cb 0.00 -3.49 -0.01 0.00 0.01 0.00 0.00 42.46 38.97 2bxr s ILE 86 CO 0.00 0.39 0.82 -1.61 0.00 0.00 0.00 174.94 174.54 2bxr s GLU 87 N 0.75 3.21 0.36 2.79 0.41 -1.26 -4.07 118.70 120.89 2bxr s GLU 87 Ca 0.08 0.03 0.08 0.00 -0.41 0.00 0.00 54.97 54.75 2bxr s GLU 87 Cb -0.12 -2.35 -0.07 0.00 -1.78 0.00 0.00 34.13 29.81 2bxr s GLU 87 CO 0.02 -0.43 -0.05 0.95 -0.49 0.00 0.00 175.26 175.26 2bxr s THR 88 N -2.83 2.05 0.02 3.63 -4.23 -1.26 -1.41 115.64 111.62 2bxr s THR 88 Ca 0.50 -2.11 -0.02 0.00 -1.18 0.00 0.00 61.69 58.88 2bxr s THR 88 Cb -0.10 -2.77 -0.02 0.00 1.34 0.00 0.00 72.50 70.95 2bxr s THR 88 CO 0.44 -0.13 0.02 -0.72 -0.54 0.00 0.00 174.62 173.70 2bxr s TYR 89 N -2.71 0.24 -0.14 3.99 -0.85 0.19 -4.73 117.35 113.33 2bxr s TYR 89 Ca 0.33 -0.52 -0.29 0.00 -0.52 0.00 0.00 57.07 56.07 2bxr s TYR 89 Cb 0.06 -0.18 -0.02 0.00 0.38 0.00 0.00 41.96 42.19 2bxr s TYR 89 CO 0.17 -0.26 1.38 0.15 -1.52 0.00 0.00 175.55 175.46 2bxr s LYS 90 N -1.95 4.19 0.04 -3.49 1.02 -1.26 -1.74 119.74 116.55 2bxr s LYS 90 Ca -0.11 1.79 -0.30 0.00 0.02 0.00 0.00 55.97 57.36 2bxr s LYS 90 Cb -0.06 -3.84 -0.08 0.00 -0.52 0.00 0.00 37.83 33.34 2bxr s LYS 90 CO -0.02 -0.78 1.68 0.08 -0.92 0.00 0.00 175.35 175.40 2bxr s VAL 91 N 3.73 3.17 -0.23 3.17 1.01 0.12 -4.87 120.40 126.50 2bxr s VAL 91 Ca 0.60 0.50 -0.29 0.00 0.00 0.00 0.00 61.98 62.79 2bxr s VAL 91 Cb -0.25 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 2bxr s VAL 91 CO 0.19 -0.02 1.78 0.21 0.00 0.00 0.00 175.10 177.27 2bxr s ASN 92 N 2.84 6.11 -0.60 3.32 3.84 -1.26 -4.59 114.94 124.60 2bxr s ASN 92 Ca 0.75 1.65 0.03 0.00 0.21 0.00 0.00 52.86 55.50 2bxr s ASN 92 Cb -0.38 -2.53 0.39 0.00 -0.55 0.00 0.00 41.25 38.17 2bxr s ASN 92 CO 0.33 -1.47 1.39 0.52 -2.79 0.00 0.00 177.10 175.07 2bxr n VAL 93 N 6.83 3.00 -0.13 -5.21 0.31 -1.26 -4.65 118.33 117.22 2bxr n VAL 93 Ca 0.22 -4.89 -0.05 0.00 -0.01 0.00 0.00 64.34 59.60 2bxr n VAL 93 Cb 0.45 -1.29 0.01 0.00 -0.91 0.00 0.00 33.84 32.10 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 2.83 -0.71 0.00 4.52 0.02 -1.89 -3.47 113.55 114.86 2bxr h SER 94 Ca 0.37 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 2bxr h SER 94 Cb 0.59 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.51 2bxr h SER 94 CO 1.03 -0.24 0.00 -0.62 -1.14 0.00 0.00 176.83 175.86 2bxr n GLU 95 N -5.39 2.52 -2.91 3.45 4.71 -1.26 -5.00 120.64 116.77 2bxr n GLU 95 Ca 0.03 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.76 2bxr n GLU 95 Cb 0.30 0.00 -0.04 0.00 -1.01 0.00 0.00 31.44 30.68 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 4.36 4.29 0.61 3.49 0.52 -1.18 -4.57 118.95 126.47 2bxr s ARG 96 Ca 0.00 0.99 -0.19 0.00 -0.52 0.00 0.00 55.73 56.00 2bxr s ARG 96 Cb 0.00 -3.58 -0.03 0.00 0.52 0.00 0.00 34.95 31.87 2bxr s ARG 96 CO 0.00 -0.33 1.27 -0.51 0.02 0.00 0.00 175.30 175.75 2bxr s LEU 97 N 2.16 3.66 -0.13 2.53 1.02 -1.26 -2.05 118.68 124.61 2bxr s LEU 97 Ca 0.37 2.56 0.03 0.00 0.02 0.00 0.00 54.13 57.11 2bxr s LEU 97 Cb -0.16 -4.54 0.01 0.00 0.02 0.00 0.00 46.19 41.51 2bxr s LEU 97 CO 0.12 -1.77 -0.21 -0.69 0.02 0.00 0.00 176.35 173.82 2bxr s VAL 98 N -1.45 1.98 -0.00 -1.59 1.01 -0.91 -1.81 120.40 117.64 2bxr s VAL 98 Ca 0.79 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 2bxr s VAL 98 Cb -0.35 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 2bxr s VAL 98 CO 0.39 0.54 0.15 -1.58 0.00 0.00 0.00 175.10 174.59 2bxr s GLN 99 N 0.76 3.29 -0.24 2.72 0.74 0.20 -1.27 119.66 125.87 2bxr s GLN 99 Ca -0.09 -0.39 0.01 0.00 0.05 0.00 0.00 55.36 54.94 2bxr s GLN 99 Cb -0.16 -3.00 0.06 0.00 1.10 0.00 0.00 33.01 31.01 2bxr s GLN 99 CO -0.00 0.66 -0.06 -0.47 -0.55 0.00 0.00 175.29 174.87 2bxr s TYR 100 N -1.29 2.54 -0.03 1.67 5.04 -0.15 -0.51 117.35 124.62 2bxr s TYR 100 Ca 0.26 -1.86 -0.01 0.00 -2.44 0.00 0.00 57.07 53.02 2bxr s TYR 100 Cb -0.12 -1.65 0.03 0.00 0.35 0.00 0.00 41.96 40.56 2bxr s TYR 100 CO 0.17 -0.79 0.05 0.08 -1.34 0.00 0.00 175.55 173.72 2bxr s VAL 101 N 1.34 -0.07 -1.29 3.14 1.01 -1.20 -1.16 120.40 122.17 2bxr s VAL 101 Ca -0.06 0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 2bxr s VAL 101 Cb -0.19 -0.12 0.01 0.00 0.00 0.00 0.00 36.38 36.08 2bxr s VAL 101 CO -0.06 0.11 1.00 0.29 0.00 0.00 0.00 175.10 176.43 2bxr n LYS 102 N 4.43 -6.63 0.00 2.72 4.01 -1.26 -3.85 118.16 117.58 2bxr n LYS 102 Ca -0.23 0.78 0.00 0.00 -0.51 0.00 0.00 58.31 58.36 2bxr n LYS 102 Cb 0.50 -5.73 0.00 0.00 -0.51 0.00 0.00 35.03 29.29 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 -1.50 1.96 3.36 0.72 0.00 -1.26 -5.00 105.19 103.48 2bxr n GLY 103 Ca -0.18 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 2bxr n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bxr s LYS 104 N 0.00 -2.62 0.01 1.61 0.00 -1.25 -5.03 119.74 112.46 2bxr s LYS 104 Ca 0.00 0.08 0.01 0.00 0.00 0.00 0.00 55.97 56.06 2bxr s LYS 104 Cb 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 37.83 36.40 2bxr s LYS 104 CO 0.00 -4.66 -0.05 0.95 0.00 0.00 0.00 175.35 171.59 2bxr s THR 105 N -2.44 0.36 -0.08 3.79 -4.23 -1.26 -3.27 115.64 108.51 2bxr s THR 105 Ca 0.69 -0.50 0.04 0.00 -1.18 0.00 0.00 61.69 60.74 2bxr s THR 105 Cb -0.12 -0.37 0.00 0.00 1.34 0.00 0.00 72.50 73.35 2bxr s THR 105 CO 0.57 -0.10 -0.21 -0.31 -0.54 0.00 0.00 174.62 174.04 2bxr s TYR 106 N -0.59 2.21 -0.30 3.99 2.02 0.33 -4.98 117.35 120.03 2bxr s TYR 106 Ca -0.03 -0.85 -0.10 0.00 -0.37 0.00 0.00 57.07 55.71 2bxr s TYR 106 Cb -0.05 -1.50 -0.02 0.00 -0.40 0.00 0.00 41.96 39.99 2bxr s TYR 106 CO -0.00 -0.34 0.17 -1.25 -1.57 0.00 0.00 175.55 172.56 2bxr s PRO 107 N 0.35 3.57 0.00 -1.71 0.04 -1.26 0.60 135.00 136.59 2bxr s PRO 107 Ca -0.15 -0.57 0.00 0.00 0.04 0.00 0.00 61.00 60.32 2bxr s PRO 107 Cb -0.17 -3.62 0.00 0.00 0.04 0.00 0.00 34.50 30.76 2bxr s PRO 107 CO 0.07 -0.33 0.00 1.19 0.04 0.00 0.00 177.00 177.96 2bxr n PHE 108 N 5.03 0.00 0.00 0.56 3.01 -0.75 -4.99 117.46 120.32 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 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 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 -4.27 116.66 106.03 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 -0.06 0.00 0.00 -3.04 0.00 0.00 32.46 29.36 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 1.30 -0.21 0.41 2.89 0.00 -1.26 -5.03 105.19 103.29 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 -3.24 1.61 -0.00 -1.26 -5.06 117.44 109.49 2bxr n TRP 116 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.50 57.09 2bxr n TRP 116 Cb 0.00 0.07 -0.08 0.00 -0.00 0.00 0.00 31.31 31.30 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 -0.48 6.35 0.00 5.87 2.47 -1.26 -5.03 114.94 122.85 2bxr s ASN 117 Ca 0.00 0.12 0.00 0.00 0.42 0.00 0.00 52.86 53.40 2bxr s ASN 117 Cb 0.00 -2.27 0.00 0.00 -1.45 0.00 0.00 41.25 37.53 2bxr s ASN 117 CO 0.00 -0.43 0.11 -2.65 -3.72 0.00 0.00 177.10 170.41 2bxr n PRO 118 N 5.70 0.00 -0.48 0.43 -0.02 -1.26 0.62 135.00 139.99 2bxr n PRO 118 Ca -0.05 0.11 0.42 0.00 -2.02 0.00 0.00 63.50 61.96 2bxr n PRO 118 Cb 0.49 -0.42 0.76 0.00 -0.02 0.00 0.00 33.50 34.32 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 0.63 117.51 122.74 2bxr h ILE 119 Ca 0.00 -0.01 -0.18 0.00 1.08 0.00 0.00 64.86 65.76 2bxr h ILE 119 Cb 0.00 0.22 -0.03 0.00 -1.09 0.00 0.00 36.82 35.92 2bxr h ILE 119 CO 0.00 0.00 -0.84 0.00 -1.08 0.00 0.00 178.15 176.24 2bxr h ALA 120 N 1.28 0.46 0.05 0.18 0.00 -1.82 -1.94 119.26 117.46 2bxr h ALA 120 Ca 0.73 -0.76 -0.30 0.00 0.00 0.00 0.00 54.91 54.58 2bxr h ALA 120 Cb 2.83 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 20.46 2bxr h ALA 120 CO -0.05 1.05 -1.61 0.10 0.00 0.00 0.00 179.25 178.74 2bxr h TYR 121 N 0.00 0.19 -0.93 0.00 -0.00 0.56 0.23 116.97 117.02 2bxr h TYR 121 Ca -0.01 -0.14 0.11 0.00 0.00 0.00 0.00 58.73 58.70 2bxr h TYR 121 Cb 1.64 -0.01 -0.08 0.00 0.00 0.00 0.00 36.73 38.28 2bxr h TYR 121 CO 0.00 1.22 0.56 -0.07 -0.00 0.00 0.00 178.16 179.87 2bxr h LEU 122 N 0.03 0.80 -0.07 0.10 3.38 -0.82 0.43 115.31 119.16 2bxr h LEU 122 Ca -0.26 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 2bxr h LEU 122 Cb 1.99 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.63 2bxr h LEU 122 CO 0.11 0.43 0.03 -0.78 0.09 0.00 0.00 178.44 178.32 2bxr h ASP 123 N 0.89 0.09 0.00 -0.43 3.58 -1.30 -2.86 116.42 116.38 2bxr h ASP 123 Ca 0.46 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.80 2bxr h ASP 123 Cb 0.47 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.49 2bxr h ASP 123 CO -0.27 0.18 0.00 -1.22 -2.88 0.00 0.00 179.24 175.05 2bxr n TYR 124 N -4.98 0.00 0.21 0.28 4.02 0.06 -1.86 117.16 114.89 2bxr n TYR 124 Ca -0.06 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.91 2bxr n TYR 124 Cb 0.09 -0.42 0.37 0.00 -0.02 0.00 0.00 39.34 39.36 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 -0.76 7.72 7.08 -1.28 -2.15 115.58 126.19 2bxr h ASN 125 Ca 0.00 0.00 0.11 0.00 -3.08 0.00 0.00 56.30 53.33 2bxr h ASN 125 Cb 0.00 0.00 -0.05 0.00 -2.08 0.00 0.00 38.32 36.19 2bxr h ASN 125 CO 0.00 0.27 0.50 -1.13 -2.08 0.00 0.00 177.43 174.99 2bxr h ASN 126 N 0.00 0.54 -0.31 6.14 -1.24 -1.23 0.13 115.58 119.61 2bxr h ASN 126 Ca -0.00 0.02 -0.15 0.00 0.71 0.00 0.00 56.30 56.88 2bxr h ASN 126 Cb 0.86 -0.09 -0.00 0.00 0.73 0.00 0.00 38.32 39.82 2bxr h ASN 126 CO 0.04 0.31 -0.39 0.25 -1.29 0.00 0.00 177.43 176.35 2bxr h LEU 127 N 0.60 0.87 -0.46 0.34 5.85 -0.68 -0.26 115.31 121.57 2bxr h LEU 127 Ca 0.36 -0.49 -0.17 0.00 0.84 0.00 0.00 57.88 58.42 2bxr h LEU 127 Cb 0.58 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2bxr h LEU 127 CO -0.13 1.19 -0.76 -0.50 -0.34 0.00 0.00 178.44 177.90 2bxr h TRP 128 N 0.57 0.22 -0.37 1.25 6.55 -1.39 -1.35 115.95 121.42 2bxr h TRP 128 Ca 0.04 -0.11 0.00 0.00 0.95 0.00 0.00 58.89 59.77 2bxr h TRP 128 Cb 0.98 -0.03 -0.02 0.00 -0.86 0.00 0.00 29.16 29.23 2bxr h TRP 128 CO 0.07 0.85 0.24 -0.09 -1.05 0.00 0.00 178.44 178.47 2bxr h ARG 129 N 0.10 0.50 -0.51 0.49 2.43 -0.67 -2.44 114.38 114.29 2bxr h ARG 129 Ca -0.02 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2bxr h ARG 129 Cb 1.33 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.75 2bxr h ARG 129 CO 0.11 0.34 0.21 1.15 -1.51 0.00 0.00 179.97 180.28 2bxr h THR 130 N 0.50 1.21 -0.57 0.20 2.02 -0.80 -1.58 112.91 113.89 2bxr h THR 130 Ca 0.14 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.67 2bxr h THR 130 Cb -0.04 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 2bxr h THR 130 CO -0.03 0.25 0.36 0.40 0.37 0.00 0.00 175.52 176.87 2bxr h ILE 131 N 0.68 1.15 0.05 3.11 2.04 -1.14 0.13 117.51 123.53 2bxr h ILE 131 Ca 0.17 -0.30 -0.17 0.00 1.00 0.00 0.00 64.86 65.57 2bxr h ILE 131 Cb 0.18 0.33 0.02 0.00 -0.74 0.00 0.00 36.82 36.61 2bxr h ILE 131 CO -0.02 0.15 -0.68 0.44 0.00 0.00 0.00 178.15 178.04 2bxr h ASP 132 N 0.77 0.51 -0.82 1.72 3.32 -1.03 -1.16 116.42 119.72 2bxr h ASP 132 Ca 0.21 -0.83 0.08 0.00 0.02 0.00 0.00 57.03 56.50 2bxr h ASP 132 Cb -0.07 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.27 2bxr h ASP 132 CO -0.04 1.29 0.54 0.78 -1.72 0.00 0.00 179.24 180.08 2bxr h ASN 133 N -0.20 0.76 -0.66 6.45 4.21 -1.07 0.20 115.58 125.27 2bxr h ASN 133 Ca -0.10 0.01 -0.09 0.00 1.21 0.00 0.00 56.30 57.34 2bxr h ASN 133 Cb 1.44 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 38.46 2bxr h ASN 133 CO 0.13 0.47 0.08 0.24 -1.29 0.00 0.00 177.43 177.07 2bxr h MET 134 N 0.85 1.11 -0.60 0.81 2.86 -0.68 -2.93 114.93 116.35 2bxr h MET 134 Ca 0.37 -0.31 0.12 0.00 -2.06 0.00 0.00 59.70 57.82 2bxr h MET 134 Cb 0.31 -0.12 -0.10 0.00 0.06 0.00 0.00 31.60 31.75 2bxr h MET 134 CO -0.14 1.03 0.01 0.78 1.06 0.00 0.00 176.91 179.65 2bxr h GLY 135 N 1.04 0.64 -0.66 8.32 0.00 0.67 -2.37 103.07 110.70 2bxr h GLY 135 Ca 0.20 0.07 0.33 0.00 0.00 0.00 0.00 47.33 47.93 2bxr h GLY 135 CO 0.02 -0.18 0.49 0.50 0.00 0.00 0.00 176.54 177.36 2bxr h LYS 136 N 0.13 0.20 0.00 4.80 1.57 -1.13 0.91 116.57 123.05 2bxr h LYS 136 Ca 0.31 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 2bxr h LYS 136 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2bxr h LYS 136 CO -0.50 0.14 0.00 0.93 -0.57 0.00 0.00 179.45 179.44 2bxr h GLU 137 N 0.21 0.00 -4.44 3.15 5.08 -1.56 -3.44 114.58 113.58 2bxr h GLU 137 Ca 0.73 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 58.37 2bxr h GLU 137 Cb 1.73 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.76 2bxr h GLU 137 CO -0.67 0.00 -0.37 0.42 -1.00 0.00 0.00 179.01 177.39 2bxr s ILE 138 N -3.58 5.23 0.02 3.13 1.01 0.31 -4.26 121.20 123.07 2bxr s ILE 138 Ca 0.01 -0.82 -0.30 0.00 0.00 0.00 0.00 60.65 59.55 2bxr s ILE 138 Cb 0.09 -4.03 -0.09 0.00 0.01 0.00 0.00 42.46 38.45 2bxr s ILE 138 CO 0.44 -0.44 1.96 -2.16 0.00 0.00 0.00 174.94 174.75 2bxr s PRO 139 N 1.71 4.10 0.50 2.79 0.04 -1.26 -4.85 135.00 138.02 2bxr s PRO 139 Ca 0.05 2.57 0.24 0.00 0.04 0.00 0.00 61.00 63.90 2bxr s PRO 139 Cb -0.21 -4.16 1.34 0.00 0.04 0.00 0.00 34.50 31.50 2bxr s PRO 139 CO 0.09 -1.00 2.06 1.79 0.04 0.00 0.00 177.00 179.97 2bxr h THR 140 N 5.70 0.73 -0.00 1.26 1.35 -1.95 0.33 112.91 120.33 2bxr h THR 140 Ca -0.49 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 2bxr h THR 140 Cb 1.23 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 2bxr h THR 140 CO 0.94 0.13 -0.08 0.47 -0.25 0.00 0.00 175.52 176.74 2bxr n ASP 141 N -3.84 0.16 -2.70 5.36 8.00 -1.26 -4.54 116.55 117.72 2bxr n ASP 141 Ca -0.02 -0.03 -0.06 0.00 0.71 0.00 0.00 54.79 55.39 2bxr n ASP 141 Cb 0.23 -0.26 0.07 0.00 -0.02 0.00 0.00 41.12 41.15 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 -1.31 -2.37 0.30 2.24 0.00 0.01 -5.01 120.51 114.37 2bxr n ALA 142 Ca 0.11 -0.86 0.18 0.00 0.00 0.00 0.00 53.44 52.87 2bxr n ALA 142 Cb 0.29 -2.27 0.96 0.00 0.00 0.00 0.00 19.45 18.43 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 3.28 0.00 0.00 0.00 0.13 -1.54 0.11 132.00 133.98 2bxr h PRO 143 Ca -0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.93 2bxr h PRO 143 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2bxr h PRO 143 CO 0.06 0.00 0.00 0.11 -0.23 0.00 0.00 178.00 177.94 2bxr h TRP 144 N 0.00 0.00 -0.00 1.56 0.09 -1.87 -2.40 115.95 113.33 2bxr h TRP 144 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.01 2bxr h TRP 144 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.65 2bxr h TRP 144 CO 0.00 0.00 -0.30 0.39 0.09 0.00 0.00 178.44 178.62 2bxr n GLU 145 N -2.82 0.33 -1.64 0.12 1.02 0.37 -4.77 120.64 113.24 2bxr n GLU 145 Ca -0.01 -0.16 -0.45 0.00 -0.02 0.00 0.00 57.16 56.53 2bxr n GLU 145 Cb 0.17 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.07 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 -1.20 0.50 -0.33 0.62 0.00 -0.91 -4.81 120.51 114.38 2bxr n ALA 146 Ca 0.09 0.40 0.18 0.00 0.00 0.00 0.00 53.44 54.12 2bxr n ALA 146 Cb 0.33 -2.16 0.43 0.00 0.00 0.00 0.00 19.45 18.04 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 3.09 0.53 -0.64 0.00 -0.00 -1.92 0.30 115.11 116.46 2bxr h GLN 147 Ca -0.43 -0.03 -0.21 0.00 -0.00 0.00 0.00 58.65 57.98 2bxr h GLN 147 Cb 1.31 -0.12 -0.12 0.00 0.00 0.00 0.00 27.48 28.54 2bxr h GLN 147 CO 0.68 0.35 0.22 0.72 0.00 0.00 0.00 178.83 180.79 2bxr n HIS 148 N -4.72 2.11 -0.22 3.99 8.25 -1.26 -4.77 115.22 118.60 2bxr n HIS 148 Ca 0.25 -1.27 -0.10 0.00 -0.26 0.00 0.00 57.72 56.34 2bxr n HIS 148 Cb 0.75 -0.63 -0.05 0.00 1.12 0.00 0.00 29.99 31.17 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 2.16 -0.44 0.16 -1.41 0.00 -0.70 -2.51 119.26 116.52 2bxr h ALA 149 Ca 0.26 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2bxr h ALA 149 Cb 2.17 1.04 0.00 0.00 0.00 0.00 0.00 17.79 21.00 2bxr h ALA 149 CO 0.65 -0.89 -0.08 -0.44 0.00 0.00 0.00 179.25 178.50 2bxr h ASP 150 N -0.24 -0.18 -0.72 0.00 3.32 -1.86 0.15 116.42 116.89 2bxr h ASP 150 Ca 0.16 -0.17 0.15 0.00 0.02 0.00 0.00 57.03 57.19 2bxr h ASP 150 Cb 0.56 0.05 -0.11 0.00 0.22 0.00 0.00 39.33 40.05 2bxr h ASP 150 CO -0.70 0.07 0.19 0.50 -1.72 0.00 0.00 179.24 177.58 2bxr h LYS 151 N -0.44 0.28 0.00 3.56 3.64 -1.94 -0.75 116.57 120.93 2bxr h LYS 151 Ca -0.02 -0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.15 2bxr h LYS 151 Cb 0.34 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 2bxr h LYS 151 CO 0.04 0.19 -0.86 -1.49 -2.27 0.00 0.00 179.45 175.05 2bxr h TRP 152 N 0.29 0.26 -0.04 1.91 4.06 -1.10 -3.09 115.95 118.24 2bxr h TRP 152 Ca 0.40 -0.14 -0.23 0.00 2.06 0.00 0.00 58.89 60.98 2bxr h TRP 152 Cb 0.67 -0.03 0.01 0.00 -1.00 0.00 0.00 29.16 28.81 2bxr h TRP 152 CO -0.25 0.95 -0.91 0.22 -3.56 0.00 0.00 178.44 174.89 2bxr h ASP 153 N 0.10 0.73 -0.08 -3.49 3.58 -0.25 -2.59 116.42 114.42 2bxr h ASP 153 Ca -0.04 -0.55 0.02 0.00 0.42 0.00 0.00 57.03 56.89 2bxr h ASP 153 Cb 1.48 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 42.31 2bxr h ASP 153 CO 0.13 1.34 0.06 0.11 -2.88 0.00 0.00 179.24 178.00 2bxr h LYS 154 N 0.35 0.00 -6.37 0.28 1.79 -1.20 0.49 116.57 111.92 2bxr h LYS 154 Ca -0.08 0.00 -0.55 0.00 -2.18 0.00 0.00 60.65 57.83 2bxr h LYS 154 Cb 1.54 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.16 2bxr h LYS 154 CO 0.17 0.00 0.06 1.41 -1.08 0.00 0.00 179.45 180.01 2bxr s MET 155 N -5.03 4.36 0.37 3.15 1.75 -1.09 -4.76 119.30 118.06 2bxr s MET 155 Ca -0.05 0.92 -0.18 0.00 -1.25 0.00 0.00 55.69 55.14 2bxr s MET 155 Cb 0.17 -3.24 -0.10 0.00 2.84 0.00 0.00 34.83 34.50 2bxr s MET 155 CO 0.67 0.61 0.83 -0.08 -0.65 0.00 0.00 175.02 176.40 2bxr s THR 156 N -1.14 4.55 -0.41 10.11 -1.32 -1.26 -1.53 115.64 124.64 2bxr s THR 156 Ca 0.32 1.18 0.25 0.00 -1.21 0.00 0.00 61.69 62.23 2bxr s THR 156 Cb -0.21 -3.61 0.27 0.00 -1.51 0.00 0.00 72.50 67.44 2bxr s THR 156 CO 0.22 -0.25 1.75 -0.03 -2.21 0.00 0.00 174.62 174.10 2bxr h MET 157 N 2.08 0.00 0.13 7.08 4.05 -0.92 -2.35 114.93 125.00 2bxr h MET 157 Ca -0.48 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 58.93 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 0.63 0.00 -0.06 -0.22 0.23 0.00 0.00 176.91 177.49 2bxr h LYS 158 N 0.00 -0.17 -0.97 0.39 3.64 -1.82 -2.79 116.57 114.84 2bxr h LYS 158 Ca 0.00 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 2bxr h LYS 158 Cb 0.40 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 2bxr h LYS 158 CO 0.00 0.30 0.64 1.05 -2.27 0.00 0.00 179.45 179.16 2bxr h GLU 159 N -0.82 1.21 -0.31 1.90 4.11 -1.85 0.10 114.58 118.91 2bxr h GLU 159 Ca -0.02 -0.07 0.06 0.00 0.07 0.00 0.00 59.36 59.40 2bxr h GLU 159 Cb 0.55 -0.27 -0.06 0.00 0.50 0.00 0.00 28.75 29.47 2bxr h GLU 159 CO 0.03 0.80 -0.06 1.25 0.07 0.00 0.00 179.01 181.10 2bxr h LEU 160 N 1.24 -0.25 -0.10 3.06 5.85 -1.50 0.72 115.31 124.33 2bxr h LEU 160 Ca 0.38 0.09 0.02 0.00 0.84 0.00 0.00 57.88 59.21 2bxr h LEU 160 Cb -0.02 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 2bxr h LEU 160 CO -0.11 -0.09 -0.04 0.40 -0.34 0.00 0.00 178.44 178.26 2bxr h ILE 161 N 0.02 0.86 -0.43 4.05 2.04 -0.69 -1.03 117.51 122.33 2bxr h ILE 161 Ca 0.15 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.01 2bxr h ILE 161 Cb 0.22 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2bxr h ILE 161 CO -0.31 0.00 0.28 0.44 0.00 0.00 0.00 178.15 178.56 2bxr h ASP 162 N -0.03 0.50 -0.24 1.72 3.32 -0.30 0.30 116.42 121.70 2bxr h ASP 162 Ca 0.06 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.13 2bxr h ASP 162 Cb 0.11 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2bxr h ASP 162 CO -0.12 0.37 0.17 0.50 -1.72 0.00 0.00 179.24 178.44 2bxr h LYS 163 N 0.58 0.13 0.00 3.56 3.64 0.82 -3.28 116.57 122.01 2bxr h LYS 163 Ca 0.16 -0.01 -0.25 0.00 -1.27 0.00 0.00 60.65 59.28 2bxr h LYS 163 Cb -0.05 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.70 2bxr h LYS 163 CO -0.03 0.08 -1.43 -0.89 -2.27 0.00 0.00 179.45 174.92 2bxr n ILE 164 N -4.49 1.52 -2.57 2.00 5.41 -0.42 -4.94 119.36 115.88 2bxr n ILE 164 Ca 0.02 -0.07 -0.41 0.00 1.00 0.00 0.00 62.75 63.29 2bxr n ILE 164 Cb 0.22 -2.05 -0.04 0.00 -0.71 0.00 0.00 39.64 37.07 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 5.66 0.00 -2.20 0.00 4.06 -1.88 -3.44 115.95 118.15 2bxr h TRP 166 Ca -0.43 0.00 -0.55 0.00 2.06 0.00 0.00 58.89 59.97 2bxr h TRP 166 Cb 1.21 0.00 -0.09 0.00 -1.00 0.00 0.00 29.16 29.29 2bxr h TRP 166 CO 0.64 0.22 -0.63 0.95 -3.56 0.00 0.00 178.44 176.07 2bxr s THR 167 N -3.18 3.59 -0.75 1.49 -4.23 -1.26 -5.04 115.64 106.25 2bxr s THR 167 Ca -0.00 -1.84 0.26 0.00 -1.18 0.00 0.00 61.69 58.93 2bxr s THR 167 Cb 0.09 -2.93 0.26 0.00 1.34 0.00 0.00 72.50 71.26 2bxr s THR 167 CO 0.78 -0.37 1.75 0.29 -0.54 0.00 0.00 174.62 176.53 2bxr n LYS 168 N -0.94 0.24 0.08 3.99 5.02 -1.26 -2.34 118.16 122.94 2bxr n LYS 168 Ca -0.07 0.18 -0.10 0.00 -2.02 0.00 0.00 58.31 56.31 2bxr n LYS 168 Cb 0.59 -1.76 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 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 0.61 0.07 -0.18 2.02 -1.96 -1.73 112.91 111.74 2bxr h THR 169 Ca 0.00 -1.02 0.01 0.00 0.77 0.00 0.00 66.41 66.17 2bxr h THR 169 Cb 0.71 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.13 2bxr h THR 169 CO 0.00 0.16 -0.39 0.00 0.37 0.00 0.00 175.52 175.67 2bxr h ALA 170 N -0.54 -0.87 -0.99 6.16 0.00 -1.81 0.45 119.26 121.66 2bxr h ALA 170 Ca -0.03 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.90 2bxr h ALA 170 Cb 0.48 0.79 -0.12 0.00 0.00 0.00 0.00 17.79 18.93 2bxr h ALA 170 CO 0.05 -0.97 -0.57 0.07 0.00 0.00 0.00 179.25 177.83 2bxr h ARG 171 N -0.54 -0.01 -0.10 0.00 0.11 -1.59 0.32 114.38 112.57 2bxr h ARG 171 Ca -0.00 0.00 0.02 0.00 0.10 0.00 0.00 59.98 60.09 2bxr h ARG 171 Cb 0.55 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.61 2bxr h ARG 171 CO -0.22 -0.00 0.00 0.07 0.10 0.00 0.00 179.97 179.92 2bxr h ARG 172 N -0.01 0.04 -0.66 0.08 -0.00 -1.10 -2.04 114.38 110.68 2bxr h ARG 172 Ca 0.18 -0.00 0.06 0.00 -0.00 0.00 0.00 59.98 60.21 2bxr h ARG 172 Cb 0.43 -0.01 -0.04 0.00 -0.00 0.00 0.00 29.97 30.35 2bxr h ARG 172 CO -0.94 0.03 0.44 0.35 -0.00 0.00 0.00 179.97 179.84 2bxr h PHE 173 N 0.04 0.69 -0.22 4.08 3.57 0.16 -2.44 116.94 122.82 2bxr h PHE 173 Ca 0.05 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 2bxr h PHE 173 Cb 0.05 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 38.56 2bxr h PHE 173 CO -0.13 0.38 -0.19 0.00 -2.23 0.00 0.00 178.31 176.14 2bxr h ALA 174 N 1.64 0.32 -0.75 2.41 0.00 -0.08 -2.63 119.26 120.17 2bxr h ALA 174 Ca 0.28 -0.35 0.17 0.00 0.00 0.00 0.00 54.91 55.02 2bxr h ALA 174 Cb 0.23 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 17.82 2bxr h ALA 174 CO -0.09 0.25 0.05 1.88 0.00 0.00 0.00 179.25 181.34 2bxr h TYR 175 N 0.22 0.04 -0.08 0.00 0.05 -0.88 0.13 116.97 116.45 2bxr h TYR 175 Ca 0.04 0.05 -0.08 0.00 0.05 0.00 0.00 58.73 58.79 2bxr h TYR 175 Cb 0.73 0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.56 2bxr h TYR 175 CO 0.07 -0.21 -0.32 1.25 -1.05 0.00 0.00 178.16 177.91 2bxr h LEU 176 N 0.14 0.14 -0.67 3.88 6.46 -1.38 0.32 115.31 124.21 2bxr h LEU 176 Ca 0.42 -0.05 -0.05 0.00 -0.12 0.00 0.00 57.88 58.09 2bxr h LEU 176 Cb 0.75 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.61 2bxr h LEU 176 CO -0.63 0.46 0.23 0.15 -0.62 0.00 0.00 178.44 178.03 2bxr h PHE 177 N 0.13 1.05 -0.24 1.25 3.57 -0.45 0.21 116.94 122.45 2bxr h PHE 177 Ca 0.02 -0.10 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 2bxr h PHE 177 Cb 0.63 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2bxr h PHE 177 CO 0.01 0.84 0.01 0.28 -2.23 0.00 0.00 178.31 177.21 2bxr h VAL 178 N 0.96 1.25 -0.23 1.41 2.07 -0.09 -1.53 116.25 120.10 2bxr h VAL 178 Ca 0.22 -0.87 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2bxr h VAL 178 Cb 0.26 1.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 2bxr h VAL 178 CO -0.01 0.27 -0.37 0.78 0.02 0.00 0.00 177.57 178.26 2bxr h ASN 179 N 0.20 -1.18 -0.40 0.57 2.35 0.01 -1.04 115.58 116.10 2bxr h ASN 179 Ca 0.07 0.17 0.01 0.00 -0.55 0.00 0.00 56.30 56.01 2bxr h ASN 179 Cb 0.39 0.51 -0.02 0.00 0.05 0.00 0.00 38.32 39.25 2bxr h ASN 179 CO 0.01 -0.37 0.24 0.40 -1.65 0.00 0.00 177.43 176.06 2bxr h ILE 180 N -0.39 1.06 0.12 2.81 2.04 -0.50 -0.51 117.51 122.15 2bxr h ILE 180 Ca 0.11 -0.17 -0.22 0.00 1.00 0.00 0.00 64.86 65.58 2bxr h ILE 180 Cb 0.58 0.52 0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2bxr h ILE 180 CO -0.44 0.09 -0.95 0.78 0.00 0.00 0.00 178.15 177.63 2bxr h ASN 181 N 0.50 0.63 -0.12 1.72 2.35 -1.12 -3.37 115.58 116.17 2bxr h ASN 181 Ca 0.15 -0.88 -0.05 0.00 -0.55 0.00 0.00 56.30 54.98 2bxr h ASN 181 Cb -0.02 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 2bxr h ASN 181 CO -0.06 1.45 -0.23 1.33 -1.65 0.00 0.00 177.43 178.27 2bxr n VAL 182 N -4.02 2.23 -4.17 2.81 0.24 -0.41 -4.94 118.33 110.08 2bxr n VAL 182 Ca -0.13 -2.77 -0.36 0.00 -2.04 0.00 0.00 64.34 59.04 2bxr n VAL 182 Cb 0.86 -0.26 -0.07 0.00 -1.47 0.00 0.00 33.84 32.90 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 -1.14 -0.17 -4.09 3.34 -2.24 -0.20 -4.77 114.28 105.01 2bxr n THR 183 Ca 0.22 -0.08 -0.12 0.00 -2.27 0.00 0.00 64.05 61.79 2bxr n THR 183 Cb 0.79 -0.52 -0.06 0.00 -2.10 0.00 0.00 70.33 68.43 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 -3.22 0.45 -0.15 3.42 0.01 -1.25 -1.93 113.70 111.03 2bxr s SER 184 Ca 0.60 -1.29 -0.13 0.00 1.31 0.00 0.00 55.95 56.43 2bxr s SER 184 Cb -0.35 0.57 -0.05 0.00 0.21 0.00 0.00 66.02 66.41 2bxr s SER 184 CO 0.90 -1.14 0.29 -1.61 0.41 0.00 0.00 173.24 172.09 2bxr s GLU 185 N -3.63 4.20 0.20 12.44 0.41 -1.26 -3.67 118.70 127.38 2bxr s GLU 185 Ca 0.30 0.09 -0.11 0.00 -0.41 0.00 0.00 54.97 54.84 2bxr s GLU 185 Cb 0.01 -3.40 0.25 0.00 -1.78 0.00 0.00 34.13 29.21 2bxr s GLU 185 CO 0.15 0.29 1.23 -2.30 -0.49 0.00 0.00 175.26 174.14 2bxr n PRO 186 N 3.41 -0.15 0.03 0.39 -0.02 -1.26 0.04 135.00 137.43 2bxr n PRO 186 Ca -0.12 1.23 0.02 0.00 -2.02 0.00 0.00 63.50 62.60 2bxr n PRO 186 Cb 0.52 -1.83 0.09 0.00 -0.02 0.00 0.00 33.50 32.27 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 -5.21 0.11 0.52 6.00 1.44 -1.26 -2.65 115.22 114.16 2bxr n HIS 187 Ca 0.10 0.06 0.09 0.00 -2.01 0.00 0.00 57.72 55.95 2bxr n HIS 187 Cb 0.34 -0.58 -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 -1.60 0.92 -4.98 -1.40 1.02 0.11 -4.84 120.64 109.87 2bxr n GLU 188 Ca -0.00 -0.06 -0.32 0.00 -0.02 0.00 0.00 57.16 56.75 2bxr n GLU 188 Cb 0.02 -1.37 -0.14 0.00 -0.02 0.00 0.00 31.44 29.92 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 -2.90 2.76 0.22 2.62 -7.23 -1.09 -4.10 120.40 110.68 2bxr s VAL 189 Ca 0.02 -0.81 -0.32 0.00 -1.81 0.00 0.00 61.98 59.05 2bxr s VAL 189 Cb 0.13 -2.08 -0.14 0.00 0.56 0.00 0.00 36.38 34.85 2bxr s VAL 189 CO 0.74 0.57 1.44 -0.24 -0.31 0.00 0.00 175.10 177.30 2bxr n SER 190 N 2.78 2.82 -0.08 4.85 2.88 0.11 -0.83 113.62 126.15 2bxr n SER 190 Ca -0.17 1.13 -0.10 0.00 -1.33 0.00 0.00 58.87 58.40 2bxr n SER 190 Cb 0.52 -1.42 -0.03 0.00 -0.75 0.00 0.00 64.21 62.53 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 4.59 0.35 0.03 -1.46 0.00 -1.25 -1.72 119.26 119.81 2bxr h ALA 191 Ca -0.45 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.39 2bxr h ALA 191 Cb 1.27 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 2bxr h ALA 191 CO 0.79 -0.09 -0.25 1.25 0.00 0.00 0.00 179.25 180.95 2bxr h LEU 192 N 0.31 -0.72 -0.62 0.00 5.85 -1.72 -0.15 115.31 118.25 2bxr h LEU 192 Ca 0.09 0.10 0.09 0.00 0.84 0.00 0.00 57.88 59.00 2bxr h LEU 192 Cb 0.12 0.29 -0.07 0.00 0.37 0.00 0.00 40.66 41.37 2bxr h LEU 192 CO -0.01 -0.32 0.26 -0.25 -0.34 0.00 0.00 178.44 177.77 2bxr h TRP 193 N -0.40 0.45 -0.34 1.25 7.01 -1.86 -1.44 115.95 120.61 2bxr h TRP 193 Ca 0.05 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.02 2bxr h TRP 193 Cb 0.47 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.41 2bxr h TRP 193 CO -0.27 0.14 -0.03 0.35 -2.79 0.00 0.00 178.44 175.84 2bxr h PHE 194 N 0.46 0.68 -0.94 2.65 3.57 -0.53 0.19 116.94 123.02 2bxr h PHE 194 Ca 0.31 -0.13 0.01 0.00 3.53 0.00 0.00 57.97 61.69 2bxr h PHE 194 Cb 0.36 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.88 2bxr h PHE 194 CO -0.15 0.75 0.61 -0.07 -2.23 0.00 0.00 178.31 177.22 2bxr h LEU 195 N 0.42 1.10 0.11 0.59 3.38 -0.80 -1.24 115.31 118.86 2bxr h LEU 195 Ca 0.09 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2bxr h LEU 195 Cb 0.50 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2bxr h LEU 195 CO 0.02 0.81 -0.05 -0.25 0.09 0.00 0.00 178.44 179.06 2bxr h TRP 196 N 1.28 -0.13 -0.49 1.13 7.01 -0.93 -2.55 115.95 121.27 2bxr h TRP 196 Ca 0.34 -0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.44 2bxr h TRP 196 Cb -0.12 0.04 -0.10 0.00 -2.10 0.00 0.00 29.16 26.88 2bxr h TRP 196 CO 0.00 0.02 -0.27 -0.92 -2.79 0.00 0.00 178.44 174.48 2bxr h TYR 197 N -0.26 -0.70 -0.27 2.65 3.20 0.34 0.19 116.97 122.12 2bxr h TYR 197 Ca -0.01 0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 2bxr h TYR 197 Cb 0.21 0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 2bxr h TYR 197 CO -0.03 -0.34 -0.09 0.28 -1.64 0.00 0.00 178.16 176.33 2bxr h VAL 198 N -0.15 1.29 -0.36 1.81 2.07 -1.30 -2.78 116.25 116.83 2bxr h VAL 198 Ca 0.22 -1.15 0.07 0.00 0.82 0.00 0.00 66.70 66.66 2bxr h VAL 198 Cb 0.51 1.48 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 2bxr h VAL 198 CO -0.58 0.36 -0.09 0.50 0.02 0.00 0.00 177.57 177.78 2bxr h LYS 199 N 0.28 0.00 -0.05 1.57 3.11 -0.81 -0.80 116.57 119.88 2bxr h LYS 199 Ca 0.06 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 2bxr h LYS 199 Cb 0.59 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.82 2bxr h LYS 199 CO 0.03 0.00 0.00 0.00 -2.81 0.00 0.00 179.45 176.67 2bxr n GLN 200 N -5.28 0.53 0.00 1.90 -0.00 0.56 -0.20 117.38 114.89 2bxr n GLN 200 Ca 0.01 0.00 0.03 0.00 -0.00 0.00 0.00 57.00 57.04 2bxr n GLN 200 Cb 0.20 -1.02 0.00 0.00 -0.00 0.00 0.00 30.24 29.42 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 0.69 1.07 3.06 0.00 0.00 0.72 -4.51 105.19 106.22 2bxr n GLY 202 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.85 -2.34 0.48 -0.02 0.00 -0.41 -4.26 105.19 96.79 2bxr n GLY 203 Ca 0.00 -1.64 -0.18 0.00 0.00 0.00 0.00 46.02 44.21 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 0.05 -0.22 2.61 1.35 -1.90 -2.33 112.91 112.48 2bxr h THR 204 Ca 0.00 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.88 2bxr h THR 204 Cb 0.00 0.05 -0.03 0.00 -1.73 0.00 0.00 68.15 66.44 2bxr h THR 204 CO 0.00 0.00 -0.13 0.41 -0.25 0.00 0.00 175.52 175.55 2bxr n THR 205 N -5.54 -0.15 0.32 6.82 -1.04 -1.26 -2.58 114.28 110.85 2bxr n THR 205 Ca -0.11 1.13 -0.17 0.00 -2.04 0.00 0.00 64.05 62.86 2bxr n THR 205 Cb 0.44 -1.45 -0.09 0.00 -1.82 0.00 0.00 70.33 67.42 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 -0.75 -0.94 -2.82 2.47 -1.68 -3.24 114.38 107.42 2bxr h ARG 206 Ca 0.03 0.05 0.17 0.00 -1.26 0.00 0.00 59.98 58.98 2bxr h ARG 206 Cb 0.09 0.17 -0.10 0.00 -1.65 0.00 0.00 29.97 28.48 2bxr h ARG 206 CO -0.20 -0.48 0.54 0.97 0.56 0.00 0.00 179.97 181.35 2bxr h ILE 207 N -0.83 0.71 -3.00 2.04 2.10 -1.15 -3.31 117.51 114.07 2bxr h ILE 207 Ca -0.08 -0.24 -0.56 0.00 1.08 0.00 0.00 64.86 65.06 2bxr h ILE 207 Cb 0.62 -0.05 -0.40 0.00 -1.09 0.00 0.00 36.82 35.89 2bxr h ILE 207 CO 0.13 0.13 -0.77 0.12 -1.08 0.00 0.00 178.15 176.68 2bxr s PHE 208 N -5.91 1.09 -0.56 2.19 5.36 -1.16 -5.09 117.98 113.90 2bxr s PHE 208 Ca -0.12 -1.34 -0.26 0.00 -0.96 0.00 0.00 56.93 54.25 2bxr s PHE 208 Cb 0.24 -1.35 0.03 0.00 -0.34 0.00 0.00 43.02 41.61 2bxr s PHE 208 CO 0.79 -0.85 1.08 -1.54 -1.46 0.00 0.00 175.22 173.24 2bxr s SER 209 N 1.83 6.41 0.47 6.13 1.04 -1.25 -4.79 113.70 123.55 2bxr s SER 209 Ca 0.09 -0.07 0.16 0.00 0.48 0.00 0.00 55.95 56.61 2bxr s SER 209 Cb -0.17 -2.50 0.88 0.00 0.10 0.00 0.00 66.02 64.33 2bxr s SER 209 CO -0.30 -1.36 1.42 0.58 0.98 0.00 0.00 173.24 174.57 2bxr h VAL 210 N 6.10 0.00 0.00 5.02 2.07 -1.94 -3.47 116.25 124.04 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 1.06 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 2bxr h VAL 210 CO 1.14 0.00 0.00 0.61 0.02 0.00 0.00 177.57 179.34 2bxr n GLY 214 N -1.28 -0.94 0.63 2.17 0.00 -1.26 -5.13 105.19 99.39 2bxr n GLY 214 Ca -0.01 0.34 -0.03 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.84 1.61 7.27 -1.26 -4.92 117.38 116.25 2bxr n GLN 215 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.73 2bxr n GLN 215 Cb 0.00 -0.19 -0.05 0.00 2.41 0.00 0.00 30.24 32.41 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 1.22 3.50 0.06 3.69 0.41 -1.26 -4.38 118.70 121.94 2bxr s GLU 216 Ca 0.18 -0.19 0.04 0.00 -0.41 0.00 0.00 54.97 54.59 2bxr s GLU 216 Cb -0.12 -3.10 -0.03 0.00 -1.78 0.00 0.00 34.13 29.11 2bxr s GLU 216 CO 0.08 0.68 -0.11 1.03 -0.49 0.00 0.00 175.26 176.44 2bxr s ARG 217 N -1.74 0.70 0.29 1.61 0.52 -0.68 0.14 118.95 119.78 2bxr s ARG 217 Ca 0.26 -0.88 0.07 0.00 -0.52 0.00 0.00 55.73 54.66 2bxr s ARG 217 Cb -0.13 -0.59 -0.06 0.00 0.52 0.00 0.00 34.95 34.69 2bxr s ARG 217 CO 0.16 0.12 -0.06 0.15 0.02 0.00 0.00 175.30 175.69 2bxr s LYS 218 N -1.73 1.60 -0.09 3.54 1.02 -0.71 -0.58 119.74 122.78 2bxr s LYS 218 Ca -0.05 -1.81 -0.22 0.00 0.02 0.00 0.00 55.97 53.90 2bxr s LYS 218 Cb -0.10 -1.25 -0.03 0.00 -0.52 0.00 0.00 37.83 35.93 2bxr s LYS 218 CO 0.01 0.05 0.67 -0.06 -0.92 0.00 0.00 175.35 175.10 2bxr s PHE 219 N -2.95 3.54 -0.20 3.18 0.08 -1.26 -0.64 117.98 119.73 2bxr s PHE 219 Ca 0.30 1.16 -0.29 0.00 0.12 0.00 0.00 56.93 58.22 2bxr s PHE 219 Cb 0.03 -2.78 -0.06 0.00 -0.57 0.00 0.00 43.02 39.65 2bxr s PHE 219 CO 0.13 0.05 2.20 0.28 -0.10 0.00 0.00 175.22 177.78 2bxr n VAL 220 N 3.92 0.38 -0.00 -0.44 0.31 -0.50 -1.66 118.33 120.33 2bxr n VAL 220 Ca -0.02 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 2bxr n VAL 220 Cb 0.51 -2.51 0.00 0.00 -0.91 0.00 0.00 33.84 30.93 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 5.69 0.15 0.00 2.92 0.00 -1.26 -4.62 105.19 108.07 2bxr n GLY 221 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 3.36 0.13 -0.02 0.00 -0.66 -4.82 105.19 101.17 2bxr n GLY 222 Ca 0.00 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.39 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 0.20 1.61 4.64 -1.84 -3.13 113.55 115.02 2bxr h SER 223 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 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 0.02 0.00 1.23 -0.87 0.00 0.00 176.83 177.21 2bxr h GLY 224 N 4.34 0.00 2.00 -0.77 0.00 -1.89 -1.56 103.07 105.20 2bxr h GLY 224 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2bxr h GLY 224 CO 0.00 0.00 -0.14 1.46 0.00 0.00 0.00 176.54 177.86 2bxr h GLN 225 N 0.00 0.00 0.02 4.80 4.20 -1.86 -1.64 115.11 120.62 2bxr h GLN 225 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2bxr h GLN 225 Cb 0.10 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 2bxr h GLN 225 CO 0.00 0.14 -0.01 0.28 -0.67 0.00 0.00 178.83 178.57 2bxr h VAL 226 N 0.00 0.97 0.20 -0.54 2.07 -1.52 0.10 116.25 117.54 2bxr h VAL 226 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2bxr h VAL 226 Cb 0.30 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 2bxr h VAL 226 CO 0.02 0.00 -0.10 0.28 0.02 0.00 0.00 177.57 177.79 2bxr h SER 227 N -0.03 -0.23 -0.91 0.57 0.02 -1.67 -3.05 113.55 108.25 2bxr h SER 227 Ca 0.00 -0.30 0.20 0.00 -0.84 0.00 0.00 61.79 60.86 2bxr h SER 227 Cb 0.03 0.06 -0.17 0.00 0.14 0.00 0.00 62.40 62.46 2bxr h SER 227 CO -0.00 0.24 -0.12 -0.33 -1.14 0.00 0.00 176.83 175.47 2bxr h GLU 228 N -0.78 0.02 0.00 3.45 5.08 -1.11 -1.02 114.58 120.22 2bxr h GLU 228 Ca -0.03 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 2bxr h GLU 228 Cb 0.51 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2bxr h GLU 228 CO 0.05 0.01 -0.49 0.00 -1.00 0.00 0.00 179.01 177.58 2bxr h ARG 229 N 0.02 0.00 -0.17 2.33 2.47 -0.76 -0.49 114.38 117.77 2bxr h ARG 229 Ca 0.48 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 59.03 2bxr h ARG 229 Cb 0.83 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.14 2bxr h ARG 229 CO -0.90 0.49 -0.57 0.82 0.56 0.00 0.00 179.97 180.37 2bxr h ILE 230 N 0.00 1.33 -0.65 2.04 2.04 -1.13 -2.46 117.51 118.68 2bxr h ILE 230 Ca -0.00 -1.83 -0.02 0.00 1.00 0.00 0.00 64.86 64.00 2bxr h ILE 230 Cb 0.99 1.81 -0.03 0.00 -0.74 0.00 0.00 36.82 38.84 2bxr h ILE 230 CO 0.06 0.57 0.33 -0.03 0.00 0.00 0.00 178.15 179.08 2bxr h MET 231 N 0.41 0.90 -0.90 2.37 4.05 -0.24 -1.12 114.93 120.40 2bxr h MET 231 Ca 0.00 -0.11 0.05 0.00 -0.28 0.00 0.00 59.70 59.36 2bxr h MET 231 Cb 1.12 -0.18 -0.06 0.00 -0.80 0.00 0.00 31.60 31.68 2bxr h MET 231 CO 0.11 0.68 0.58 -0.44 0.23 0.00 0.00 176.91 178.07 2bxr h ASP 232 N 0.90 0.95 0.72 1.39 3.32 -0.81 0.19 116.42 123.08 2bxr h ASP 232 Ca 0.23 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.19 2bxr h ASP 232 Cb 0.06 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2bxr h ASP 232 CO -0.03 0.63 -0.41 -0.07 -1.72 0.00 0.00 179.24 177.64 2bxr h LEU 233 N 1.10 0.00 0.00 1.55 3.38 -0.84 -3.21 115.31 117.28 2bxr h LEU 233 Ca 0.37 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.31 2bxr h LEU 233 Cb 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2bxr h LEU 233 CO -0.14 0.41 -1.47 0.18 0.09 0.00 0.00 178.44 177.52 2bxr n LEU 234 N -3.66 0.51 0.00 1.67 4.77 -0.52 -5.04 117.00 114.73 2bxr n LEU 234 Ca -0.01 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2bxr n LEU 234 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2bxr n LEU 234 CO 0.38 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2bxr n GLY 235 N 1.26 2.52 0.92 -0.72 0.00 0.59 -2.47 105.19 107.28 2bxr n GLY 235 Ca -0.04 -0.38 0.02 0.00 0.00 0.00 0.00 46.02 45.62 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 3.74 2.45 -0.92 1.61 5.68 -1.26 -3.15 116.55 124.69 2bxr n ASP 236 Ca 0.00 -2.28 0.10 0.00 -0.50 0.00 0.00 54.79 52.11 2bxr n ASP 236 Cb 0.00 -0.54 0.26 0.00 -1.14 0.00 0.00 41.12 39.70 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 0.20 2.17 -4.16 0.11 6.02 -1.03 -4.67 117.38 116.02 2bxr n GLN 237 Ca 0.09 -1.80 -0.34 0.00 -0.01 0.00 0.00 57.00 54.94 2bxr n GLN 237 Cb 0.54 -1.43 -0.13 0.00 1.02 0.00 0.00 30.24 30.23 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 -1.47 3.68 -0.25 5.09 1.01 -1.19 -0.94 120.40 126.34 2bxr s VAL 238 Ca 0.35 -0.41 -0.04 0.00 0.00 0.00 0.00 61.98 61.89 2bxr s VAL 238 Cb 0.19 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.94 2bxr s VAL 238 CO 0.26 0.45 -0.02 -0.54 0.00 0.00 0.00 175.10 175.25 2bxr s LYS 239 N 0.95 3.04 0.73 2.72 -0.14 0.14 -4.97 119.74 122.21 2bxr s LYS 239 Ca 0.00 -0.86 -0.11 0.00 -1.36 0.00 0.00 55.97 53.64 2bxr s LYS 239 Cb -0.15 -3.10 0.03 0.00 -1.68 0.00 0.00 37.83 32.94 2bxr s LYS 239 CO 0.01 -0.36 1.10 -0.51 -0.76 0.00 0.00 175.35 174.83 2bxr s LEU 240 N 1.41 2.82 -1.34 3.17 1.43 -1.26 -1.14 118.68 123.77 2bxr s LEU 240 Ca 0.02 0.98 -0.05 0.00 -1.03 0.00 0.00 54.13 54.05 2bxr s LEU 240 Cb -0.16 -3.70 0.03 0.00 0.03 0.00 0.00 46.19 42.39 2bxr s LEU 240 CO -0.02 -1.48 0.38 0.59 0.23 0.00 0.00 176.35 176.05 2bxr n ASN 241 N -3.06 -4.56 -3.46 2.29 3.02 0.39 -4.85 115.26 105.03 2bxr n ASN 241 Ca 0.07 -0.20 -0.27 0.00 -0.03 0.00 0.00 54.58 54.15 2bxr n ASN 241 Cb 0.58 -3.76 -0.09 0.00 -0.61 0.00 0.00 39.78 35.90 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 -3.98 2.77 -2.14 3.10 8.25 -0.07 -4.92 115.22 118.23 2bxr n HIS 242 Ca -0.09 -4.06 -0.42 0.00 -0.26 0.00 0.00 57.72 52.90 2bxr n HIS 242 Cb 0.59 -0.50 -0.03 0.00 1.12 0.00 0.00 29.99 31.17 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 -2.01 4.24 0.06 -0.41 0.02 -1.26 -3.50 135.00 132.14 2bxr s PRO 243 Ca 0.36 2.06 -0.30 0.00 0.02 0.00 0.00 61.00 63.14 2bxr s PRO 243 Cb 0.12 -3.68 -0.05 0.00 0.02 0.00 0.00 34.50 30.90 2bxr s PRO 243 CO -0.06 -0.68 1.11 0.08 -0.33 0.00 0.00 177.00 177.13 2bxr s VAL 244 N 2.89 4.26 -0.00 3.83 1.01 -1.26 -1.17 120.40 129.96 2bxr s VAL 244 Ca 0.67 1.68 0.00 0.00 0.00 0.00 0.00 61.98 64.33 2bxr s VAL 244 Cb -0.33 -4.07 -0.00 0.00 0.00 0.00 0.00 36.38 31.98 2bxr s VAL 244 CO 0.27 0.16 0.00 0.35 0.00 0.00 0.00 175.10 175.88 2bxr n THR 245 N 3.64 0.01 -4.31 3.92 -2.24 -0.05 -4.81 114.28 110.43 2bxr n THR 245 Ca 0.07 -0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.65 2bxr n THR 245 Cb 0.48 -0.61 -0.15 0.00 -2.10 0.00 0.00 70.33 67.95 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 -2.01 0.81 -0.23 4.78 3.76 -1.01 -1.09 115.29 120.30 2bxr s HIS 246 Ca -0.00 -0.19 0.01 0.00 -0.15 0.00 0.00 55.06 54.73 2bxr s HIS 246 Cb 0.00 -0.58 0.06 0.00 1.11 0.00 0.00 32.58 33.17 2bxr s HIS 246 CO 0.01 -0.08 -0.06 0.08 -0.85 0.00 0.00 174.74 173.84 2bxr s VAL 247 N 0.17 1.55 -0.18 -0.90 1.01 -0.18 -0.73 120.40 121.14 2bxr s VAL 247 Ca -0.02 -1.22 -0.04 0.00 0.00 0.00 0.00 61.98 60.69 2bxr s VAL 247 Cb -0.07 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2bxr s VAL 247 CO 0.00 -0.09 -0.02 -0.62 0.00 0.00 0.00 175.10 174.37 2bxr s ASP 248 N 1.39 4.77 0.00 3.32 -1.08 -0.12 -1.06 116.67 123.88 2bxr s ASP 248 Ca -0.06 -0.19 0.03 0.00 -0.52 0.00 0.00 52.55 51.81 2bxr s ASP 248 Cb -0.19 -1.80 -0.01 0.00 -1.46 0.00 0.00 42.92 39.46 2bxr s ASP 248 CO -0.06 0.10 0.28 1.67 0.52 0.00 0.00 175.17 177.69 2bxr n GLN 249 N 3.97 3.76 0.16 4.34 7.27 0.40 -1.42 117.38 135.86 2bxr n GLN 249 Ca -0.17 -0.24 0.11 0.00 0.07 0.00 0.00 57.00 56.77 2bxr n GLN 249 Cb 0.52 -0.78 0.59 0.00 2.41 0.00 0.00 30.24 32.98 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 -0.63 0.57 -3.55 1.69 3.41 -1.23 -4.02 113.62 109.86 2bxr n SER 250 Ca 0.01 0.76 -0.28 0.00 -0.26 0.00 0.00 58.87 59.10 2bxr n SER 250 Cb 0.05 -0.84 -0.12 0.00 -0.26 0.00 0.00 64.21 63.05 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 -4.04 2.87 0.00 4.04 1.04 -1.26 -5.02 113.70 111.32 2bxr s SER 251 Ca -0.02 -2.72 0.00 0.00 0.48 0.00 0.00 55.95 53.69 2bxr s SER 251 Cb 0.06 -0.70 0.00 0.00 0.10 0.00 0.00 66.02 65.49 2bxr s SER 251 CO 0.20 -0.24 0.00 -0.90 0.98 0.00 0.00 173.24 173.29 2bxr n ASP 252 N 3.37 0.00 -4.67 7.02 5.75 -1.26 -4.42 116.55 122.35 2bxr n ASP 252 Ca 0.17 0.00 -0.38 0.00 -0.01 0.00 0.00 54.79 54.57 2bxr n ASP 252 Cb 0.39 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.41 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 6.41 -0.25 -1.12 2.47 -1.26 -4.86 114.94 116.33 2bxr s ASN 253 Ca 0.00 0.48 -0.25 0.00 0.42 0.00 0.00 52.86 53.51 2bxr s ASN 253 Cb 0.00 -2.23 -0.00 0.00 -1.45 0.00 0.00 41.25 37.57 2bxr s ASN 253 CO 0.00 -0.08 0.86 -0.63 -3.72 0.00 0.00 177.10 173.53 2bxr s ILE 254 N 1.35 4.80 -0.23 -5.21 1.01 -0.80 -4.86 121.20 117.26 2bxr s ILE 254 Ca 0.18 1.57 -0.18 0.00 0.00 0.00 0.00 60.65 62.23 2bxr s ILE 254 Cb -0.15 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 2bxr s ILE 254 CO 0.08 -0.12 0.50 -0.63 0.00 0.00 0.00 174.94 174.76 2bxr s ILE 255 N 2.93 5.10 -0.11 2.92 1.01 -0.50 -2.39 121.20 130.16 2bxr s ILE 255 Ca 0.36 0.88 0.01 0.00 0.00 0.00 0.00 60.65 61.91 2bxr s ILE 255 Cb -0.15 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.49 2bxr s ILE 255 CO 0.08 0.15 -0.15 -0.63 0.00 0.00 0.00 174.94 174.39 2bxr s ILE 256 N 1.88 2.87 -0.07 2.92 1.01 0.86 -0.95 121.20 129.72 2bxr s ILE 256 Ca 0.22 -0.74 0.02 0.00 0.00 0.00 0.00 60.65 60.15 2bxr s ILE 256 Cb -0.15 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.12 2bxr s ILE 256 CO 0.09 0.54 -0.10 -0.70 0.00 0.00 0.00 174.94 174.77 2bxr s GLU 257 N 0.10 2.74 0.31 2.79 2.12 0.09 -1.34 118.70 125.51 2bxr s GLU 257 Ca -0.07 -0.62 0.07 0.00 0.36 0.00 0.00 54.97 54.71 2bxr s GLU 257 Cb -0.15 -2.52 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 2bxr s GLU 257 CO 0.05 0.59 0.34 0.95 -0.54 0.00 0.00 175.26 176.65 2bxr s THR 258 N -0.62 4.10 0.38 -1.70 -4.23 -0.99 -0.87 115.64 111.71 2bxr s THR 258 Ca 0.09 -1.20 0.19 0.00 -1.18 0.00 0.00 61.69 59.59 2bxr s THR 258 Cb -0.11 -3.39 0.39 0.00 1.34 0.00 0.00 72.50 70.72 2bxr s THR 258 CO 0.01 -0.22 1.69 0.25 -0.54 0.00 0.00 174.62 175.81 2bxr h LEU 259 N 1.16 0.44 -1.32 4.79 5.85 -1.49 0.32 115.31 125.06 2bxr h LEU 259 Ca -0.47 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.40 2bxr h LEU 259 Cb 1.25 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.37 2bxr h LEU 259 CO 0.57 -0.07 0.00 -0.46 -0.34 0.00 0.00 178.44 178.15 2bxr n ASN 260 N -4.83 1.91 -1.09 1.25 6.94 -1.26 -4.90 115.26 113.28 2bxr n ASN 260 Ca 0.31 -2.11 -0.10 0.00 -0.02 0.00 0.00 54.58 52.66 2bxr n ASN 260 Cb 1.05 -0.31 -0.01 0.00 -2.36 0.00 0.00 39.78 38.16 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 0.30 -0.40 -2.47 -2.53 8.25 0.11 -5.02 115.22 113.46 2bxr n HIS 261 Ca 0.10 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.25 2bxr n HIS 261 Cb 0.35 -2.35 -0.02 0.00 1.12 0.00 0.00 29.99 29.09 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 -4.22 3.80 0.03 -0.41 2.02 -1.25 -4.91 118.70 113.75 2bxr s GLU 262 Ca 0.00 0.70 0.05 0.00 0.02 0.00 0.00 54.97 55.74 2bxr s GLU 262 Cb 0.00 -2.23 -0.02 0.00 0.10 0.00 0.00 34.13 31.98 2bxr s GLU 262 CO 0.00 -0.24 -0.14 -1.01 0.02 0.00 0.00 175.26 173.88 2bxr s HIS 263 N -2.65 1.24 -0.05 1.61 3.76 -1.26 -2.35 115.29 115.59 2bxr s HIS 263 Ca 0.55 -0.34 -0.04 0.00 -0.15 0.00 0.00 55.06 55.08 2bxr s HIS 263 Cb -0.10 -0.74 0.02 0.00 1.11 0.00 0.00 32.58 32.87 2bxr s HIS 263 CO 0.36 0.03 0.13 0.71 -0.85 0.00 0.00 174.74 175.13 2bxr s TYR 264 N -0.80 -0.15 0.04 1.40 2.02 -0.45 -4.85 117.35 114.57 2bxr s TYR 264 Ca 0.02 0.39 0.08 0.00 -0.37 0.00 0.00 57.07 57.18 2bxr s TYR 264 Cb -0.08 0.01 -0.03 0.00 -0.40 0.00 0.00 41.96 41.47 2bxr s TYR 264 CO 0.01 -0.10 -0.22 -1.83 -1.57 0.00 0.00 175.55 171.85 2bxr s GLU 265 N 0.38 1.47 0.28 -0.62 -1.05 -0.84 -0.10 118.70 118.21 2bxr s GLU 265 Ca -0.03 -0.97 -0.16 0.00 -0.15 0.00 0.00 54.97 53.66 2bxr s GLU 265 Cb -0.04 -1.59 0.01 0.00 -0.44 0.00 0.00 34.13 32.07 2bxr s GLU 265 CO -0.02 0.41 0.61 0.00 0.95 0.00 0.00 175.26 177.22 2bxr n LYS 267 N -0.44 0.62 -3.94 0.00 5.02 -0.24 -1.91 118.16 117.28 2bxr n LYS 267 Ca -0.03 0.11 -0.10 0.00 -2.02 0.00 0.00 58.31 56.27 2bxr n LYS 267 Cb 0.60 -1.75 -0.10 0.00 -0.02 0.00 0.00 35.03 33.76 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 -3.16 0.19 0.02 2.13 2.02 -0.90 -4.88 117.35 112.78 2bxr s TYR 268 Ca -0.03 -0.44 0.09 0.00 -0.37 0.00 0.00 57.07 56.31 2bxr s TYR 268 Cb 0.10 -0.15 -0.03 0.00 -0.40 0.00 0.00 41.96 41.49 2bxr s TYR 268 CO 0.82 -0.29 -0.25 0.08 -1.57 0.00 0.00 175.55 174.33 2bxr s VAL 269 N -2.00 2.18 -0.25 0.71 1.01 -0.83 -1.75 120.40 119.47 2bxr s VAL 269 Ca -0.10 -1.26 0.02 0.00 0.00 0.00 0.00 61.98 60.63 2bxr s VAL 269 Cb -0.05 -1.82 0.05 0.00 0.00 0.00 0.00 36.38 34.56 2bxr s VAL 269 CO -0.02 0.45 -0.11 -0.63 0.00 0.00 0.00 175.10 174.79 2bxr s ILE 270 N -0.74 2.31 -0.09 2.22 1.01 -0.42 -0.45 121.20 125.03 2bxr s ILE 270 Ca 0.11 -1.46 -0.30 0.00 0.00 0.00 0.00 60.65 59.01 2bxr s ILE 270 Cb -0.10 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 2bxr s ILE 270 CO 0.01 0.06 1.42 0.21 0.00 0.00 0.00 174.94 176.65 2bxr s ASN 271 N 1.16 6.83 -0.29 3.58 2.47 0.61 -0.61 114.94 128.70 2bxr s ASN 271 Ca -0.06 1.96 0.14 0.00 0.42 0.00 0.00 52.86 55.32 2bxr s ASN 271 Cb -0.19 -2.54 0.48 0.00 -1.45 0.00 0.00 41.25 37.55 2bxr s ASN 271 CO -0.06 -0.81 1.15 0.00 -3.72 0.00 0.00 177.10 173.66 2bxr n ALA 272 N 6.55 3.98 -2.64 1.71 0.00 0.10 -0.38 120.51 129.83 2bxr n ALA 272 Ca 0.15 -3.37 -0.12 0.00 0.00 0.00 0.00 53.44 50.09 2bxr n ALA 272 Cb 0.44 -0.58 -0.11 0.00 0.00 0.00 0.00 19.45 19.20 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 -4.27 0.61 0.90 0.00 -4.36 -1.25 -4.51 121.20 108.31 2bxr s ILE 273 Ca 0.40 -1.35 -0.11 0.00 -0.26 0.00 0.00 60.65 59.33 2bxr s ILE 273 Cb 0.37 -0.96 0.13 0.00 1.25 0.00 0.00 42.46 43.26 2bxr s ILE 273 CO -0.00 -0.53 1.13 -0.81 0.24 0.00 0.00 174.94 174.97 2bxr n PRO 274 N 0.99 -0.33 -0.14 0.37 -0.04 -1.26 -4.53 135.00 130.06 2bxr n PRO 274 Ca -0.19 -0.03 -0.11 0.00 -0.04 0.00 0.00 63.50 63.13 2bxr n PRO 274 Cb 0.57 -2.37 -0.06 0.00 -0.04 0.00 0.00 33.50 31.60 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 -1.69 -0.32 -0.76 0.54 0.11 -1.90 -1.23 132.00 126.75 2bxr h PRO 275 Ca -0.44 0.02 0.12 0.00 0.11 0.00 0.00 66.00 65.82 2bxr h PRO 275 Cb 1.28 0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.41 2bxr h PRO 275 CO 0.42 -0.22 0.50 0.00 -0.21 0.00 0.00 178.00 178.49 2bxr h THR 276 N -0.34 0.87 0.01 -1.15 1.03 -1.75 -2.07 112.91 109.50 2bxr h THR 276 Ca 0.13 -0.19 -0.24 0.00 -0.01 0.00 0.00 66.41 66.10 2bxr h THR 276 Cb 0.59 0.27 0.01 0.00 -1.07 0.00 0.00 68.15 67.94 2bxr h THR 276 CO -0.59 0.10 -0.97 -0.07 -0.01 0.00 0.00 175.52 173.98 2bxr h LEU 277 N 0.55 0.60 -1.01 0.00 3.38 -1.61 -3.14 115.31 114.09 2bxr h LEU 277 Ca 0.36 -0.48 0.12 0.00 0.09 0.00 0.00 57.88 57.97 2bxr h LEU 277 Cb 0.65 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 41.13 2bxr h LEU 277 CO -0.13 1.29 0.64 0.74 0.09 0.00 0.00 178.44 181.06 2bxr h THR 278 N 0.26 0.93 0.00 0.22 2.02 -0.62 -1.47 112.91 114.25 2bxr h THR 278 Ca -0.09 -0.35 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 2bxr h THR 278 Cb 1.61 -0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2bxr h THR 278 CO 0.17 0.18 -0.04 0.00 0.37 0.00 0.00 175.52 176.21 2bxr h ALA 279 N 1.53 1.35 0.00 6.16 0.00 -1.35 -1.36 119.26 125.59 2bxr h ALA 279 Ca 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2bxr h ALA 279 Cb 0.47 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2bxr h ALA 279 CO -0.26 0.05 0.00 0.87 0.00 0.00 0.00 179.25 179.91 2bxr h LYS 280 N 0.00 0.00 -6.94 0.00 1.57 -1.33 -3.46 116.57 106.41 2bxr h LYS 280 Ca -0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 2bxr h LYS 280 Cb 0.13 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 2bxr h LYS 280 CO 0.01 0.00 0.38 0.42 -0.57 0.00 0.00 179.45 179.68 2bxr s ILE 281 N -3.18 4.00 -0.24 1.86 1.01 -0.52 -5.01 121.20 119.13 2bxr s ILE 281 Ca 0.08 1.55 -0.17 0.00 0.00 0.00 0.00 60.65 62.11 2bxr s ILE 281 Cb 0.07 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.71 2bxr s ILE 281 CO 0.65 0.02 0.48 -1.00 0.00 0.00 0.00 174.94 175.09 2bxr s HIS 282 N -1.71 3.30 -0.20 3.97 3.76 -0.25 -4.99 115.29 119.18 2bxr s HIS 282 Ca 0.55 0.63 -0.03 0.00 -0.15 0.00 0.00 55.06 56.06 2bxr s HIS 282 Cb -0.19 -2.66 -0.01 0.00 1.11 0.00 0.00 32.58 30.83 2bxr s HIS 282 CO 0.24 -0.20 -0.06 -0.06 -0.85 0.00 0.00 174.74 173.81 2bxr s PHE 283 N 2.00 2.93 -0.19 1.40 0.40 -1.26 -1.01 117.98 122.25 2bxr s PHE 283 Ca 0.21 -0.88 0.00 0.00 -0.60 0.00 0.00 56.93 55.66 2bxr s PHE 283 Cb -0.15 -2.04 0.02 0.00 0.51 0.00 0.00 43.02 41.35 2bxr s PHE 283 CO 0.09 -0.47 -0.17 1.03 0.70 0.00 0.00 175.22 176.40 2bxr s ARG 284 N 1.21 2.99 0.81 0.44 0.52 -0.23 -1.48 118.95 123.20 2bxr s ARG 284 Ca 0.02 -0.84 -0.10 0.00 -0.52 0.00 0.00 55.73 54.29 2bxr s ARG 284 Cb -0.14 -2.66 0.08 0.00 0.52 0.00 0.00 34.95 32.74 2bxr s ARG 284 CO -0.02 -0.24 1.10 -2.14 0.02 0.00 0.00 175.30 174.02 2bxr s PRO 285 N 1.30 1.96 0.58 3.54 0.02 -1.26 0.15 135.00 141.30 2bxr s PRO 285 Ca 0.04 1.21 -0.18 0.00 0.02 0.00 0.00 61.00 62.09 2bxr s PRO 285 Cb -0.14 -1.86 -0.11 0.00 0.02 0.00 0.00 34.50 32.41 2bxr s PRO 285 CO -0.11 -1.86 0.14 0.39 -0.33 0.00 0.00 177.00 175.23 2bxr n GLU 286 N -3.68 0.21 -2.35 5.54 -0.58 -0.55 -4.94 120.64 114.30 2bxr n GLU 286 Ca 0.09 0.09 -0.36 0.00 -0.42 0.00 0.00 57.16 56.56 2bxr n GLU 286 Cb 0.53 -1.34 -0.02 0.00 -0.57 0.00 0.00 31.44 30.04 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 3.07 3.98 0.43 -4.62 1.43 -1.26 -4.97 118.68 116.74 2bxr s LEU 287 Ca 0.61 2.19 -0.24 0.00 -1.03 0.00 0.00 54.13 55.66 2bxr s LEU 287 Cb -0.44 -4.32 -0.11 0.00 0.03 0.00 0.00 46.19 41.35 2bxr s LEU 287 CO 0.62 -0.86 0.94 -2.65 0.23 0.00 0.00 176.35 174.62 2bxr n PRO 288 N -0.59 1.21 -0.12 1.29 -0.02 -1.26 -4.56 135.00 130.95 2bxr n PRO 288 Ca 0.08 0.44 -0.05 0.00 -2.02 0.00 0.00 63.50 61.94 2bxr n PRO 288 Cb 0.49 -1.96 0.01 0.00 -0.02 0.00 0.00 33.50 32.02 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 1.38 0.27 -0.87 3.55 0.00 -1.99 -0.13 119.26 121.47 2bxr h ALA 289 Ca -0.44 0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.71 2bxr h ALA 289 Cb 1.35 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 19.31 2bxr h ALA 289 CO 0.56 -0.45 -0.56 1.49 0.00 0.00 0.00 179.25 180.29 2bxr h GLU 290 N 0.01 -0.08 -0.28 0.00 4.81 -1.98 -2.33 114.58 114.72 2bxr h GLU 290 Ca 0.19 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 2bxr h GLU 290 Cb 0.28 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2bxr h GLU 290 CO -0.39 -0.06 -0.03 -0.09 -0.73 0.00 0.00 179.01 177.71 2bxr h ARG 291 N -0.09 0.52 -1.17 1.92 2.43 -1.53 -2.09 114.38 114.37 2bxr h ARG 291 Ca 0.16 -0.18 0.34 0.00 -0.81 0.00 0.00 59.98 59.49 2bxr h ARG 291 Cb 0.47 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.93 2bxr h ARG 291 CO -0.87 0.69 0.92 -0.97 -1.51 0.00 0.00 179.97 178.23 2bxr h ASN 292 N 0.29 0.00 0.08 -3.80 -0.73 -0.65 0.05 115.58 110.83 2bxr h ASN 292 Ca 0.08 0.00 -0.22 0.00 1.87 0.00 0.00 56.30 58.02 2bxr h ASN 292 Cb 0.48 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.06 2bxr h ASN 292 CO 0.02 0.00 -1.14 1.56 -0.37 0.00 0.00 177.43 177.50 2bxr h GLN 293 N 0.00 0.18 0.31 6.67 1.08 -0.96 -3.24 115.11 119.15 2bxr h GLN 293 Ca 0.56 -0.30 -0.00 0.00 -1.45 0.00 0.00 58.65 57.45 2bxr h GLN 293 Cb 2.39 0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 29.91 2bxr h GLN 293 CO -0.01 1.14 -0.44 1.25 -0.95 0.00 0.00 178.83 179.82 2bxr h LEU 294 N -0.52 -1.27 -2.19 1.46 5.85 -0.34 -2.16 115.31 116.15 2bxr h LEU 294 Ca -0.25 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 2bxr h LEU 294 Cb 1.57 0.44 -0.00 0.00 0.37 0.00 0.00 40.66 43.04 2bxr h LEU 294 CO 0.02 -0.54 -0.00 0.16 -0.34 0.00 0.00 178.44 177.73 2bxr h ILE 295 N -0.79 0.80 0.00 4.05 3.07 -1.60 0.14 117.51 123.18 2bxr h ILE 295 Ca -0.04 -0.01 -0.04 0.00 1.55 0.00 0.00 64.86 66.32 2bxr h ILE 295 Cb 0.72 1.01 -0.01 0.00 -0.27 0.00 0.00 36.82 38.27 2bxr h ILE 295 CO -0.13 0.00 -0.18 -0.61 -1.05 0.00 0.00 178.15 176.19 2bxr h GLN 296 N 0.00 0.00 -0.10 0.16 5.75 -1.45 -3.22 115.11 116.25 2bxr h GLN 296 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2bxr h GLN 296 Cb 0.01 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.56 2bxr h GLN 296 CO 0.00 0.18 0.00 0.54 -2.65 0.00 0.00 178.83 176.90 2bxr n ARG 297 N -3.89 2.20 -3.51 1.69 1.74 0.47 -4.87 116.66 110.50 2bxr n ARG 297 Ca -0.02 -2.35 -0.42 0.00 -0.77 0.00 0.00 57.85 54.29 2bxr n ARG 297 Cb 0.27 -1.45 -0.08 0.00 -1.02 0.00 0.00 32.46 30.18 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 -2.26 5.73 0.58 0.55 1.43 -1.19 -4.58 118.68 118.93 2bxr s LEU 298 Ca 0.26 -1.84 -0.17 0.00 -1.03 0.00 0.00 54.13 51.36 2bxr s LEU 298 Cb 0.22 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 2bxr s LEU 298 CO 0.05 -0.71 1.08 -2.84 0.23 0.00 0.00 176.35 174.16 2bxr s PRO 299 N 1.42 3.28 0.65 1.29 0.02 -1.25 -4.36 135.00 136.05 2bxr s PRO 299 Ca 0.05 1.35 -0.10 0.00 0.02 0.00 0.00 61.00 62.32 2bxr s PRO 299 Cb -0.27 -2.02 0.00 0.00 0.02 0.00 0.00 34.50 32.24 2bxr s PRO 299 CO 0.00 -0.86 1.02 -1.64 -0.33 0.00 0.00 177.00 175.19 2bxr s MET 300 N -3.79 2.98 0.48 5.54 -1.94 -1.26 -1.03 119.30 120.28 2bxr s MET 300 Ca 0.67 0.35 -0.05 0.00 -1.71 0.00 0.00 55.69 54.94 2bxr s MET 300 Cb -0.19 -2.11 0.11 0.00 2.01 0.00 0.00 34.83 34.65 2bxr s MET 300 CO 0.33 -0.86 0.66 0.41 -0.01 0.00 0.00 175.02 175.55 2bxr n GLY 301 N -2.83 -0.43 2.94 -0.03 0.00 -0.58 -4.83 105.19 99.43 2bxr n GLY 301 Ca 0.06 -1.83 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 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 -3.54 1.24 0.01 4.61 0.00 -0.81 -3.66 121.76 119.61 2bxr s ALA 302 Ca 0.40 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.88 2bxr s ALA 302 Cb -0.02 -0.76 -0.01 0.00 0.00 0.00 0.00 23.12 22.34 2bxr s ALA 302 CO 0.27 -0.21 0.03 0.14 0.00 0.00 0.00 175.76 175.99 2bxr s VAL 303 N 1.31 0.10 -0.13 0.00 -7.23 -1.26 -0.52 120.40 112.66 2bxr s VAL 303 Ca -0.03 -0.79 0.03 0.00 -1.81 0.00 0.00 61.98 59.38 2bxr s VAL 303 Cb -0.14 -0.31 0.01 0.00 0.56 0.00 0.00 36.38 36.50 2bxr s VAL 303 CO -0.04 -0.43 -0.21 -0.63 -0.31 0.00 0.00 175.10 173.47 2bxr s ILE 304 N -1.36 1.99 -0.17 -0.62 1.01 0.66 -1.70 121.20 121.01 2bxr s ILE 304 Ca -0.15 -0.95 -0.10 0.00 0.00 0.00 0.00 60.65 59.46 2bxr s ILE 304 Cb -0.09 -1.76 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 2bxr s ILE 304 CO -0.00 0.54 0.16 -0.75 0.00 0.00 0.00 174.94 174.89 2bxr s LYS 305 N 0.77 3.98 -0.10 2.79 2.20 -0.78 -1.39 119.74 127.20 2bxr s LYS 305 Ca -0.09 -0.13 -0.02 0.00 -0.36 0.00 0.00 55.97 55.37 2bxr s LYS 305 Cb -0.16 -3.35 0.03 0.00 -1.51 0.00 0.00 37.83 32.85 2bxr s LYS 305 CO -0.00 0.44 0.00 0.00 -0.36 0.00 0.00 175.35 175.43 2bxr s MET 307 N 1.92 2.93 -0.19 0.00 -1.94 0.82 -1.48 119.30 121.35 2bxr s MET 307 Ca 0.04 -0.97 -0.12 0.00 -1.71 0.00 0.00 55.69 52.92 2bxr s MET 307 Cb -0.13 -3.48 -0.05 0.00 2.01 0.00 0.00 34.83 33.18 2bxr s MET 307 CO -0.06 -0.55 0.22 1.41 -0.01 0.00 0.00 175.02 176.03 2bxr s MET 308 N 1.49 4.20 -0.07 2.03 1.75 -0.39 -1.79 119.30 126.52 2bxr s MET 308 Ca 0.01 -0.07 0.01 0.00 -1.25 0.00 0.00 55.69 54.39 2bxr s MET 308 Cb -0.18 -3.45 -0.03 0.00 2.84 0.00 0.00 34.83 34.01 2bxr s MET 308 CO 0.04 0.21 -0.08 0.71 -0.65 0.00 0.00 175.02 175.24 2bxr s TYR 309 N 0.60 2.90 0.06 4.11 2.02 -0.51 -0.90 117.35 125.63 2bxr s TYR 309 Ca 0.12 -0.04 0.02 0.00 -0.37 0.00 0.00 57.07 56.80 2bxr s TYR 309 Cb -0.12 -1.71 -0.03 0.00 -0.40 0.00 0.00 41.96 39.69 2bxr s TYR 309 CO 0.02 0.28 -0.07 0.71 -1.57 0.00 0.00 175.55 174.92 2bxr s TYR 310 N -0.71 0.73 0.16 2.71 2.02 -0.80 0.11 117.35 121.56 2bxr s TYR 310 Ca 0.11 -0.63 -0.16 0.00 -0.37 0.00 0.00 57.07 56.01 2bxr s TYR 310 Cb -0.11 -0.43 0.05 0.00 -0.40 0.00 0.00 41.96 41.06 2bxr s TYR 310 CO 0.01 -0.11 1.79 -0.22 -1.57 0.00 0.00 175.55 175.45 2bxr h LYS 311 N 4.02 0.41 -5.47 -0.62 3.64 -1.86 -3.32 116.57 113.37 2bxr h LYS 311 Ca -0.36 -0.02 -0.42 0.00 -1.27 0.00 0.00 60.65 58.58 2bxr h LYS 311 Cb 1.19 -0.09 -0.16 0.00 -0.41 0.00 0.00 32.23 32.75 2bxr h LYS 311 CO 0.48 0.27 -0.75 -1.21 -2.27 0.00 0.00 179.45 175.98 2bxr s GLU 312 N -6.15 1.15 -0.05 1.90 2.02 -1.26 -4.64 118.70 111.67 2bxr s GLU 312 Ca -0.13 -1.40 -0.03 0.00 0.02 0.00 0.00 54.97 53.43 2bxr s GLU 312 Cb 0.11 -0.97 -0.09 0.00 0.10 0.00 0.00 34.13 33.28 2bxr s GLU 312 CO 0.72 0.17 2.71 0.00 0.02 0.00 0.00 175.26 178.89 2bxr n ALA 313 N 0.11 5.20 -0.47 5.21 0.00 -1.26 -4.74 120.51 124.57 2bxr n ALA 313 Ca -0.12 -1.05 0.38 0.00 0.00 0.00 0.00 53.44 52.64 2bxr n ALA 313 Cb 0.59 -1.64 0.61 0.00 0.00 0.00 0.00 19.45 19.01 2bxr n ALA 313 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2bxr n PHE 314 N 1.79 0.40 -0.22 0.00 1.16 -1.26 -0.34 117.46 118.98 2bxr n PHE 314 Ca 0.23 0.40 -0.08 0.00 -1.87 0.00 0.00 57.45 56.13 2bxr n PHE 314 Cb 0.68 -0.82 0.03 0.00 -1.61 0.00 0.00 39.48 37.76 2bxr n PHE 314 CO 0.00 0.00 0.00 0.11 -1.87 0.00 0.00 176.76 175.00 2bxr h TRP 315 N 0.00 0.96 -0.82 2.97 0.09 -1.85 -1.83 115.95 115.47 2bxr h TRP 315 Ca 0.76 -0.09 0.17 0.00 0.09 0.00 0.00 58.89 59.82 2bxr h TRP 315 Cb 2.66 -0.28 -0.11 0.00 0.08 0.00 0.00 29.16 31.51 2bxr h TRP 315 CO -0.00 0.78 0.35 0.87 0.09 0.00 0.00 178.44 180.53 2bxr h LYS 316 N 0.86 0.43 0.00 0.12 1.79 -0.48 0.12 116.57 119.42 2bxr h LYS 316 Ca 0.20 -0.03 -0.02 0.00 -2.18 0.00 0.00 60.65 58.63 2bxr h LYS 316 Cb 0.26 -0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 30.81 2bxr h LYS 316 CO -0.01 0.29 -0.09 0.87 -1.08 0.00 0.00 179.45 179.43 2bxr h LYS 317 N 0.45 0.00 -0.88 3.15 1.57 -1.43 -0.86 116.57 118.57 2bxr h LYS 317 Ca 0.48 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.80 2bxr h LYS 317 Cb 0.79 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.83 2bxr h LYS 317 CO -0.45 0.09 0.52 1.63 -0.57 0.00 0.00 179.45 180.67 2bxr n LYS 318 N -3.59 2.18 -3.17 3.15 5.02 -0.53 -4.90 118.16 116.31 2bxr n LYS 318 Ca -0.02 -3.05 -0.18 0.00 -2.02 0.00 0.00 58.31 53.05 2bxr n LYS 318 Cb 0.21 -2.11 -0.02 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 -1.15 -2.57 -4.58 4.39 -0.08 -0.33 -4.91 116.55 107.32 2bxr n ASP 319 Ca 0.55 -0.18 -0.37 0.00 -1.51 0.00 0.00 54.79 53.28 2bxr n ASP 319 Cb 1.56 -2.21 -0.11 0.00 2.34 0.00 0.00 41.12 42.70 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 -2.65 3.22 0.22 -0.67 2.02 0.31 -3.13 117.35 116.66 2bxr s TYR 320 Ca 0.29 0.04 -0.14 0.00 -0.37 0.00 0.00 57.07 56.89 2bxr s TYR 320 Cb -0.16 -2.31 0.26 0.00 -0.40 0.00 0.00 41.96 39.35 2bxr s TYR 320 CO 0.36 -0.13 1.60 0.00 -1.57 0.00 0.00 175.55 175.82 2bxr n GLY 322 N -1.48 0.94 3.45 0.00 0.00 -1.26 -4.66 105.19 102.18 2bxr n GLY 322 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 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 0.57 0.61 -0.32 0.00 0.23 -1.21 -2.14 119.30 117.03 2bxr s MET 324 Ca -0.03 -0.18 -0.11 0.00 -1.03 0.00 0.00 55.69 54.34 2bxr s MET 324 Cb -0.15 -0.61 -0.01 0.00 -1.53 0.00 0.00 34.83 32.54 2bxr s MET 324 CO 0.03 0.06 0.19 0.42 -2.03 0.00 0.00 175.02 173.68 2bxr s ILE 325 N 0.22 4.86 -0.27 3.16 1.09 -0.40 -1.04 121.20 128.83 2bxr s ILE 325 Ca -0.03 -0.34 -0.04 0.00 -1.10 0.00 0.00 60.65 59.15 2bxr s ILE 325 Cb -0.07 -3.49 0.02 0.00 -1.06 0.00 0.00 42.46 37.87 2bxr s ILE 325 CO -0.00 0.04 -0.01 -0.63 -0.10 0.00 0.00 174.94 174.24 2bxr s ILE 326 N 1.65 3.29 -0.60 2.92 1.01 -0.67 -0.98 121.20 127.81 2bxr s ILE 326 Ca 0.05 -0.91 0.05 0.00 0.00 0.00 0.00 60.65 59.85 2bxr s ILE 326 Cb -0.17 -2.68 0.33 0.00 0.01 0.00 0.00 42.46 39.94 2bxr s ILE 326 CO 0.08 0.15 0.94 1.21 0.00 0.00 0.00 174.94 177.32 2bxr n GLU 327 N 4.74 3.19 -4.67 2.79 2.13 -0.31 -4.63 120.64 123.89 2bxr n GLU 327 Ca -0.16 -4.83 -0.33 0.00 0.66 0.00 0.00 57.16 52.50 2bxr n GLU 327 Cb 0.47 -2.25 -0.12 0.00 0.27 0.00 0.00 31.44 29.82 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 -3.27 4.42 0.03 4.31 2.15 -1.26 -4.45 116.67 118.60 2bxr s ASP 328 Ca 0.47 -0.12 -0.10 0.00 0.43 0.00 0.00 52.55 53.24 2bxr s ASP 328 Cb 0.26 -1.03 -0.04 0.00 -0.30 0.00 0.00 42.92 41.81 2bxr s ASP 328 CO -0.12 0.34 1.15 -0.08 -0.17 0.00 0.00 175.17 176.29 2bxr h GLU 329 N 5.09 -0.20 -2.23 4.34 4.57 -1.96 -3.26 114.58 120.93 2bxr h GLU 329 Ca -0.48 0.01 -0.77 0.00 -1.18 0.00 0.00 59.36 56.94 2bxr h GLU 329 Cb 1.16 0.05 -0.24 0.00 -0.16 0.00 0.00 28.75 29.56 2bxr h GLU 329 CO 0.52 -0.13 1.20 -0.25 -1.18 0.00 0.00 179.01 179.17 2bxr n ASP 330 N -3.30 7.45 -3.97 1.04 10.43 -1.26 -4.89 116.55 122.05 2bxr n ASP 330 Ca -0.02 -3.62 -0.25 0.00 2.57 0.00 0.00 54.79 53.47 2bxr n ASP 330 Cb 0.11 -1.18 -0.17 0.00 1.84 0.00 0.00 41.12 41.73 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 -3.66 1.26 0.00 2.24 0.00 -1.23 -5.08 121.76 115.29 2bxr s ALA 331 Ca 0.45 -0.45 -0.01 0.00 0.00 0.00 0.00 51.96 51.95 2bxr s ALA 331 Cb 0.26 -0.71 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 2bxr s ALA 331 CO -0.20 -0.12 1.02 -1.00 0.00 0.00 0.00 175.76 175.46 2bxr h PRO 332 N 7.49 -0.02 -6.75 0.00 0.13 -1.92 -3.42 132.00 127.51 2bxr h PRO 332 Ca -0.31 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.31 2bxr h PRO 332 Cb 1.16 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.30 2bxr h PRO 332 CO 0.45 -0.01 0.46 0.42 -0.23 0.00 0.00 178.00 179.09 2bxr s ILE 333 N -3.08 3.68 -0.14 -3.56 -1.09 -1.26 -4.54 121.20 111.21 2bxr s ILE 333 Ca -0.00 1.60 0.15 0.00 -2.23 0.00 0.00 60.65 60.16 2bxr s ILE 333 Cb 0.00 -4.02 -0.21 0.00 -1.58 0.00 0.00 42.46 36.65 2bxr s ILE 333 CO 0.02 0.35 0.10 -1.20 -1.23 0.00 0.00 174.94 172.97 2bxr n SER 334 N 1.64 1.03 -3.72 3.58 7.64 -0.00 -4.71 113.62 119.07 2bxr n SER 334 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 2bxr n SER 334 Cb 0.45 1.02 -0.09 0.00 -1.01 0.00 0.00 64.21 64.58 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 -2.50 0.02 0.15 0.44 2.07 -1.24 -1.67 121.20 118.47 2bxr s ILE 335 Ca -0.08 -0.19 0.07 0.00 -1.41 0.00 0.00 60.65 59.04 2bxr s ILE 335 Cb 0.06 -0.64 -0.04 0.00 0.13 0.00 0.00 42.46 41.97 2bxr s ILE 335 CO 0.67 -0.11 -0.15 -0.89 -1.91 0.00 0.00 174.94 172.55 2bxr s THR 336 N -0.55 1.51 0.00 4.00 2.01 -0.21 -1.31 115.64 121.09 2bxr s THR 336 Ca -0.07 -1.89 -0.12 0.00 0.31 0.00 0.00 61.69 59.93 2bxr s THR 336 Cb -0.04 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.76 2bxr s THR 336 CO 0.03 -0.46 0.24 -0.76 -0.69 0.00 0.00 174.62 172.99 2bxr s LEU 337 N -2.73 1.14 0.38 4.42 1.43 0.26 -3.33 118.68 120.25 2bxr s LEU 337 Ca 0.14 -0.09 -0.26 0.00 -1.03 0.00 0.00 54.13 52.89 2bxr s LEU 337 Cb -0.04 1.05 -0.09 0.00 0.03 0.00 0.00 46.19 47.15 2bxr s LEU 337 CO 0.04 -0.45 1.15 -0.62 0.23 0.00 0.00 176.35 176.70 2bxr s ASP 338 N -1.51 6.65 -0.10 2.29 -1.08 -1.19 0.04 116.67 121.77 2bxr s ASP 338 Ca -0.12 2.30 0.25 0.00 -0.52 0.00 0.00 52.55 54.45 2bxr s ASP 338 Cb -0.05 -2.61 0.46 0.00 -1.46 0.00 0.00 42.92 39.26 2bxr s ASP 338 CO 0.02 -0.58 1.15 -0.67 0.52 0.00 0.00 175.17 175.60 2bxr n ASP 339 N 0.20 1.25 -4.77 -0.34 2.03 -0.08 -4.78 116.55 110.07 2bxr n ASP 339 Ca 0.04 -2.05 -0.36 0.00 0.52 0.00 0.00 54.79 52.94 2bxr n ASP 339 Cb 0.47 -0.37 -0.00 0.00 -0.72 0.00 0.00 41.12 40.49 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 -1.51 3.15 0.75 5.18 2.01 -1.25 -4.45 115.64 119.52 2bxr s THR 340 Ca 0.32 0.77 -0.15 0.00 0.31 0.00 0.00 61.69 62.93 2bxr s THR 340 Cb 0.36 -3.34 0.02 0.00 0.01 0.00 0.00 72.50 69.55 2bxr s THR 340 CO -0.12 -0.10 0.93 0.29 -0.69 0.00 0.00 174.62 174.93 2bxr n LYS 341 N -0.98 0.38 0.29 4.92 4.76 -1.01 -4.81 118.16 121.70 2bxr n LYS 341 Ca 0.10 0.19 0.16 0.00 -2.87 0.00 0.00 58.31 55.89 2bxr n LYS 341 Cb 0.50 -2.20 0.87 0.00 -1.84 0.00 0.00 35.03 32.35 2bxr n LYS 341 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 2bxr h PRO 342 N -0.47 0.00 -0.02 1.97 0.13 -1.94 0.13 132.00 131.80 2bxr h PRO 342 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2bxr h PRO 342 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2bxr h PRO 342 CO 0.45 0.00 -0.40 -0.40 -0.23 0.00 0.00 178.00 177.43 2bxr n ASP 343 N -2.76 2.06 0.00 1.44 5.75 -1.26 -4.97 116.55 116.81 2bxr n ASP 343 Ca -0.02 -1.53 0.00 0.00 -0.01 0.00 0.00 54.79 53.23 2bxr n ASP 343 Cb 0.22 0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 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 1.35 0.66 3.84 6.12 0.00 0.45 -5.08 105.19 112.53 2bxr n GLY 344 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.68 6.71 -0.81 1.61 1.04 -1.26 -4.48 113.70 113.82 2bxr s SER 345 Ca 0.00 1.60 -0.01 0.00 0.48 0.00 0.00 55.95 58.02 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 -0.52 0.64 0.18 0.98 0.00 0.00 173.24 174.52 2bxr n LEU 346 N -1.31 -3.62 -4.67 2.42 4.32 -1.26 -2.41 117.00 110.47 2bxr n LEU 346 Ca 0.07 -0.66 -0.41 0.00 -0.02 0.00 0.00 56.01 54.99 2bxr n LEU 346 Cb 0.54 -2.24 0.02 0.00 -1.62 0.00 0.00 43.42 40.11 2bxr n LEU 346 CO 0.44 -0.14 0.79 -0.81 -1.22 0.00 0.00 177.39 176.45 2bxr n PRO 347 N -2.41 1.67 -3.49 3.23 -0.04 -1.25 -4.15 135.00 128.57 2bxr n PRO 347 Ca -0.20 0.60 -0.14 0.00 -0.04 0.00 0.00 63.50 63.72 2bxr n PRO 347 Cb 0.62 -2.29 -0.04 0.00 -0.04 0.00 0.00 33.50 31.75 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 -1.25 -1.57 -0.17 0.55 0.00 -1.26 -1.91 121.76 116.15 2bxr s ALA 348 Ca 0.64 0.75 0.01 0.00 0.00 0.00 0.00 51.96 53.36 2bxr s ALA 348 Cb -0.51 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.13 2bxr s ALA 348 CO 0.56 -0.59 -0.20 0.42 0.00 0.00 0.00 175.76 175.95 2bxr s ILE 349 N -2.69 2.10 -0.11 0.00 1.01 -0.08 -0.90 121.20 120.53 2bxr s ILE 349 Ca -0.04 -0.94 -0.15 0.00 0.00 0.00 0.00 60.65 59.52 2bxr s ILE 349 Cb -0.01 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 2bxr s ILE 349 CO -0.04 0.54 0.37 -0.32 0.00 0.00 0.00 174.94 175.50 2bxr s MET 350 N 1.12 4.19 -0.02 2.79 -2.45 0.11 -1.26 119.30 123.78 2bxr s MET 350 Ca 0.01 0.27 -0.02 0.00 -1.25 0.00 0.00 55.69 54.70 2bxr s MET 350 Cb -0.14 -3.38 0.00 0.00 1.25 0.00 0.00 34.83 32.57 2bxr s MET 350 CO -0.09 0.32 0.05 0.20 1.05 0.00 0.00 175.02 176.56 2bxr s GLY 351 N 0.15 -0.02 -0.16 2.11 0.00 -0.55 0.89 107.32 109.74 2bxr s GLY 351 Ca 0.21 0.10 -0.08 0.00 0.00 0.00 0.00 44.72 44.96 2bxr s GLY 351 CO 0.08 0.08 0.11 -1.36 0.00 0.00 0.00 173.10 172.00 2bxr s PHE 352 N -0.09 3.42 -0.25 1.90 0.08 -0.42 -1.55 117.98 121.07 2bxr s PHE 352 Ca -0.01 0.34 -0.05 0.00 0.12 0.00 0.00 56.93 57.33 2bxr s PHE 352 Cb -0.01 -2.03 -0.00 0.00 -0.57 0.00 0.00 43.02 40.40 2bxr s PHE 352 CO 0.00 0.44 -0.00 -1.50 -0.10 0.00 0.00 175.22 174.05 2bxr s ILE 353 N -0.23 3.54 0.20 0.64 -1.16 -0.49 -0.82 121.20 122.87 2bxr s ILE 353 Ca 0.10 -0.60 -0.03 0.00 -0.51 0.00 0.00 60.65 59.61 2bxr s ILE 353 Cb -0.12 -2.70 -0.04 0.00 0.61 0.00 0.00 42.46 40.22 2bxr s ILE 353 CO 0.01 0.29 0.17 -1.48 -2.81 0.00 0.00 174.94 171.11 2bxr s LEU 354 N 1.47 1.12 0.00 8.50 0.05 -1.26 -0.25 118.68 128.32 2bxr s LEU 354 Ca 0.04 -1.30 0.00 0.00 0.05 0.00 0.00 54.13 52.92 2bxr s LEU 354 Cb -0.15 0.55 0.00 0.00 -2.05 0.00 0.00 46.19 44.54 2bxr s LEU 354 CO -0.01 -0.86 0.00 0.00 -0.55 0.00 0.00 176.35 174.92 2bxr n ALA 355 N -0.26 0.00 0.32 1.48 0.00 0.32 -2.25 120.51 120.11 2bxr n ALA 355 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.65 2bxr n ALA 355 Cb 0.65 0.00 1.07 0.00 0.00 0.00 0.00 19.45 21.17 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 -0.22 0.00 -0.00 -1.88 0.17 114.38 112.45 2bxr h ARG 356 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 59.98 59.83 2bxr h ARG 356 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.96 2bxr h ARG 356 CO 0.00 0.01 -0.47 0.87 -0.00 0.00 0.00 179.97 180.38 2bxr h LYS 357 N 0.00 0.56 0.28 0.08 1.57 -1.84 -2.10 116.57 115.12 2bxr h LYS 357 Ca -0.00 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 2bxr h LYS 357 Cb 0.11 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2bxr h LYS 357 CO 0.00 0.91 -0.14 0.00 -0.57 0.00 0.00 179.45 179.65 2bxr h ALA 358 N 1.04 -0.38 -0.54 3.86 0.00 -0.92 -0.62 119.26 121.70 2bxr h ALA 358 Ca 0.03 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.92 2bxr h ALA 358 Cb 0.99 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 2bxr h ALA 358 CO 0.09 -0.66 0.04 -0.44 0.00 0.00 0.00 179.25 178.28 2bxr h ASP 359 N -0.49 -0.15 0.41 0.00 3.32 -1.44 0.36 116.42 118.42 2bxr h ASP 359 Ca -0.04 0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 2bxr h ASP 359 Cb 0.37 0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 2bxr h ASP 359 CO 0.06 -0.05 -0.22 -0.09 -1.72 0.00 0.00 179.24 177.22 2bxr h ARG 360 N 0.16 -0.57 0.00 3.56 2.43 -1.35 -3.27 114.38 115.35 2bxr h ARG 360 Ca 0.28 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2bxr h ARG 360 Cb 0.42 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 2bxr h ARG 360 CO -0.42 -0.38 -0.35 1.28 -1.51 0.00 0.00 179.97 178.59 2bxr n LEU 361 N -5.35 0.49 -0.22 3.80 4.77 -0.24 -3.81 117.00 116.44 2bxr n LEU 361 Ca -0.11 0.27 0.02 0.00 -0.03 0.00 0.00 56.01 56.16 2bxr n LEU 361 Cb 0.26 -0.30 0.13 0.00 -2.33 0.00 0.00 43.42 41.19 2bxr n LEU 361 CO 0.35 -0.00 0.99 0.00 -1.33 0.00 0.00 177.39 177.40 2bxr h ALA 362 N 2.78 0.87 -1.32 -1.18 0.00 -0.36 -1.60 119.26 118.45 2bxr h ALA 362 Ca 0.00 0.10 0.44 0.00 0.00 0.00 0.00 54.91 55.44 2bxr h ALA 362 Cb 0.61 0.07 -0.13 0.00 0.00 0.00 0.00 17.79 18.35 2bxr h ALA 362 CO 0.00 -0.20 0.85 0.87 0.00 0.00 0.00 179.25 180.77 2bxr h LYS 363 N 0.41 0.08 -7.31 0.00 1.79 -1.73 -3.44 116.57 106.37 2bxr h LYS 363 Ca 0.34 -0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 58.30 2bxr h LYS 363 Cb 0.46 -0.02 0.09 0.00 -1.58 0.00 0.00 32.23 31.19 2bxr h LYS 363 CO -0.35 0.05 0.36 -0.51 -1.08 0.00 0.00 179.45 177.93 2bxr s LEU 364 N -9.48 3.18 0.36 2.94 1.43 -0.60 -5.00 118.68 111.50 2bxr s LEU 364 Ca -0.08 1.67 -0.27 0.00 -1.03 0.00 0.00 54.13 54.43 2bxr s LEU 364 Cb 0.30 -4.50 -0.09 0.00 0.03 0.00 0.00 46.19 41.92 2bxr s LEU 364 CO 0.82 -1.47 1.15 -2.28 0.23 0.00 0.00 176.35 174.80 2bxr s HIS 365 N -2.94 3.23 0.26 0.29 5.65 -1.26 -4.90 115.29 115.63 2bxr s HIS 365 Ca 0.59 1.59 -0.11 0.00 0.25 0.00 0.00 55.06 57.39 2bxr s HIS 365 Cb -0.15 -3.36 0.38 0.00 -1.18 0.00 0.00 32.58 28.26 2bxr s HIS 365 CO 0.52 -1.08 1.57 -0.22 -0.65 0.00 0.00 174.74 174.89 2bxr h LYS 366 N 3.04 -0.01 -0.17 2.88 3.64 -1.94 0.76 116.57 124.77 2bxr h LYS 366 Ca -0.48 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 58.93 2bxr h LYS 366 Cb 1.22 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 2bxr h LYS 366 CO 0.64 -0.00 0.12 0.93 -2.27 0.00 0.00 179.45 178.86 2bxr h GLU 367 N -0.01 0.09 0.11 1.90 4.39 -2.00 -1.42 114.58 117.64 2bxr h GLU 367 Ca 0.42 -0.01 -0.27 0.00 0.34 0.00 0.00 59.36 59.84 2bxr h GLU 367 Cb 0.65 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.29 2bxr h GLU 367 CO -0.93 0.06 -1.20 0.82 -1.16 0.00 0.00 179.01 176.61 2bxr h ILE 368 N 0.09 1.45 -0.07 3.13 2.04 -1.23 -2.84 117.51 120.08 2bxr h ILE 368 Ca 0.07 -2.87 0.02 0.00 1.00 0.00 0.00 64.86 63.09 2bxr h ILE 368 Cb 0.18 2.83 -0.03 0.00 -0.74 0.00 0.00 36.82 39.06 2bxr h ILE 368 CO -0.01 0.84 -0.08 0.03 0.00 0.00 0.00 178.15 178.94 2bxr h ARG 369 N 0.12 -0.10 -0.44 2.37 3.08 -0.89 -1.29 114.38 117.23 2bxr h ARG 369 Ca -0.13 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.01 2bxr h ARG 369 Cb 1.90 0.02 -0.10 0.00 0.08 0.00 0.00 29.97 31.87 2bxr h ARG 369 CO 0.20 -0.07 -0.33 -0.22 -1.07 0.00 0.00 179.97 178.49 2bxr h LYS 370 N -0.11 -0.23 -0.29 0.04 3.64 -1.26 0.20 116.57 118.57 2bxr h LYS 370 Ca 0.06 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2bxr h LYS 370 Cb 0.18 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2bxr h LYS 370 CO -0.13 -0.15 0.19 -0.22 -2.27 0.00 0.00 179.45 176.87 2bxr h LYS 371 N -0.24 0.38 0.09 1.90 3.64 -1.40 -0.01 116.57 120.95 2bxr h LYS 371 Ca 0.18 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.55 2bxr h LYS 371 Cb 0.54 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2bxr h LYS 371 CO -0.57 0.27 -0.20 0.87 -2.27 0.00 0.00 179.45 177.55 2bxr h LYS 372 N 0.39 -0.36 -0.23 1.90 1.57 -0.26 -2.34 116.57 117.23 2bxr h LYS 372 Ca 0.11 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.97 2bxr h LYS 372 Cb -0.03 0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.29 2bxr h LYS 372 CO -0.02 -0.24 -0.24 0.82 -0.57 0.00 0.00 179.45 179.20 2bxr h ILE 373 N -0.37 0.40 -0.97 1.86 2.04 -0.46 -2.19 117.51 117.82 2bxr h ILE 373 Ca 0.03 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.06 2bxr h ILE 373 Cb 0.40 0.40 -0.09 0.00 -0.74 0.00 0.00 36.82 36.79 2bxr h ILE 373 CO -0.12 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.64 2bxr n GLU 375 N -4.66 0.14 -0.06 0.00 0.28 -0.87 -0.97 120.64 114.50 2bxr n GLU 375 Ca 0.21 0.09 -0.13 0.00 -0.16 0.00 0.00 57.16 57.17 2bxr n GLU 375 Cb 0.52 -1.64 -0.06 0.00 1.43 0.00 0.00 31.44 31.69 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 0.39 -0.66 -1.84 5.85 0.12 -3.04 115.31 116.13 2bxr h LEU 376 Ca 0.00 -0.44 -0.12 0.00 0.84 0.00 0.00 57.88 58.16 2bxr h LEU 376 Cb 0.63 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2bxr h LEU 376 CO 0.00 0.75 -0.24 1.88 -0.34 0.00 0.00 178.44 180.49 2bxr h TYR 377 N 0.03 0.90 -0.23 1.25 0.99 -1.02 0.19 116.97 119.08 2bxr h TYR 377 Ca 0.03 -0.21 0.06 0.00 2.00 0.00 0.00 58.73 60.61 2bxr h TYR 377 Cb 0.62 -0.21 -0.07 0.00 1.00 0.00 0.00 36.73 38.07 2bxr h TYR 377 CO 0.07 0.95 -0.21 0.00 -0.00 0.00 0.00 178.16 178.97 2bxr h ALA 378 N 1.05 -0.07 -0.00 3.88 0.00 -1.10 0.69 119.26 123.70 2bxr h ALA 378 Ca 0.09 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2bxr h ALA 378 Cb 0.76 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2bxr h ALA 378 CO 0.06 -0.63 -0.42 0.36 0.00 0.00 0.00 179.25 178.62 2bxr n LYS 379 N -5.35 0.32 0.10 0.00 2.85 -0.98 0.26 118.16 115.36 2bxr n LYS 379 Ca -0.01 -0.19 -0.21 0.00 -1.05 0.00 0.00 58.31 56.85 2bxr n LYS 379 Cb 0.27 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 33.00 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 0.46 1.17 -0.04 0.58 2.07 -0.45 -3.36 116.25 116.69 2bxr h VAL 380 Ca 0.00 -2.72 0.00 0.00 0.82 0.00 0.00 66.70 64.80 2bxr h VAL 380 Cb 0.50 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.15 2bxr h VAL 380 CO 0.00 0.84 0.00 0.18 0.02 0.00 0.00 177.57 178.61 2bxr n LEU 381 N -3.58 2.77 -3.64 2.57 4.77 0.22 -4.95 117.00 115.14 2bxr n LEU 381 Ca -0.18 -0.93 -0.27 0.00 -0.03 0.00 0.00 56.01 54.60 2bxr n LEU 381 Cb 1.07 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 42.15 2bxr n LEU 381 CO 0.54 0.47 -0.01 0.61 -1.33 0.00 0.00 177.39 177.67 2bxr n GLY 382 N 1.33 -0.48 2.92 -0.72 0.00 0.14 -4.95 105.19 103.43 2bxr n GLY 382 Ca 0.15 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.94 1.65 0.47 1.61 0.01 -0.62 -5.01 113.70 108.86 2bxr s SER 383 Ca 0.52 -0.23 0.12 0.00 1.31 0.00 0.00 55.95 57.68 2bxr s SER 383 Cb -0.28 -0.68 1.08 0.00 0.21 0.00 0.00 66.02 66.35 2bxr s SER 383 CO 0.64 -0.06 2.11 -0.61 0.41 0.00 0.00 173.24 175.73 2bxr h GLN 384 N 7.55 0.25 0.00 12.44 5.75 -1.92 -2.49 115.11 136.68 2bxr h GLN 384 Ca -0.31 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.17 2bxr h GLN 384 Cb 1.15 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.65 2bxr h GLN 384 CO 0.43 0.16 0.00 -0.85 -2.65 0.00 0.00 178.83 175.92 2bxr n GLU 385 N -4.51 0.06 0.23 1.69 0.28 -1.26 -1.57 120.64 115.55 2bxr n GLU 385 Ca -0.00 0.30 0.16 0.00 -0.16 0.00 0.00 57.16 57.46 2bxr n GLU 385 Cb 0.08 -1.61 0.75 0.00 1.43 0.00 0.00 31.44 32.09 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 2.43 1.00 -0.01 -1.84 0.00 -1.78 -2.69 119.26 116.37 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 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2bxr h ALA 386 CO 0.00 0.00 -0.16 1.28 0.00 0.00 0.00 179.25 180.37 2bxr n LEU 387 N -2.65 1.02 -3.22 0.00 4.32 -0.61 -4.45 117.00 111.42 2bxr n LEU 387 Ca -0.00 -0.27 -0.27 0.00 -0.02 0.00 0.00 56.01 55.45 2bxr n LEU 387 Cb 0.15 -0.10 -0.06 0.00 -1.62 0.00 0.00 43.42 41.79 2bxr n LEU 387 CO 0.19 0.18 0.09 1.41 -1.22 0.00 0.00 177.39 178.05 2bxr n HIS 388 N -0.51 3.67 -1.25 -1.77 8.25 -1.02 -5.07 115.22 117.53 2bxr n HIS 388 Ca 0.14 -4.08 -0.32 0.00 -0.26 0.00 0.00 57.72 53.21 2bxr n HIS 388 Cb 0.33 -0.52 0.10 0.00 1.12 0.00 0.00 29.99 31.02 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 -2.85 2.00 -0.10 -0.41 0.04 -1.26 -4.74 135.00 127.68 2bxr s PRO 389 Ca 0.43 1.46 0.17 0.00 0.04 0.00 0.00 61.00 63.10 2bxr s PRO 389 Cb 0.21 -1.85 -0.25 0.00 0.04 0.00 0.00 34.50 32.65 2bxr s PRO 389 CO -0.07 -1.88 0.24 0.28 0.04 0.00 0.00 177.00 175.62 2bxr n VAL 390 N -3.31 0.58 -3.70 -0.36 0.31 0.30 -4.96 118.33 107.19 2bxr n VAL 390 Ca 0.11 -0.58 -0.05 0.00 -0.01 0.00 0.00 64.34 63.81 2bxr n VAL 390 Cb 0.52 -0.22 -0.02 0.00 -0.91 0.00 0.00 33.84 33.21 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 -2.87 -0.20 -0.20 3.52 5.65 -1.21 -5.01 115.29 114.97 2bxr s HIS 391 Ca -0.08 -0.09 -0.09 0.00 0.25 0.00 0.00 55.06 55.05 2bxr s HIS 391 Cb 0.09 0.63 0.08 0.00 -1.18 0.00 0.00 32.58 32.19 2bxr s HIS 391 CO 0.75 -0.83 0.46 -0.47 -0.65 0.00 0.00 174.74 174.00 2bxr s TYR 392 N -3.36 -0.78 0.08 3.88 5.04 -1.26 -1.43 117.35 119.53 2bxr s TYR 392 Ca 0.10 1.55 0.09 0.00 -2.44 0.00 0.00 57.07 56.37 2bxr s TYR 392 Cb -0.02 0.36 -0.03 0.00 0.35 0.00 0.00 41.96 42.62 2bxr s TYR 392 CO -0.00 -0.44 -0.22 -1.21 -1.34 0.00 0.00 175.55 172.34 2bxr s GLU 393 N 1.97 1.31 -0.20 4.97 0.41 -0.74 -5.01 118.70 121.41 2bxr s GLU 393 Ca -0.07 -1.13 -0.27 0.00 -0.41 0.00 0.00 54.97 53.10 2bxr s GLU 393 Cb -0.09 -1.57 0.08 0.00 -1.78 0.00 0.00 34.13 30.77 2bxr s GLU 393 CO -0.14 0.38 0.78 -1.83 -0.49 0.00 0.00 175.26 173.96 2bxr s GLU 394 N -1.66 0.83 -0.06 1.61 -1.05 -1.26 -0.13 118.70 116.98 2bxr s GLU 394 Ca 0.09 0.64 0.03 0.00 -0.15 0.00 0.00 54.97 55.58 2bxr s GLU 394 Cb -0.10 0.40 -0.02 0.00 -0.44 0.00 0.00 34.13 33.97 2bxr s GLU 394 CO 0.04 -0.17 -0.14 0.21 0.95 0.00 0.00 175.26 176.15 2bxr s LYS 395 N -0.24 2.60 -0.39 -4.83 2.20 -1.12 -4.99 119.74 112.96 2bxr s LYS 395 Ca -0.03 -0.69 -0.15 0.00 -0.36 0.00 0.00 55.97 54.74 2bxr s LYS 395 Cb -0.03 -2.41 0.01 0.00 -1.51 0.00 0.00 37.83 33.89 2bxr s LYS 395 CO 0.03 0.58 0.33 1.21 -0.36 0.00 0.00 175.35 177.14 2bxr s ASN 396 N -0.61 6.13 0.22 1.43 3.84 -1.26 -1.88 114.94 122.81 2bxr s ASN 396 Ca 0.09 -0.66 0.26 0.00 0.21 0.00 0.00 52.86 52.75 2bxr s ASN 396 Cb -0.11 -2.18 0.84 0.00 -0.55 0.00 0.00 41.25 39.26 2bxr s ASN 396 CO 0.01 -0.43 1.76 0.79 -2.79 0.00 0.00 177.10 176.45 2bxr n TRP 397 N 5.29 0.92 -0.04 0.43 7.02 -0.69 -3.62 117.44 126.75 2bxr n TRP 397 Ca -0.10 0.29 -0.12 0.00 -1.02 0.00 0.00 57.50 56.55 2bxr n TRP 397 Cb 0.48 -0.96 -0.06 0.00 -2.42 0.00 0.00 31.31 28.35 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 -4.81 0.63 -3.49 0.00 0.28 -1.24 -4.71 120.64 107.29 2bxr n GLU 399 Ca -0.05 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.53 2bxr n GLU 399 Cb 0.17 -1.19 -0.08 0.00 1.43 0.00 0.00 31.44 31.77 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 0.61 2.76 0.16 3.44 0.41 -0.88 -4.96 118.70 120.24 2bxr s GLU 400 Ca 0.00 -1.48 -0.12 0.00 -0.41 0.00 0.00 54.97 52.97 2bxr s GLU 400 Cb 0.00 -3.97 0.05 0.00 -1.78 0.00 0.00 34.13 28.43 2bxr s GLU 400 CO 0.00 -1.04 1.66 0.37 -0.49 0.00 0.00 175.26 175.76 2bxr h GLN 401 N 8.58 0.92 -0.60 1.61 4.15 -1.89 0.35 115.11 128.23 2bxr h GLN 401 Ca -0.25 -0.24 -0.20 0.00 0.77 0.00 0.00 58.65 58.73 2bxr h GLN 401 Cb 1.09 -0.11 -0.12 0.00 0.21 0.00 0.00 27.48 28.55 2bxr h GLN 401 CO 0.84 0.87 0.19 0.66 -1.93 0.00 0.00 178.83 179.46 2bxr n TYR 402 N -4.36 1.97 0.00 3.99 4.01 -1.26 -4.26 117.16 117.24 2bxr n TYR 402 Ca 0.02 -1.29 0.00 0.00 -0.16 0.00 0.00 57.90 56.47 2bxr n TYR 402 Cb 0.26 -0.61 0.00 0.00 -0.31 0.00 0.00 39.34 38.68 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 -0.53 0.78 0.00 7.72 7.64 -1.04 -4.96 113.62 123.24 2bxr n SER 403 Ca 0.38 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.26 2bxr n SER 403 Cb 1.26 0.10 0.00 0.00 -1.01 0.00 0.00 64.21 64.55 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 0.78 1.89 0.00 0.23 0.00 0.12 -4.83 105.19 103.38 2bxr n GLY 404 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.53 3.59 -0.02 0.00 -1.25 -4.58 105.19 101.41 2bxr n GLY 405 Ca 0.00 -1.08 -0.27 0.00 0.00 0.00 0.00 46.02 44.67 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 1.81 0.79 -1.71 0.00 0.05 -1.88 -3.08 116.97 112.95 2bxr h TYR 407 Ca -0.43 -0.44 0.00 0.00 0.05 0.00 0.00 58.73 57.91 2bxr h TYR 407 Cb 1.25 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.91 2bxr h TYR 407 CO 0.79 1.28 0.00 -2.37 -1.05 0.00 0.00 178.16 176.80 2bxr n THR 408 N -4.05 0.00 -3.93 -2.88 5.66 -1.26 -4.96 114.28 102.85 2bxr n THR 408 Ca -0.11 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.55 2bxr n THR 408 Cb 0.78 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.51 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 3.90 0.29 1.79 0.00 -1.26 -1.53 121.76 122.95 2bxr s ALA 409 Ca 0.00 -0.76 0.09 0.00 0.00 0.00 0.00 51.96 51.29 2bxr s ALA 409 Cb 0.00 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.22 2bxr s ALA 409 CO 0.00 0.72 0.05 1.52 0.00 0.00 0.00 175.76 178.05 2bxr s TYR 410 N -1.27 2.71 -0.32 0.00 -0.85 -0.20 -4.95 117.35 112.47 2bxr s TYR 410 Ca 0.25 -0.28 -0.12 0.00 -0.52 0.00 0.00 57.07 56.40 2bxr s TYR 410 Cb -0.12 -1.35 -0.02 0.00 0.38 0.00 0.00 41.96 40.84 2bxr s TYR 410 CO 0.16 0.52 0.22 -0.06 -1.52 0.00 0.00 175.55 174.87 2bxr s PHE 411 N -2.36 3.22 0.82 -3.49 0.40 -1.26 -3.84 117.98 111.46 2bxr s PHE 411 Ca 0.34 -0.18 -0.12 0.00 -0.60 0.00 0.00 56.93 56.36 2bxr s PHE 411 Cb -0.05 -2.44 0.09 0.00 0.51 0.00 0.00 43.02 41.13 2bxr s PHE 411 CO 0.21 -0.33 1.16 -2.14 0.70 0.00 0.00 175.22 174.82 2bxr s PRO 412 N 1.72 1.68 0.29 0.24 0.02 -1.26 0.07 135.00 137.77 2bxr s PRO 412 Ca 0.06 1.55 -0.28 0.00 0.02 0.00 0.00 61.00 62.35 2bxr s PRO 412 Cb -0.17 -1.80 -0.14 0.00 0.02 0.00 0.00 34.50 32.41 2bxr s PRO 412 CO 0.10 -2.14 0.96 -2.30 -0.33 0.00 0.00 177.00 173.30 2bxr n PRO 413 N -3.52 1.23 0.00 5.54 -0.02 -1.26 -2.76 135.00 134.21 2bxr n PRO 413 Ca 0.12 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 2bxr n PRO 413 Cb 0.52 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.22 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 1.29 2.82 0.13 -1.23 0.00 0.16 -4.83 105.19 103.53 2bxr n GLY 414 Ca 0.10 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.97 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 1.44 -0.91 -0.61 1.08 -1.82 -2.10 117.51 114.60 2bxr h ILE 415 Ca 0.00 -1.82 0.21 0.00 -0.39 0.00 0.00 64.86 62.87 2bxr h ILE 415 Cb 0.00 2.43 -0.12 0.00 -3.07 0.00 0.00 36.82 36.06 2bxr h ILE 415 CO 0.00 0.52 0.43 -0.03 -0.69 0.00 0.00 178.15 178.38 2bxr h MET 416 N -0.19 0.45 0.00 2.37 1.85 -1.88 -1.70 114.93 115.83 2bxr h MET 416 Ca -0.03 -0.03 -0.14 0.00 -0.61 0.00 0.00 59.70 58.89 2bxr h MET 416 Cb 1.04 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.94 2bxr h MET 416 CO 0.07 0.30 -1.52 0.25 -0.40 0.00 0.00 176.91 175.62 2bxr n THR 417 N -4.99 0.96 -0.07 -0.77 -2.24 -1.22 -2.03 114.28 103.92 2bxr n THR 417 Ca 0.22 -0.66 -0.15 0.00 -2.27 0.00 0.00 64.05 61.19 2bxr n THR 417 Cb 0.64 -0.55 -0.05 0.00 -2.10 0.00 0.00 70.33 68.26 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 0.77 0.00 -0.78 4.20 -1.14 -3.43 115.11 114.73 2bxr h GLN 418 Ca -0.15 -0.51 0.00 0.00 0.06 0.00 0.00 58.65 58.05 2bxr h GLN 418 Cb 1.48 0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.32 2bxr h GLN 418 CO 0.03 1.14 -0.18 0.66 -0.67 0.00 0.00 178.83 179.81 2bxr n TYR 419 N -4.09 0.00 0.29 2.96 4.02 -0.67 -4.91 117.16 114.76 2bxr n TYR 419 Ca -0.05 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.94 2bxr n TYR 419 Cb 0.61 0.00 0.54 0.00 -0.02 0.00 0.00 39.34 40.47 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 -1.06 -2.40 103.07 104.33 2bxr h GLY 420 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bxr h GLY 420 CO 0.00 0.00 -0.01 0.07 0.00 0.00 0.00 176.54 176.60 2bxr h ARG 421 N 0.00 0.00 -0.69 4.80 0.11 -1.90 -2.71 114.38 114.00 2bxr h ARG 421 Ca 0.00 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 59.96 2bxr h ARG 421 Cb 0.93 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.94 2bxr h ARG 421 CO 0.00 0.01 0.15 1.55 0.10 0.00 0.00 179.97 181.78 2bxr n VAL 422 N -3.23 2.78 0.12 0.08 3.14 -0.90 -4.68 118.33 115.64 2bxr n VAL 422 Ca -0.02 -1.47 -0.01 0.00 -2.96 0.00 0.00 64.34 59.88 2bxr n VAL 422 Cb 0.13 -0.34 0.25 0.00 -1.06 0.00 0.00 33.84 32.83 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 3.19 1.31 -0.58 1.55 -0.00 -1.72 -3.14 117.51 118.12 2bxr h ILE 423 Ca 0.14 -1.50 -0.31 0.00 -0.00 0.00 0.00 64.86 63.19 2bxr h ILE 423 Cb 2.14 1.71 -0.40 0.00 -0.00 0.00 0.00 36.82 40.27 2bxr h ILE 423 CO 0.62 0.44 -1.08 -2.11 -0.00 0.00 0.00 178.15 176.02 2bxr n ARG 424 N -4.03 1.94 -3.83 2.19 1.85 -1.26 -4.90 116.66 108.62 2bxr n ARG 424 Ca -0.02 -3.59 -0.36 0.00 -1.00 0.00 0.00 57.85 52.88 2bxr n ARG 424 Cb 0.47 -1.66 -0.07 0.00 -1.05 0.00 0.00 32.46 30.15 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 3.68 0.77 2.89 0.74 -1.19 -4.80 119.66 118.07 2bxr s GLN 425 Ca 0.31 -0.16 -0.13 0.00 0.05 0.00 0.00 55.36 55.43 2bxr s GLN 425 Cb 0.35 -3.26 0.06 0.00 1.10 0.00 0.00 33.01 31.26 2bxr s GLN 425 CO -0.02 0.62 1.17 -2.14 -0.55 0.00 0.00 175.29 174.37 2bxr s PRO 426 N -0.58 2.00 -0.26 1.67 0.02 -1.26 -4.79 135.00 131.80 2bxr s PRO 426 Ca 0.13 1.59 0.03 0.00 0.02 0.00 0.00 61.00 62.76 2bxr s PRO 426 Cb -0.12 -1.83 0.06 0.00 0.02 0.00 0.00 34.50 32.63 2bxr s PRO 426 CO 0.02 -1.91 -0.11 0.14 -0.33 0.00 0.00 177.00 174.81 2bxr s VAL 427 N -2.30 2.15 0.00 3.83 -7.23 -0.35 -4.98 120.40 111.53 2bxr s VAL 427 Ca 0.70 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 59.25 2bxr s VAL 427 Cb -0.25 -2.26 0.00 0.00 0.56 0.00 0.00 36.38 34.43 2bxr s VAL 427 CO 0.49 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.86 2bxr n GLY 428 N 4.44 0.98 0.55 2.32 0.00 -1.26 -0.35 105.19 111.86 2bxr n GLY 428 Ca -0.14 0.61 0.06 0.00 0.00 0.00 0.00 46.02 46.55 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 2.72 -3.77 1.61 1.74 -1.26 -4.93 116.66 112.77 2bxr n ARG 429 Ca 0.00 -2.29 -0.35 0.00 -0.77 0.00 0.00 57.85 54.44 2bxr n ARG 429 Cb 0.00 -1.45 -0.09 0.00 -1.02 0.00 0.00 32.46 29.91 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 -1.84 5.26 0.22 0.55 1.01 0.52 -1.97 121.20 124.95 2bxr s ILE 430 Ca 0.27 0.14 0.11 0.00 0.00 0.00 0.00 60.65 61.16 2bxr s ILE 430 Cb 0.19 -3.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 2bxr s ILE 430 CO 0.09 0.42 -0.19 -0.36 0.00 0.00 0.00 174.94 174.91 2bxr s PHE 431 N 0.54 2.39 -0.27 3.97 0.40 0.40 -1.21 117.98 124.20 2bxr s PHE 431 Ca 0.07 -0.32 0.03 0.00 -0.60 0.00 0.00 56.93 56.11 2bxr s PHE 431 Cb -0.12 -1.14 0.07 0.00 0.51 0.00 0.00 43.02 42.34 2bxr s PHE 431 CO -0.00 0.56 -0.06 -0.06 0.70 0.00 0.00 175.22 176.37 2bxr s PHE 432 N -1.93 3.16 0.00 0.36 0.40 -1.26 -0.28 117.98 118.44 2bxr s PHE 432 Ca 0.25 -2.35 0.00 0.00 -0.60 0.00 0.00 56.93 54.23 2bxr s PHE 432 Cb -0.07 -2.07 0.00 0.00 0.51 0.00 0.00 43.02 41.38 2bxr s PHE 432 CO 0.13 -0.88 0.00 0.00 0.70 0.00 0.00 175.22 175.17 2bxr n ALA 433 N 4.45 0.00 0.00 5.36 0.00 0.49 -4.83 120.51 125.97 2bxr n ALA 433 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 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 0.80 0.42 0.00 0.00 -1.26 -4.54 105.19 105.62 2bxr n GLY 434 Ca 0.00 -1.49 0.23 0.00 0.00 0.00 0.00 46.02 44.76 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 0.64 0.00 2.61 1.03 -1.81 0.20 112.91 115.59 2bxr h THR 435 Ca 0.00 -0.05 0.00 0.00 -0.01 0.00 0.00 66.41 66.35 2bxr h THR 435 Cb 0.00 0.48 0.00 0.00 -1.07 0.00 0.00 68.15 67.56 2bxr h THR 435 CO 0.00 0.03 0.00 -0.62 -0.01 0.00 0.00 175.52 174.92 2bxr n GLU 436 N -4.38 0.25 0.00 0.00 -0.58 -1.26 -1.65 120.64 113.02 2bxr n GLU 436 Ca 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 2bxr n GLU 436 Cb 0.78 -1.45 0.00 0.00 -0.57 0.00 0.00 31.44 30.21 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 -0.95 0.93 -1.98 2.62 -2.24 0.72 -5.02 114.28 108.37 2bxr n THR 437 Ca 0.05 -0.94 -0.30 0.00 -2.27 0.00 0.00 64.05 60.59 2bxr n THR 437 Cb 0.02 0.54 0.02 0.00 -2.10 0.00 0.00 70.33 68.81 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 -0.93 3.07 -0.13 6.98 0.00 -0.66 -4.86 121.76 125.23 2bxr s ALA 438 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 51.96 51.75 2bxr s ALA 438 Cb 0.00 -2.99 0.10 0.00 0.00 0.00 0.00 23.12 20.24 2bxr s ALA 438 CO 0.00 -0.83 1.07 0.25 0.00 0.00 0.00 175.76 176.25 2bxr n THR 439 N -2.79 1.20 -3.71 0.00 -2.24 -1.26 -4.58 114.28 100.91 2bxr n THR 439 Ca 0.06 -1.26 -0.11 0.00 -2.27 0.00 0.00 64.05 60.47 2bxr n THR 439 Cb 0.55 0.34 -0.12 0.00 -2.10 0.00 0.00 70.33 69.01 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 -1.40 0.29 -1.56 -0.78 2.20 -1.26 -4.90 119.74 112.34 2bxr s LYS 440 Ca 0.10 0.67 -0.11 0.00 -0.36 0.00 0.00 55.97 56.26 2bxr s LYS 440 Cb 0.07 -0.07 0.09 0.00 -1.51 0.00 0.00 37.83 36.42 2bxr s LYS 440 CO 0.03 -0.17 0.75 0.91 -0.36 0.00 0.00 175.35 176.51 2bxr n TRP 441 N 4.31 -1.89 -1.75 4.03 7.02 -0.24 -3.80 117.44 125.12 2bxr n TRP 441 Ca -0.24 0.82 -0.42 0.00 -1.02 0.00 0.00 57.50 56.64 2bxr n TRP 441 Cb 0.54 -3.54 -0.03 0.00 -2.42 0.00 0.00 31.31 25.86 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 -3.64 6.48 0.00 -0.99 0.15 -1.26 -1.70 113.70 112.73 2bxr s SER 442 Ca 0.48 2.65 0.00 0.00 0.70 0.00 0.00 55.95 59.78 2bxr s SER 442 Cb -0.26 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.51 2bxr s SER 442 CO 0.88 -1.00 0.00 0.61 1.20 0.00 0.00 173.24 174.93 2bxr n GLY 443 N 4.32 2.35 3.97 9.45 0.00 -1.23 -4.98 105.19 119.07 2bxr n GLY 443 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.16 2.81 0.17 1.61 1.51 -0.72 -4.58 117.35 115.99 2bxr s TYR 444 Ca 0.00 -0.40 -0.17 0.00 -1.01 0.00 0.00 57.07 55.49 2bxr s TYR 444 Cb 0.00 -2.27 0.11 0.00 -0.11 0.00 0.00 41.96 39.69 2bxr s TYR 444 CO 0.00 -0.29 1.66 0.52 -1.11 0.00 0.00 175.55 176.34 2bxr h MET 445 N 0.78 -0.01 -0.89 -0.62 2.86 -1.91 -1.05 114.93 114.09 2bxr h MET 445 Ca -0.41 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.34 2bxr h MET 445 Cb 1.27 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 32.81 2bxr h MET 445 CO 0.49 -0.00 -0.49 1.49 1.06 0.00 0.00 176.91 179.45 2bxr h GLU 446 N -0.01 -0.06 -0.99 1.72 4.57 -1.92 -1.37 114.58 116.51 2bxr h GLU 446 Ca 0.21 0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.49 2bxr h GLU 446 Cb 0.32 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 28.85 2bxr h GLU 446 CO -0.45 -0.04 0.63 0.78 -1.18 0.00 0.00 179.01 178.75 2bxr h GLY 447 N -0.06 1.59 -0.10 1.92 0.00 -0.32 -1.52 103.07 104.57 2bxr h GLY 447 Ca 0.22 -0.43 0.07 0.00 0.00 0.00 0.00 47.33 47.18 2bxr h GLY 447 CO -0.89 0.21 -0.36 0.00 0.00 0.00 0.00 176.54 175.50 2bxr h ALA 448 N 1.51 -0.34 0.03 3.60 0.00 -0.54 -0.84 119.26 122.68 2bxr h ALA 448 Ca 0.47 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.47 2bxr h ALA 448 Cb 0.38 0.74 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2bxr h ALA 448 CO -0.24 -0.80 -0.20 0.28 0.00 0.00 0.00 179.25 178.29 2bxr h VAL 449 N -0.33 0.52 -0.50 0.00 2.07 -0.79 -1.92 116.25 115.30 2bxr h VAL 449 Ca 0.13 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.74 2bxr h VAL 449 Cb 0.56 0.52 -0.07 0.00 -1.52 0.00 0.00 31.29 30.79 2bxr h VAL 449 CO -0.49 0.00 0.11 -0.08 0.02 0.00 0.00 177.57 177.13 2bxr h GLU 450 N -0.34 0.24 0.50 1.57 4.81 -1.16 0.25 114.58 120.46 2bxr h GLU 450 Ca 0.05 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2bxr h GLU 450 Cb 0.40 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2bxr h GLU 450 CO -0.17 0.16 -0.46 0.00 -0.73 0.00 0.00 179.01 177.82 2bxr h ALA 451 N 1.38 -1.04 -0.55 2.92 0.00 -0.96 -0.53 119.26 120.48 2bxr h ALA 451 Ca 0.25 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 55.09 2bxr h ALA 451 Cb 0.32 0.65 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 2bxr h ALA 451 CO -0.31 -1.12 -0.02 0.78 0.00 0.00 0.00 179.25 178.58 2bxr h GLY 452 N -0.95 0.55 0.67 0.00 0.00 -0.91 0.10 103.07 102.53 2bxr h GLY 452 Ca -0.06 0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 2bxr h GLY 452 CO -0.04 -0.17 -0.00 0.83 0.00 0.00 0.00 176.54 177.16 2bxr h GLU 453 N 0.10 0.00 -0.59 4.80 5.08 -0.82 0.24 114.58 123.39 2bxr h GLU 453 Ca 0.28 -0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.75 2bxr h GLU 453 Cb 0.44 -0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.57 2bxr h GLU 453 CO -0.48 0.33 -0.32 -0.09 -1.00 0.00 0.00 179.01 177.45 2bxr h ARG 454 N -0.33 -0.15 -0.52 2.33 2.43 -0.62 -0.33 114.38 117.19 2bxr h ARG 454 Ca 0.00 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 2bxr h ARG 454 Cb 0.33 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 2bxr h ARG 454 CO 0.00 -0.10 0.30 0.00 -1.51 0.00 0.00 179.97 178.66 2bxr h ALA 455 N 1.04 0.67 -0.16 2.80 0.00 -0.57 -0.93 119.26 122.12 2bxr h ALA 455 Ca 0.24 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.20 2bxr h ALA 455 Cb 0.55 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 2bxr h ALA 455 CO -0.67 -0.01 -0.28 0.00 0.00 0.00 0.00 179.25 178.28 2bxr h ALA 456 N 1.25 -0.27 -0.06 0.00 0.00 0.34 -1.21 119.26 119.31 2bxr h ALA 456 Ca 0.22 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.20 2bxr h ALA 456 Cb 0.06 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2bxr h ALA 456 CO -0.12 -0.74 -0.14 0.00 0.00 0.00 0.00 179.25 178.26 2bxr h ARG 457 N -0.33 -0.19 -0.72 0.00 3.08 -0.54 0.24 114.38 115.91 2bxr h ARG 457 Ca 0.11 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.29 2bxr h ARG 457 Cb 0.50 0.04 -0.13 0.00 0.08 0.00 0.00 29.97 30.47 2bxr h ARG 457 CO -0.35 -0.13 -0.35 0.93 -1.07 0.00 0.00 179.97 179.00 2bxr h GLU 458 N -0.20 -0.11 -0.53 0.04 5.08 -0.63 0.35 114.58 118.58 2bxr h GLU 458 Ca 0.07 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.54 2bxr h GLU 458 Cb 0.29 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.48 2bxr h GLU 458 CO -0.18 -0.07 0.04 0.28 -1.00 0.00 0.00 179.01 178.08 2bxr h VAL 459 N -0.11 0.61 -0.44 3.13 2.07 0.17 -2.07 116.25 119.61 2bxr h VAL 459 Ca 0.27 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.83 2bxr h VAL 459 Cb 0.57 0.44 -0.09 0.00 -1.52 0.00 0.00 31.29 30.68 2bxr h VAL 459 CO -0.78 0.03 -0.19 -0.07 0.02 0.00 0.00 177.57 176.58 2bxr h LEU 460 N 0.16 -0.66 -0.73 2.57 3.38 0.14 -1.02 115.31 119.15 2bxr h LEU 460 Ca 0.27 0.16 0.08 0.00 0.09 0.00 0.00 57.88 58.48 2bxr h LEU 460 Cb 0.41 0.37 -0.06 0.00 0.09 0.00 0.00 40.66 41.47 2bxr h LEU 460 CO -0.42 -0.22 0.40 0.78 0.09 0.00 0.00 178.44 179.07 2bxr h ASN 461 N -0.10 0.58 0.00 -0.43 2.35 -0.67 -2.09 115.58 115.22 2bxr h ASN 461 Ca 0.21 0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.93 2bxr h ASN 461 Cb 0.43 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 2bxr h ASN 461 CO -0.51 0.36 0.29 0.61 -1.65 0.00 0.00 177.43 176.53 2bxr n GLY 462 N -1.30 1.73 3.89 2.83 0.00 -0.39 -4.70 105.19 107.25 2bxr n GLY 462 Ca 0.11 -0.42 -0.03 0.00 0.00 0.00 0.00 46.02 45.68 2bxr n GLY 462 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bxr s LEU 463 N 0.00 0.01 0.00 0.99 1.43 -0.79 -4.96 118.68 115.36 2bxr s LEU 463 Ca 0.23 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2bxr s LEU 463 Cb 0.11 2.06 0.00 0.00 0.03 0.00 0.00 46.19 48.39 2bxr s LEU 463 CO -0.00 -0.98 0.00 0.61 0.23 0.00 0.00 176.35 176.21