#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oxa s THR 3 N 0.00 2.14 -0.02 0.00 2.01 -1.26 -5.11 115.64 113.40 1oxa s THR 3 Ca 0.00 -1.77 -0.17 0.00 0.31 0.00 0.00 61.69 60.06 1oxa s THR 3 Cb 0.00 -2.33 -0.05 0.00 0.01 0.00 0.00 72.50 70.12 1oxa s THR 3 CO 0.00 -0.17 0.47 0.68 -0.69 0.00 0.00 174.62 174.92 1oxa s VAL 4 N 1.08 5.01 0.39 3.82 -7.23 -1.26 -5.07 120.40 117.14 1oxa s VAL 4 Ca -0.04 0.98 -0.24 0.00 -1.81 0.00 0.00 61.98 60.86 1oxa s VAL 4 Cb -0.20 -3.80 -0.09 0.00 0.56 0.00 0.00 36.38 32.86 1oxa s VAL 4 CO -0.06 0.48 1.05 -2.84 -0.31 0.00 0.00 175.10 173.43 1oxa s PRO 5 N -0.49 4.19 -0.27 4.82 0.02 -1.26 -4.84 135.00 137.16 1oxa s PRO 5 Ca 0.26 1.53 -0.04 0.00 0.02 0.00 0.00 61.00 62.77 1oxa s PRO 5 Cb -0.17 -2.58 0.02 0.00 0.02 0.00 0.00 34.50 31.80 1oxa s PRO 5 CO 0.14 -0.12 -0.00 0.34 -0.33 0.00 0.00 177.00 177.03 1oxa s ASP 6 N -1.53 4.69 0.00 2.53 2.15 -1.26 -0.46 116.67 122.79 1oxa s ASP 6 Ca 0.57 -0.87 0.00 0.00 0.43 0.00 0.00 52.55 52.68 1oxa s ASP 6 Cb -0.22 -1.75 0.00 0.00 -0.30 0.00 0.00 42.92 40.65 1oxa s ASP 6 CO 0.28 -0.17 0.80 0.18 -0.17 0.00 0.00 175.17 176.09 1oxa n LEU 7 N 4.73 0.00 0.07 -1.34 4.77 -0.15 -1.12 117.00 123.96 1oxa n LEU 7 Ca -0.15 0.30 0.12 0.00 -0.03 0.00 0.00 56.01 56.25 1oxa n LEU 7 Cb 0.47 -0.30 0.22 0.00 -2.33 0.00 0.00 43.42 41.48 1oxa n LEU 7 CO 0.28 -0.30 0.46 -0.62 -1.33 0.00 0.00 177.39 175.89 1oxa n GLU 8 N -1.30 0.28 -1.25 3.23 1.02 -1.26 -4.73 120.64 116.63 1oxa n GLU 8 Ca 0.00 0.11 -0.31 0.00 -0.02 0.00 0.00 57.16 56.94 1oxa n GLU 8 Cb 0.00 -1.71 0.10 0.00 -0.02 0.00 0.00 31.44 29.81 1oxa n GLU 8 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1oxa s SER 9 N -4.28 4.31 0.38 1.62 1.04 -0.28 -4.91 113.70 111.58 1oxa s SER 9 Ca 0.07 1.94 0.27 0.00 0.48 0.00 0.00 55.95 58.71 1oxa s SER 9 Cb 0.13 -2.54 1.33 0.00 0.10 0.00 0.00 66.02 65.04 1oxa s SER 9 CO 0.69 -2.17 1.82 0.44 0.98 0.00 0.00 173.24 175.00 1oxa h ASP 10 N -1.03 0.00 0.42 7.02 5.19 -1.91 -2.22 116.42 123.90 1oxa h ASP 10 Ca -0.44 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 55.95 1oxa h ASP 10 Cb 1.24 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.75 1oxa h ASP 10 CO 0.50 0.00 -0.08 0.28 -3.12 0.00 0.00 179.24 176.82 1oxa h SER 11 N 0.00 0.00 -0.65 6.45 0.02 -1.91 0.18 113.55 117.64 1oxa h SER 11 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1oxa h SER 11 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1oxa h SER 11 CO 0.00 0.08 0.00 0.49 -1.14 0.00 0.00 176.83 176.26 1oxa n PHE 12 N -3.44 1.16 -1.11 3.45 3.72 -0.83 -4.09 117.46 116.32 1oxa n PHE 12 Ca -0.02 -0.51 0.00 0.00 -0.05 0.00 0.00 57.45 56.88 1oxa n PHE 12 Cb 0.22 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.64 1oxa n PHE 12 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1oxa n HIS 13 N 1.27 0.00 -3.71 1.38 8.25 -0.21 -4.78 115.22 117.42 1oxa n HIS 13 Ca 0.24 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.40 1oxa n HIS 13 Cb 0.71 0.01 -0.15 0.00 1.12 0.00 0.00 29.99 31.67 1oxa n HIS 13 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1oxa s VAL 14 N 0.00 0.65 -1.29 1.59 1.01 0.46 -4.77 120.40 118.06 1oxa s VAL 14 Ca 0.00 -1.07 -0.08 0.00 0.00 0.00 0.00 61.98 60.83 1oxa s VAL 14 Cb 0.00 -1.39 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1oxa s VAL 14 CO 0.00 -0.54 1.13 -0.67 0.00 0.00 0.00 175.10 175.01 1oxa n ASP 15 N 4.96 -6.04 0.16 3.32 -0.08 -1.26 -4.73 116.55 112.88 1oxa n ASP 15 Ca -0.05 -0.52 0.15 0.00 -1.51 0.00 0.00 54.79 52.86 1oxa n ASP 15 Cb 0.43 -4.83 0.72 0.00 2.34 0.00 0.00 41.12 39.78 1oxa n ASP 15 CO 0.00 0.00 0.00 4.11 0.12 0.00 0.00 177.20 181.43 1oxa h TRP 16 N -2.56 0.00 0.00 -0.67 0.09 -1.86 -1.13 115.95 109.82 1oxa h TRP 16 Ca -0.54 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.44 1oxa h TRP 16 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.59 1oxa h TRP 16 CO 0.47 0.00 0.00 0.66 0.09 0.00 0.00 178.44 179.66 1oxa n TYR 17 N -4.27 0.64 0.10 0.12 4.01 -1.26 -1.04 117.16 115.46 1oxa n TYR 17 Ca 0.02 0.26 -0.21 0.00 -0.16 0.00 0.00 57.90 57.81 1oxa n TYR 17 Cb 0.32 -0.92 -0.15 0.00 -0.31 0.00 0.00 39.34 38.28 1oxa n TYR 17 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1oxa h SER 18 N 0.00 0.62 -0.48 7.72 0.87 -1.57 -2.94 113.55 117.77 1oxa h SER 18 Ca 0.00 -0.77 -0.11 0.00 -1.23 0.00 0.00 61.79 59.68 1oxa h SER 18 Cb 0.30 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1oxa h SER 18 CO 0.00 1.63 -0.15 0.74 -0.53 0.00 0.00 176.83 178.51 1oxa h THR 19 N 0.11 1.27 -0.49 2.23 2.02 -1.30 -1.87 112.91 114.88 1oxa h THR 19 Ca -0.26 -1.30 -0.06 0.00 0.77 0.00 0.00 66.41 65.56 1oxa h THR 19 Cb 2.09 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 69.59 1oxa h THR 19 CO 0.21 0.45 0.05 1.88 0.37 0.00 0.00 175.52 178.48 1oxa h TYR 20 N 0.79 0.82 0.28 3.16 0.05 -1.20 -1.45 116.97 119.42 1oxa h TYR 20 Ca 0.12 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 1oxa h TYR 20 Cb 0.71 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.23 1oxa h TYR 20 CO 0.05 0.73 -0.13 0.00 -1.05 0.00 0.00 178.16 177.76 1oxa h ALA 21 N 1.31 -0.37 -0.78 3.88 0.00 -1.31 0.15 119.26 122.15 1oxa h ALA 21 Ca 0.15 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1oxa h ALA 21 Cb 0.38 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1oxa h ALA 21 CO 0.01 -0.67 0.47 0.93 0.00 0.00 0.00 179.25 180.00 1oxa h GLU 22 N -0.45 0.86 -0.41 0.00 3.07 -1.16 -2.30 114.58 114.19 1oxa h GLU 22 Ca -0.04 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.71 1oxa h GLU 22 Cb 0.34 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 1oxa h GLU 22 CO 0.06 0.57 0.03 -0.07 -1.40 0.00 0.00 179.01 178.20 1oxa h LEU 23 N 0.88 0.68 -0.24 1.33 3.38 -1.09 -3.02 115.31 117.22 1oxa h LEU 23 Ca 0.33 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 58.05 1oxa h LEU 23 Cb 0.13 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1oxa h LEU 23 CO -0.16 0.80 0.02 -0.09 0.09 0.00 0.00 178.44 179.10 1oxa h ARG 24 N 0.54 0.09 -0.03 1.13 2.43 -0.47 0.13 114.38 118.20 1oxa h ARG 24 Ca 0.12 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1oxa h ARG 24 Cb 0.43 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1oxa h ARG 24 CO 0.01 0.06 -0.26 1.05 -1.51 0.00 0.00 179.97 179.33 1oxa h GLU 25 N 0.10 0.05 0.17 0.20 4.11 -1.46 -3.03 114.58 114.72 1oxa h GLU 25 Ca 0.11 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.52 1oxa h GLU 25 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1oxa h GLU 25 CO -0.17 0.31 -0.08 1.15 0.07 0.00 0.00 179.01 180.28 1oxa h THR 26 N 0.04 0.58 -2.06 -1.06 2.02 -1.30 -3.46 112.91 107.67 1oxa h THR 26 Ca 0.01 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.10 1oxa h THR 26 Cb 0.48 1.00 -0.23 0.00 -1.74 0.00 0.00 68.15 67.66 1oxa h THR 26 CO 0.03 0.16 -0.25 0.00 0.37 0.00 0.00 175.52 175.83 1oxa s ALA 27 N -3.40 -1.70 0.43 6.16 0.00 0.40 -5.04 121.76 118.61 1oxa s ALA 27 Ca -0.10 1.90 0.36 0.00 0.00 0.00 0.00 51.96 54.12 1oxa s ALA 27 Cb 0.00 -1.66 1.83 0.00 0.00 0.00 0.00 23.12 23.29 1oxa s ALA 27 CO 0.35 -0.94 2.18 -1.35 0.00 0.00 0.00 175.76 176.00 1oxa h PRO 28 N 8.07 0.00 -4.00 0.00 0.11 -1.72 -3.37 132.00 131.10 1oxa h PRO 28 Ca -0.18 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.36 1oxa h PRO 28 Cb 1.11 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.83 1oxa h PRO 28 CO 0.14 0.03 -0.78 0.08 -0.21 0.00 0.00 178.00 177.27 1oxa s VAL 29 N -4.05 1.10 0.00 3.15 1.01 -1.26 -0.46 120.40 119.89 1oxa s VAL 29 Ca -0.03 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.02 1oxa s VAL 29 Cb 0.12 -1.49 -0.01 0.00 0.00 0.00 0.00 36.38 35.00 1oxa s VAL 29 CO 0.50 -0.17 -0.10 -0.89 0.00 0.00 0.00 175.10 174.44 1oxa s THR 30 N 1.59 0.76 0.45 3.92 2.01 -0.56 -4.97 115.64 118.85 1oxa s THR 30 Ca -0.03 -0.52 -0.22 0.00 0.31 0.00 0.00 61.69 61.23 1oxa s THR 30 Cb -0.18 -0.66 -0.08 0.00 0.01 0.00 0.00 72.50 71.59 1oxa s THR 30 CO -0.08 0.14 1.10 -2.16 -0.69 0.00 0.00 174.62 172.94 1oxa s PRO 31 N -0.42 3.86 0.29 4.92 0.04 -1.26 -0.50 135.00 141.93 1oxa s PRO 31 Ca 0.02 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.64 1oxa s PRO 31 Cb -0.05 -2.36 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 1oxa s PRO 31 CO -0.00 -0.42 0.37 0.14 0.04 0.00 0.00 177.00 177.12 1oxa s VAL 32 N -1.68 0.00 -0.05 -0.36 -7.23 0.17 -4.39 120.40 106.87 1oxa s VAL 32 Ca 0.63 -1.70 0.07 0.00 -1.81 0.00 0.00 61.98 59.17 1oxa s VAL 32 Cb -0.24 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.20 1oxa s VAL 32 CO 0.29 0.00 -0.25 -0.13 -0.31 0.00 0.00 175.10 174.70 1oxa s ARG 33 N -3.58 2.40 -0.22 4.82 1.81 0.39 -0.46 118.95 124.11 1oxa s ARG 33 Ca 0.32 -0.91 -0.11 0.00 -1.72 0.00 0.00 55.73 53.31 1oxa s ARG 33 Cb 0.02 -2.12 0.08 0.00 -0.45 0.00 0.00 34.95 32.47 1oxa s ARG 33 CO 0.17 0.44 0.53 0.12 -0.68 0.00 0.00 175.30 175.87 1oxa s PHE 34 N -0.31 -0.87 -1.35 -0.53 5.36 -0.30 -0.98 117.98 118.99 1oxa s PHE 34 Ca 0.01 1.72 -0.02 0.00 -0.96 0.00 0.00 56.93 57.68 1oxa s PHE 34 Cb -0.13 0.45 0.01 0.00 -0.34 0.00 0.00 43.02 43.02 1oxa s PHE 34 CO 0.02 -0.47 0.16 1.28 -1.46 0.00 0.00 175.22 174.75 1oxa n LEU 35 N 4.64 -1.64 0.00 6.12 4.32 -1.26 -1.54 117.00 127.64 1oxa n LEU 35 Ca -0.18 -0.01 0.00 0.00 -0.02 0.00 0.00 56.01 55.80 1oxa n LEU 35 Cb 0.54 -2.48 0.00 0.00 -1.62 0.00 0.00 43.42 39.87 1oxa n LEU 35 CO 0.02 -0.06 0.00 0.61 -1.22 0.00 0.00 177.39 176.74 1oxa n GLY 36 N -1.02 0.98 3.52 -0.72 0.00 -1.26 -5.05 105.19 101.63 1oxa n GLY 36 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 1oxa n GLY 36 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1oxa s GLN 37 N -0.42 1.85 -0.10 1.61 -2.07 -0.59 -5.12 119.66 114.82 1oxa s GLN 37 Ca 0.00 -1.68 -0.19 0.00 -1.82 0.00 0.00 55.36 51.66 1oxa s GLN 37 Cb 0.00 -1.87 -0.04 0.00 -1.09 0.00 0.00 33.01 30.01 1oxa s GLN 37 CO 0.00 0.33 0.53 -0.51 -1.32 0.00 0.00 175.29 174.33 1oxa s ASP 38 N -3.56 6.77 0.30 12.60 1.11 -1.26 -1.15 116.67 131.48 1oxa s ASP 38 Ca 0.31 0.93 0.05 0.00 0.18 0.00 0.00 52.55 54.01 1oxa s ASP 38 Cb -0.05 -2.32 -0.03 0.00 1.07 0.00 0.00 42.92 41.59 1oxa s ASP 38 CO 0.16 -0.01 0.24 0.00 1.18 0.00 0.00 175.17 176.74 1oxa s ALA 39 N 0.58 1.69 -0.16 5.23 0.00 0.39 -4.50 121.76 125.00 1oxa s ALA 39 Ca 0.29 -1.97 0.01 0.00 0.00 0.00 0.00 51.96 50.30 1oxa s ALA 39 Cb -0.16 1.45 0.02 0.00 0.00 0.00 0.00 23.12 24.42 1oxa s ALA 39 CO 0.13 -0.64 -0.19 -1.58 0.00 0.00 0.00 175.76 173.47 1oxa s TRP 40 N -3.63 2.60 -0.26 0.00 0.52 -0.63 0.43 118.94 117.97 1oxa s TRP 40 Ca 0.40 -1.45 -0.11 0.00 0.02 0.00 0.00 56.10 54.97 1oxa s TRP 40 Cb 0.04 -1.81 -0.05 0.00 -1.15 0.00 0.00 33.47 30.50 1oxa s TRP 40 CO 0.23 -0.71 0.17 -1.17 0.02 0.00 0.00 176.95 175.49 1oxa s LEU 41 N 1.17 4.07 -0.39 2.99 2.96 0.35 0.05 118.68 129.86 1oxa s LEU 41 Ca 0.01 0.06 -0.12 0.00 -0.22 0.00 0.00 54.13 53.85 1oxa s LEU 41 Cb -0.14 -2.11 0.03 0.00 0.50 0.00 0.00 46.19 44.48 1oxa s LEU 41 CO -0.09 0.02 0.25 -0.69 -1.32 0.00 0.00 176.35 174.52 1oxa s VAL 42 N 1.35 4.76 -0.11 1.68 1.01 -0.41 -1.49 120.40 127.20 1oxa s VAL 42 Ca 0.07 -0.87 0.20 0.00 0.00 0.00 0.00 61.98 61.39 1oxa s VAL 42 Cb -0.15 -3.69 -0.31 0.00 0.00 0.00 0.00 36.38 32.23 1oxa s VAL 42 CO 0.07 -0.30 0.48 0.35 0.00 0.00 0.00 175.10 175.71 1oxa n THR 43 N 5.05 0.00 -2.75 3.92 -2.24 0.39 -1.17 114.28 117.48 1oxa n THR 43 Ca -0.11 -0.43 -0.37 0.00 -2.27 0.00 0.00 64.05 60.87 1oxa n THR 43 Cb 0.46 0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.75 1oxa n THR 43 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1oxa s GLY 44 N -4.22 2.79 0.08 3.38 0.00 -1.19 -3.27 107.32 104.88 1oxa s GLY 44 Ca -0.06 0.55 -0.31 0.00 0.00 0.00 0.00 44.72 44.90 1oxa s GLY 44 CO 0.85 0.99 1.63 -1.82 0.00 0.00 0.00 173.10 174.75 1oxa h TYR 45 N 3.08 -0.78 -0.79 1.90 3.20 -1.90 0.21 116.97 121.90 1oxa h TYR 45 Ca -0.47 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.37 1oxa h TYR 45 Cb 1.19 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 39.71 1oxa h TYR 45 CO 0.61 -0.45 0.39 -0.44 -1.64 0.00 0.00 178.16 176.63 1oxa h ASP 46 N -0.73 1.01 -0.39 -2.11 3.32 -1.94 0.26 116.42 115.84 1oxa h ASP 46 Ca -0.05 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 56.81 1oxa h ASP 46 Cb 0.60 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1oxa h ASP 46 CO 0.05 0.85 -0.04 -0.33 -1.72 0.00 0.00 179.24 178.04 1oxa h GLU 47 N 1.12 0.72 -0.32 3.56 3.07 -1.92 0.01 114.58 120.82 1oxa h GLU 47 Ca 0.27 -0.25 -0.03 0.00 -0.50 0.00 0.00 59.36 58.85 1oxa h GLU 47 Cb 0.09 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1oxa h GLU 47 CO -0.04 0.84 0.06 0.00 -1.40 0.00 0.00 179.01 178.47 1oxa h ALA 48 N 0.86 0.42 -0.82 3.43 0.00 -0.22 0.01 119.26 122.94 1oxa h ALA 48 Ca 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1oxa h ALA 48 Cb 0.54 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1oxa h ALA 48 CO 0.03 0.10 0.35 -0.22 0.00 0.00 0.00 179.25 179.52 1oxa h LYS 49 N 0.36 1.21 -0.44 0.00 3.64 -0.89 -1.97 116.57 118.48 1oxa h LYS 49 Ca 0.10 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1oxa h LYS 49 Cb 0.32 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1oxa h LYS 49 CO 0.00 0.96 0.16 0.00 -2.27 0.00 0.00 179.45 178.30 1oxa h ALA 50 N 1.19 0.58 -0.75 5.00 0.00 -0.69 -2.62 119.26 121.97 1oxa h ALA 50 Ca 0.28 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1oxa h ALA 50 Cb 0.18 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1oxa h ALA 50 CO -0.03 0.21 0.29 0.00 0.00 0.00 0.00 179.25 179.72 1oxa h ALA 51 N 1.00 1.09 0.00 0.00 0.00 -0.68 -1.28 119.26 119.39 1oxa h ALA 51 Ca 0.14 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1oxa h ALA 51 Cb 0.23 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1oxa h ALA 51 CO -0.01 0.64 -0.40 -0.07 0.00 0.00 0.00 179.25 179.42 1oxa h LEU 52 N 1.10 0.00 0.00 0.00 3.38 -1.26 -2.64 115.31 115.88 1oxa h LEU 52 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1oxa h LEU 52 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1oxa h LEU 52 CO -0.02 0.40 -0.37 -1.20 0.09 0.00 0.00 178.44 177.34 1oxa n SER 53 N -3.88 0.42 -4.52 -0.43 7.64 -0.96 -4.76 113.62 107.13 1oxa n SER 53 Ca -0.01 0.05 -0.43 0.00 1.01 0.00 0.00 58.87 59.48 1oxa n SER 53 Cb 0.45 -0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.58 1oxa n SER 53 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1oxa s ASP 54 N -3.30 6.33 0.00 6.43 -1.08 -0.52 -4.93 116.67 119.61 1oxa s ASP 54 Ca 0.11 -0.33 0.20 0.00 -0.52 0.00 0.00 52.55 52.01 1oxa s ASP 54 Cb 0.17 -2.33 1.03 0.00 -1.46 0.00 0.00 42.92 40.33 1oxa s ASP 54 CO 0.66 -0.82 1.60 0.18 0.52 0.00 0.00 175.17 177.31 1oxa n LEU 55 N 6.36 0.00 0.22 -1.34 4.77 -1.26 -2.18 117.00 123.57 1oxa n LEU 55 Ca -0.01 0.22 0.15 0.00 -0.03 0.00 0.00 56.01 56.33 1oxa n LEU 55 Cb 0.48 -0.22 0.52 0.00 -2.33 0.00 0.00 43.42 41.87 1oxa n LEU 55 CO 0.55 -0.08 0.92 0.03 -1.33 0.00 0.00 177.39 177.48 1oxa h ARG 56 N 0.00 0.00 -4.75 3.23 3.08 -1.93 -3.36 114.38 110.65 1oxa h ARG 56 Ca 0.00 0.00 -0.70 0.00 0.07 0.00 0.00 59.98 59.35 1oxa h ARG 56 Cb 0.14 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 29.99 1oxa h ARG 56 CO 0.00 0.00 0.21 -0.51 -1.07 0.00 0.00 179.97 178.60 1oxa s LEU 57 N -5.72 5.32 0.72 3.04 1.43 -0.93 -1.36 118.68 121.19 1oxa s LEU 57 Ca 0.04 -1.49 -0.12 0.00 -1.03 0.00 0.00 54.13 51.53 1oxa s LEU 57 Cb 0.08 -2.32 0.03 0.00 0.03 0.00 0.00 46.19 44.02 1oxa s LEU 57 CO 0.55 -1.12 1.09 -0.55 0.23 0.00 0.00 176.35 176.54 1oxa s SER 58 N 3.57 4.90 0.00 2.29 0.15 0.13 -4.69 113.70 120.04 1oxa s SER 58 Ca 0.14 1.81 0.08 0.00 0.70 0.00 0.00 55.95 58.69 1oxa s SER 58 Cb -0.21 -2.52 0.04 0.00 -1.71 0.00 0.00 66.02 61.61 1oxa s SER 58 CO 0.05 -1.77 0.68 -1.20 1.20 0.00 0.00 173.24 172.20 1oxa n SER 59 N -3.12 1.44 -4.49 5.45 7.64 -1.26 -0.97 113.62 118.32 1oxa n SER 59 Ca 0.09 -1.22 -0.43 0.00 1.01 0.00 0.00 58.87 58.32 1oxa n SER 59 Cb 0.53 0.21 -0.09 0.00 -1.01 0.00 0.00 64.21 63.85 1oxa n SER 59 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1oxa s ASP 60 N -0.93 6.20 0.00 6.43 -1.08 -1.26 -4.24 116.67 121.78 1oxa s ASP 60 Ca 0.09 -0.65 0.28 0.00 -0.52 0.00 0.00 52.55 51.75 1oxa s ASP 60 Cb 0.07 -2.22 1.22 0.00 -1.46 0.00 0.00 42.92 40.52 1oxa s ASP 60 CO 0.15 -0.57 1.90 -0.81 0.52 0.00 0.00 175.17 176.36 1oxa n PRO 61 N 5.59 0.06 0.00 4.34 -0.04 -1.26 -3.32 135.00 140.37 1oxa n PRO 61 Ca -0.07 0.02 0.13 0.00 -0.04 0.00 0.00 63.50 63.54 1oxa n PRO 61 Cb 0.47 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.84 1oxa n PRO 61 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1oxa n LYS 62 N -1.47 0.20 -2.43 0.54 5.02 -1.26 -4.89 118.16 113.87 1oxa n LYS 62 Ca 0.08 -0.09 -0.40 0.00 -2.02 0.00 0.00 58.31 55.87 1oxa n LYS 62 Cb 0.31 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 1oxa n LYS 62 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1oxa s LYS 63 N -2.86 4.60 -0.12 1.97 1.02 -1.21 -5.03 119.74 118.11 1oxa s LYS 63 Ca 0.16 1.86 -0.03 0.00 0.02 0.00 0.00 55.97 57.97 1oxa s LYS 63 Cb 0.18 -3.18 -0.03 0.00 -0.52 0.00 0.00 37.83 34.28 1oxa s LYS 63 CO 0.60 0.15 0.01 0.15 -0.92 0.00 0.00 175.35 175.35 1oxa s LYS 64 N -1.42 3.31 0.15 1.68 -0.14 -1.26 -4.79 119.74 117.26 1oxa s LYS 64 Ca 0.45 -0.40 0.06 0.00 -1.36 0.00 0.00 55.97 54.72 1oxa s LYS 64 Cb -0.33 -2.91 -0.04 0.00 -1.68 0.00 0.00 37.83 32.87 1oxa s LYS 64 CO 0.42 0.55 -0.13 0.71 -0.76 0.00 0.00 175.35 176.14 1oxa s TYR 65 N -0.45 1.42 -0.12 3.18 2.02 -1.26 -5.10 117.35 117.04 1oxa s TYR 65 Ca 0.08 -0.63 -0.31 0.00 -0.37 0.00 0.00 57.07 55.85 1oxa s TYR 65 Cb -0.12 -0.72 -0.08 0.00 -0.40 0.00 0.00 41.96 40.64 1oxa s TYR 65 CO 0.02 0.17 2.07 -2.30 -1.57 0.00 0.00 175.55 173.94 1oxa n PRO 66 N 0.09 2.23 -2.04 -1.71 -0.02 -1.26 -2.51 135.00 129.78 1oxa n PRO 66 Ca -0.12 0.74 -0.20 0.00 -2.02 0.00 0.00 63.50 61.90 1oxa n PRO 66 Cb 0.59 -2.97 -0.04 0.00 -0.02 0.00 0.00 33.50 31.05 1oxa n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oxa n GLY 67 N 5.17 0.59 3.32 -1.23 0.00 -1.26 -4.97 105.19 106.80 1oxa n GLY 67 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.97 1oxa n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxa s VAL 68 N -2.88 2.14 -0.50 1.61 1.01 -1.04 -5.09 120.40 115.66 1oxa s VAL 68 Ca 0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 1oxa s VAL 68 Cb 0.00 -1.75 0.13 0.00 0.00 0.00 0.00 36.38 34.76 1oxa s VAL 68 CO 0.00 0.58 0.30 -1.61 0.00 0.00 0.00 175.10 174.37 1oxa s GLU 69 N -0.59 2.23 -0.02 2.72 0.41 -1.26 -4.52 118.70 117.66 1oxa s GLU 69 Ca 0.09 -2.10 -0.30 0.00 -0.41 0.00 0.00 54.97 52.25 1oxa s GLU 69 Cb -0.10 -3.65 -0.06 0.00 -1.78 0.00 0.00 34.13 28.54 1oxa s GLU 69 CO -0.01 -1.12 1.54 0.08 -0.49 0.00 0.00 175.26 175.27 1oxa s VAL 70 N 0.66 3.58 -0.29 2.63 1.01 -1.26 -4.99 120.40 121.74 1oxa s VAL 70 Ca 0.12 0.86 -0.03 0.00 0.00 0.00 0.00 61.98 62.93 1oxa s VAL 70 Cb -0.22 -3.56 0.10 0.00 0.00 0.00 0.00 36.38 32.70 1oxa s VAL 70 CO -0.04 -0.04 0.12 -0.70 0.00 0.00 0.00 175.10 174.44 1oxa s GLU 71 N 3.19 0.38 -0.07 2.72 2.56 -1.26 -5.03 118.70 121.20 1oxa s GLU 71 Ca 0.69 -0.71 -0.29 0.00 0.00 0.00 0.00 54.97 54.65 1oxa s GLU 71 Cb -0.33 -1.49 -0.02 0.00 2.00 0.00 0.00 34.13 34.30 1oxa s GLU 71 CO 0.28 -0.99 0.97 -0.06 -0.56 0.00 0.00 175.26 174.89 1oxa s PHE 72 N 1.92 3.57 0.65 5.30 0.40 -1.26 -4.94 117.98 123.62 1oxa s PHE 72 Ca 0.09 1.59 0.36 0.00 -0.60 0.00 0.00 56.93 58.37 1oxa s PHE 72 Cb -0.16 -3.13 1.97 0.00 0.51 0.00 0.00 43.02 42.20 1oxa s PHE 72 CO -0.32 -0.12 2.15 -1.00 0.70 0.00 0.00 175.22 176.62 1oxa h PRO 73 N 6.98 0.00 0.00 0.24 0.13 -1.99 -1.89 132.00 135.47 1oxa h PRO 73 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1oxa h PRO 73 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1oxa h PRO 73 CO 0.81 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.58 1oxa n ALA 74 N -2.07 1.86 -1.13 -0.56 0.00 -1.26 -2.38 120.51 114.97 1oxa n ALA 74 Ca -0.02 -0.01 -0.07 0.00 0.00 0.00 0.00 53.44 53.35 1oxa n ALA 74 Cb 0.24 -1.36 0.27 0.00 0.00 0.00 0.00 19.45 18.60 1oxa n ALA 74 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1oxa n TYR 75 N -1.88 2.17 -1.58 0.00 4.01 -0.71 -4.98 117.16 114.19 1oxa n TYR 75 Ca 0.04 -1.32 -0.50 0.00 -0.16 0.00 0.00 57.90 55.95 1oxa n TYR 75 Cb 0.26 -0.66 -0.06 0.00 -0.31 0.00 0.00 39.34 38.57 1oxa n TYR 75 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1oxa n LEU 76 N -0.50 2.74 0.00 7.72 0.00 -1.00 -1.14 117.00 124.82 1oxa n LEU 76 Ca 0.40 0.68 0.00 0.00 0.00 0.00 0.00 56.01 57.10 1oxa n LEU 76 Cb 1.32 -1.31 0.00 0.00 0.00 0.00 0.00 43.42 43.43 1oxa n LEU 76 CO 0.39 -0.45 0.00 0.61 0.00 0.00 0.00 177.39 177.95 1oxa n GLY 77 N 5.38 0.99 3.70 -3.96 0.00 -1.26 -4.51 105.19 105.54 1oxa n GLY 77 Ca 0.31 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.92 1oxa n GLY 77 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1oxa s PHE 78 N -3.42 3.59 0.80 1.61 0.40 -0.30 -3.80 117.98 116.86 1oxa s PHE 78 Ca 0.00 1.53 -0.11 0.00 -0.60 0.00 0.00 56.93 57.75 1oxa s PHE 78 Cb 0.00 -3.04 0.08 0.00 0.51 0.00 0.00 43.02 40.56 1oxa s PHE 78 CO 0.00 -0.04 1.11 -2.14 0.70 0.00 0.00 175.22 174.85 1oxa s PRO 79 N 1.22 1.97 0.26 0.24 0.02 -1.26 -4.73 135.00 132.71 1oxa s PRO 79 Ca 0.47 1.27 -0.04 0.00 0.02 0.00 0.00 61.00 62.72 1oxa s PRO 79 Cb -0.19 -1.86 0.36 0.00 0.02 0.00 0.00 34.50 32.83 1oxa s PRO 79 CO 0.22 -1.88 1.88 1.49 -0.33 0.00 0.00 177.00 178.39 1oxa h GLU 80 N -1.27 1.13 -0.54 5.54 4.81 -1.99 -0.82 114.58 121.45 1oxa h GLU 80 Ca -0.44 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1oxa h GLU 80 Cb 1.24 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 1oxa h GLU 80 CO 0.49 0.75 0.29 0.38 -0.73 0.00 0.00 179.01 180.19 1oxa h ASP 81 N 1.17 0.68 0.30 1.04 2.03 -2.00 -1.25 116.42 118.39 1oxa h ASP 81 Ca 0.41 -0.10 -0.20 0.00 -0.73 0.00 0.00 57.03 56.40 1oxa h ASP 81 Cb 0.10 -0.17 -0.00 0.00 -0.83 0.00 0.00 39.33 38.42 1oxa h ASP 81 CO -0.15 0.59 -0.82 -0.37 -1.03 0.00 0.00 179.24 177.45 1oxa h VAL 82 N 0.72 1.39 -0.43 4.15 -1.51 -1.86 -2.95 116.25 115.76 1oxa h VAL 82 Ca 0.19 -2.29 0.05 0.00 -1.23 0.00 0.00 66.70 63.42 1oxa h VAL 82 Cb 0.06 2.25 -0.05 0.00 -2.13 0.00 0.00 31.29 31.42 1oxa h VAL 82 CO -0.03 0.68 0.16 -0.09 -1.23 0.00 0.00 177.57 177.06 1oxa h ARG 83 N 0.25 0.32 0.00 5.19 1.12 -0.96 -0.55 114.38 119.75 1oxa h ARG 83 Ca -0.05 -0.02 -0.01 0.00 -1.11 0.00 0.00 59.98 58.79 1oxa h ARG 83 Cb 1.42 -0.07 -0.00 0.00 -0.01 0.00 0.00 29.97 31.31 1oxa h ARG 83 CO 0.14 0.21 -0.04 -0.91 -3.11 0.00 0.00 179.97 176.26 1oxa h ASN 84 N 0.33 0.00 0.90 -3.80 -0.26 -1.13 -0.47 115.58 111.14 1oxa h ASN 84 Ca 0.20 0.00 -0.14 0.00 -0.56 0.00 0.00 56.30 55.80 1oxa h ASN 84 Cb 0.18 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.42 1oxa h ASN 84 CO -0.20 0.04 -0.65 1.88 -1.06 0.00 0.00 177.43 177.45 1oxa h TYR 85 N 0.00 0.00 0.00 1.19 0.05 -0.97 -3.05 116.97 114.19 1oxa h TYR 85 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1oxa h TYR 85 Cb 0.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.81 1oxa h TYR 85 CO 0.00 0.65 -0.44 0.74 -1.05 0.00 0.00 178.16 178.05 1oxa h PHE 86 N 0.00 0.00 -0.69 4.88 -1.00 -0.33 -3.38 116.94 116.43 1oxa h PHE 86 Ca -0.01 0.00 -0.49 0.00 2.81 0.00 0.00 57.97 60.28 1oxa h PHE 86 Cb 1.27 0.00 -0.35 0.00 3.61 0.00 0.00 35.95 40.48 1oxa h PHE 86 CO 0.00 0.00 -0.53 0.00 -1.61 0.00 0.00 178.31 176.17 1oxa n ALA 87 N -2.13 5.02 -2.84 2.45 0.00 -0.31 -4.74 120.51 117.97 1oxa n ALA 87 Ca 0.02 -3.67 -0.19 0.00 0.00 0.00 0.00 53.44 49.60 1oxa n ALA 87 Cb 0.54 -0.54 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1oxa n ALA 87 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1oxa n THR 88 N -0.80 1.40 -4.22 0.00 -1.04 -1.20 -4.79 114.28 103.62 1oxa n THR 88 Ca 0.43 -4.46 -0.16 0.00 -2.04 0.00 0.00 64.05 57.83 1oxa n THR 88 Cb 0.91 -0.46 -0.08 0.00 -1.82 0.00 0.00 70.33 68.88 1oxa n THR 88 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1oxa s ASN 89 N -3.08 1.07 0.33 8.00 4.22 -1.26 -4.29 114.94 119.92 1oxa s ASN 89 Ca 0.40 -1.58 0.07 0.00 -2.14 0.00 0.00 52.86 49.61 1oxa s ASN 89 Cb 0.38 0.53 0.74 0.00 1.28 0.00 0.00 41.25 44.18 1oxa s ASN 89 CO -0.08 -1.04 1.85 0.00 -2.04 0.00 0.00 177.10 175.79 1oxa h MET 90 N 2.27 0.75 0.00 3.55 -0.00 -1.92 -1.97 114.93 117.61 1oxa h MET 90 Ca -0.28 -0.05 0.00 0.00 -0.00 0.00 0.00 59.70 59.37 1oxa h MET 90 Cb 1.24 -0.17 0.00 0.00 -0.00 0.00 0.00 31.60 32.67 1oxa h MET 90 CO 0.41 0.50 0.00 0.41 -0.00 0.00 0.00 176.91 178.23 1oxa n GLY 91 N -1.40 -1.13 1.53 -3.00 0.00 -1.26 -2.84 105.19 97.08 1oxa n GLY 91 Ca 0.18 -0.02 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 1oxa n GLY 91 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oxa n THR 92 N -1.71 1.99 -4.10 2.61 -2.24 -0.75 -4.83 114.28 105.25 1oxa n THR 92 Ca 0.04 -3.35 -0.09 0.00 -2.27 0.00 0.00 64.05 58.37 1oxa n THR 92 Cb 0.21 -0.28 -0.10 0.00 -2.10 0.00 0.00 70.33 68.05 1oxa n THR 92 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1oxa s SER 93 N -3.32 0.72 0.32 3.42 0.01 -1.13 -4.36 113.70 109.37 1oxa s SER 93 Ca 0.41 -0.89 0.10 0.00 1.31 0.00 0.00 55.95 56.89 1oxa s SER 93 Cb 0.38 0.13 -0.06 0.00 0.21 0.00 0.00 66.02 66.69 1oxa s SER 93 CO -0.03 -0.47 -0.12 -1.81 0.41 0.00 0.00 173.24 171.22 1oxa s ASP 94 N -2.62 3.77 0.67 2.44 1.01 -1.26 -4.64 116.67 116.04 1oxa s ASP 94 Ca 0.04 -1.08 -0.17 0.00 0.71 0.00 0.00 52.55 52.05 1oxa s ASP 94 Cb 0.03 -0.38 0.00 0.00 1.01 0.00 0.00 42.92 43.58 1oxa s ASP 94 CO -0.06 -0.11 1.21 -2.84 0.21 0.00 0.00 175.17 173.59 1oxa s PRO 95 N -3.59 2.53 0.00 8.23 0.02 -1.26 -0.97 135.00 139.97 1oxa s PRO 95 Ca 0.32 1.80 0.28 0.00 0.02 0.00 0.00 61.00 63.42 1oxa s PRO 95 Cb -0.01 -1.88 1.13 0.00 0.02 0.00 0.00 34.50 33.76 1oxa s PRO 95 CO 0.16 -1.54 1.80 -0.35 -0.33 0.00 0.00 177.00 176.75 1oxa n PRO 96 N -2.19 0.58 -0.22 5.54 -0.04 -1.26 -4.80 135.00 132.61 1oxa n PRO 96 Ca 0.14 -0.21 -0.07 0.00 -0.04 0.00 0.00 63.50 63.32 1oxa n PRO 96 Cb 0.50 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.50 1oxa n PRO 96 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1oxa h THR 97 N 0.52 1.20 -0.51 0.52 2.02 -1.77 -2.51 112.91 112.39 1oxa h THR 97 Ca 0.00 -0.54 0.02 0.00 0.77 0.00 0.00 66.41 66.66 1oxa h THR 97 Cb 0.39 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 1oxa h THR 97 CO 0.00 0.23 0.32 -0.74 0.37 0.00 0.00 175.52 175.69 1oxa h HIS 98 N 0.84 0.59 -0.22 3.16 -0.00 -1.32 -2.28 115.15 115.92 1oxa h HIS 98 Ca 0.22 0.02 0.06 0.00 -0.00 0.00 0.00 60.37 60.66 1oxa h HIS 98 Cb 0.07 -0.20 -0.06 0.00 -0.00 0.00 0.00 27.41 27.22 1oxa h HIS 98 CO -0.01 0.35 -0.21 1.15 -0.00 0.00 0.00 177.93 179.22 1oxa h THR 99 N 0.64 0.45 -0.22 6.26 2.02 -1.71 0.69 112.91 121.03 1oxa h THR 99 Ca 0.20 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.21 1oxa h THR 99 Cb -0.02 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1oxa h THR 99 CO -0.07 0.00 -0.53 0.08 0.37 0.00 0.00 175.52 175.37 1oxa h ARG 100 N -0.22 0.63 0.18 6.66 0.11 -1.39 -0.65 114.38 119.70 1oxa h ARG 100 Ca 0.13 -0.39 -0.01 0.00 0.10 0.00 0.00 59.98 59.81 1oxa h ARG 100 Cb 0.42 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1oxa h ARG 100 CO -0.35 1.00 -0.09 -0.07 0.10 0.00 0.00 179.97 180.56 1oxa h LEU 101 N 0.49 -0.20 -0.95 0.08 3.38 -1.11 0.29 115.31 117.29 1oxa h LEU 101 Ca 0.01 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1oxa h LEU 101 Cb 1.08 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 1oxa h LEU 101 CO 0.10 -0.12 0.21 -0.09 0.09 0.00 0.00 178.44 178.63 1oxa h ARG 102 N -0.27 0.98 0.15 1.13 2.43 -0.86 -1.98 114.38 115.97 1oxa h ARG 102 Ca -0.02 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 58.95 1oxa h ARG 102 Cb 0.21 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1oxa h ARG 102 CO 0.04 0.83 -0.07 -0.22 -1.51 0.00 0.00 179.97 179.04 1oxa h LYS 103 N 0.95 -0.19 -0.25 0.20 1.63 -0.76 -0.82 116.57 117.32 1oxa h LYS 103 Ca 0.21 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 60.05 1oxa h LYS 103 Cb 0.25 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 1oxa h LYS 103 CO -0.01 -0.11 0.10 -0.07 -3.45 0.00 0.00 179.45 175.91 1oxa h LEU 104 N -0.22 0.14 -0.46 5.20 -0.00 -0.77 -2.80 115.31 116.40 1oxa h LEU 104 Ca -0.02 0.02 -0.06 0.00 -0.00 0.00 0.00 57.88 57.81 1oxa h LEU 104 Cb 0.17 -0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 40.81 1oxa h LEU 104 CO 0.03 0.11 0.04 0.58 -0.00 0.00 0.00 178.44 179.20 1oxa h VAL 105 N 0.23 1.26 -0.20 1.22 2.07 -1.31 -2.86 116.25 116.65 1oxa h VAL 105 Ca 0.10 -0.98 0.06 0.00 0.82 0.00 0.00 66.70 66.70 1oxa h VAL 105 Cb 0.05 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1oxa h VAL 105 CO -0.09 0.34 0.17 0.28 0.02 0.00 0.00 177.57 178.30 1oxa h SER 106 N 0.65 0.00 0.08 0.57 0.02 -1.01 0.19 113.55 114.05 1oxa h SER 106 Ca 0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1oxa h SER 106 Cb 0.44 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.98 1oxa h SER 106 CO 0.02 0.00 -0.08 1.56 -1.14 0.00 0.00 176.83 177.18 1oxa h GLN 107 N 0.00 0.01 0.00 3.45 4.20 -1.25 -3.32 115.11 118.20 1oxa h GLN 107 Ca 0.10 -0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.59 1oxa h GLN 107 Cb 0.44 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.18 1oxa h GLN 107 CO -0.00 0.09 -1.79 0.39 -0.67 0.00 0.00 178.83 176.85 1oxa n GLU 108 N -4.44 0.34 -2.64 1.46 -0.58 -0.22 -4.77 120.64 109.80 1oxa n GLU 108 Ca -0.03 0.09 -0.43 0.00 -0.42 0.00 0.00 57.16 56.37 1oxa n GLU 108 Cb 0.16 -1.24 -0.01 0.00 -0.57 0.00 0.00 31.44 29.78 1oxa n GLU 108 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1oxa s PHE 109 N -2.27 2.83 0.43 -0.32 5.36 0.51 -4.84 117.98 119.68 1oxa s PHE 109 Ca -0.19 -1.51 0.07 0.00 -0.96 0.00 0.00 56.93 54.34 1oxa s PHE 109 Cb 0.05 -4.67 -0.02 0.00 -0.34 0.00 0.00 43.02 38.04 1oxa s PHE 109 CO 0.31 -1.77 0.34 0.95 -1.46 0.00 0.00 175.22 173.59 1oxa s THR 110 N 3.99 2.51 0.28 0.12 -4.23 -1.26 -4.65 115.64 112.40 1oxa s THR 110 Ca 0.50 -1.42 0.07 0.00 -1.18 0.00 0.00 61.69 59.66 1oxa s THR 110 Cb 0.02 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.94 1oxa s THR 110 CO 0.02 0.00 1.66 0.58 -0.54 0.00 0.00 174.62 176.35 1oxa h VAL 111 N 1.08 1.34 -0.28 2.29 2.07 -1.93 -2.49 116.25 118.34 1oxa h VAL 111 Ca -0.41 -1.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.40 1oxa h VAL 111 Cb 1.27 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 1oxa h VAL 111 CO 0.60 0.50 0.14 -0.09 0.02 0.00 0.00 177.57 178.74 1oxa h ARG 112 N 0.15 0.40 -0.60 1.57 2.43 -1.96 0.11 114.38 116.48 1oxa h ARG 112 Ca 0.01 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1oxa h ARG 112 Cb 0.91 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.36 1oxa h ARG 112 CO 0.07 0.37 0.24 -0.09 -1.51 0.00 0.00 179.97 179.06 1oxa h ARG 113 N 0.33 0.86 -0.20 0.20 2.43 -1.84 -0.60 114.38 115.56 1oxa h ARG 113 Ca 0.10 -0.13 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 1oxa h ARG 113 Cb 0.09 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1oxa h ARG 113 CO -0.01 0.70 -0.33 0.28 -1.51 0.00 0.00 179.97 179.10 1oxa h VAL 114 N 0.85 1.33 -0.40 0.20 2.07 -1.10 -3.12 116.25 116.09 1oxa h VAL 114 Ca 0.20 -1.55 -0.04 0.00 0.82 0.00 0.00 66.70 66.14 1oxa h VAL 114 Cb 0.16 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 1oxa h VAL 114 CO -0.02 0.48 0.07 -0.33 0.02 0.00 0.00 177.57 177.79 1oxa h GLU 115 N 0.26 0.60 0.00 1.57 4.39 -0.45 -1.28 114.58 119.67 1oxa h GLU 115 Ca 0.02 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1oxa h GLU 115 Cb 0.92 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1oxa h GLU 115 CO 0.08 0.57 0.00 0.00 -1.16 0.00 0.00 179.01 178.49 1oxa n ALA 116 N -2.47 1.56 0.45 3.43 0.00 -0.26 -1.92 120.51 121.30 1oxa n ALA 116 Ca 0.02 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.54 1oxa n ALA 116 Cb 0.21 -1.20 0.01 0.00 0.00 0.00 0.00 19.45 18.47 1oxa n ALA 116 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1oxa n MET 117 N -1.52 0.37 -0.13 0.00 2.81 -0.49 -4.56 117.12 113.61 1oxa n MET 117 Ca 0.03 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.84 1oxa n MET 117 Cb 0.15 -1.63 -0.03 0.00 -0.71 0.00 0.00 33.22 31.00 1oxa n MET 117 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 1oxa h ARG 118 N 0.00 -0.28 -0.46 0.03 2.43 -1.36 0.50 114.38 115.23 1oxa h ARG 118 Ca 0.00 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.24 1oxa h ARG 118 Cb 0.79 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.38 1oxa h ARG 118 CO 0.00 -0.19 0.31 -1.00 -1.51 0.00 0.00 179.97 177.58 1oxa h PRO 119 N -0.29 0.42 -0.18 0.20 0.13 -1.80 -0.03 132.00 130.45 1oxa h PRO 119 Ca 0.16 -0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 65.22 1oxa h PRO 119 Cb 0.56 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.59 1oxa h PRO 119 CO -0.56 0.28 -0.07 0.00 -0.23 0.00 0.00 178.00 177.42 1oxa h ARG 120 N 0.43 0.36 -0.71 0.86 2.47 -1.41 -0.18 114.38 116.20 1oxa h ARG 120 Ca 0.20 -0.15 0.02 0.00 -1.26 0.00 0.00 59.98 58.79 1oxa h ARG 120 Cb 0.23 -0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.50 1oxa h ARG 120 CO -0.05 0.65 0.45 0.28 0.56 0.00 0.00 179.97 181.86 1oxa h VAL 121 N 0.06 1.12 -0.47 2.04 2.07 -0.31 0.12 116.25 120.88 1oxa h VAL 121 Ca 0.04 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 1oxa h VAL 121 Cb 0.53 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1oxa h VAL 121 CO 0.02 0.16 0.01 -0.33 0.02 0.00 0.00 177.57 177.46 1oxa h GLU 122 N 0.90 0.76 -0.30 1.57 5.08 -0.91 -1.71 114.58 119.97 1oxa h GLU 122 Ca 0.28 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 1oxa h GLU 122 Cb -0.02 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1oxa h GLU 122 CO -0.09 0.77 -0.10 0.37 -1.00 0.00 0.00 179.01 178.96 1oxa h GLN 123 N 0.72 0.60 -0.73 2.33 4.15 0.32 -2.34 115.11 120.16 1oxa h GLN 123 Ca 0.14 -0.24 -0.06 0.00 0.77 0.00 0.00 58.65 59.26 1oxa h GLN 123 Cb 0.43 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.06 1oxa h GLN 123 CO 0.02 0.81 0.20 0.82 -1.93 0.00 0.00 178.83 178.74 1oxa h ILE 124 N 0.36 1.26 -0.19 2.39 2.04 -0.72 -2.36 117.51 120.29 1oxa h ILE 124 Ca 0.07 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1oxa h ILE 124 Cb 0.60 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1oxa h ILE 124 CO 0.03 0.37 0.12 0.74 0.00 0.00 0.00 178.15 179.41 1oxa h THR 125 N 1.09 1.04 -0.21 -0.27 2.02 -1.20 -1.91 112.91 113.46 1oxa h THR 125 Ca 0.23 -0.08 0.03 0.00 0.77 0.00 0.00 66.41 67.36 1oxa h THR 125 Cb 0.34 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1oxa h THR 125 CO -0.00 0.05 0.01 0.00 0.37 0.00 0.00 175.52 175.94 1oxa h ALA 126 N 1.07 0.20 -0.10 6.16 0.00 -1.28 -1.87 119.26 123.44 1oxa h ALA 126 Ca 0.07 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1oxa h ALA 126 Cb -0.02 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1oxa h ALA 126 CO -0.02 -0.42 -0.01 0.93 0.00 0.00 0.00 179.25 179.74 1oxa h GLU 127 N 0.08 0.03 -0.88 0.00 5.08 -1.24 0.10 114.58 117.76 1oxa h GLU 127 Ca 0.10 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 1oxa h GLU 127 Cb 0.12 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.31 1oxa h GLU 127 CO -0.16 0.02 0.57 -0.07 -1.00 0.00 0.00 179.01 178.37 1oxa h LEU 128 N 0.03 0.94 -1.23 1.33 3.38 -1.21 -0.32 115.31 118.23 1oxa h LEU 128 Ca 0.05 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 1oxa h LEU 128 Cb 0.06 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1oxa h LEU 128 CO -0.09 0.64 -0.37 -0.07 0.09 0.00 0.00 178.44 178.65 1oxa h LEU 129 N 1.10 0.00 -0.60 1.67 3.38 -0.83 -2.65 115.31 117.37 1oxa h LEU 129 Ca 0.35 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.27 1oxa h LEU 129 Cb 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1oxa h LEU 129 CO -0.12 0.37 0.18 0.44 0.09 0.00 0.00 178.44 179.40 1oxa h ASP 130 N 0.00 0.89 1.17 -0.43 3.32 0.91 -3.17 116.42 119.11 1oxa h ASP 130 Ca -0.00 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.81 1oxa h ASP 130 Cb 0.71 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 1oxa h ASP 130 CO 0.05 0.86 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.98 1oxa h GLU 131 N 0.86 0.00 0.00 3.56 5.08 -1.01 -3.22 114.58 119.86 1oxa h GLU 131 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1oxa h GLU 131 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1oxa h GLU 131 CO -0.00 0.12 0.00 -0.39 -1.00 0.00 0.00 179.01 177.73 1oxa h VAL 132 N 0.00 0.00 0.00 3.13 -1.51 -1.50 -3.50 116.25 112.87 1oxa h VAL 132 Ca -0.00 -0.61 0.00 0.00 -1.23 0.00 0.00 66.70 64.86 1oxa h VAL 132 Cb 0.74 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 31.47 1oxa h VAL 132 CO 0.02 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.97 1oxa n GLY 133 N 0.81 -0.23 0.75 5.19 0.00 -1.22 -4.73 105.19 105.75 1oxa n GLY 133 Ca 0.04 -1.75 -0.01 0.00 0.00 0.00 0.00 46.02 44.30 1oxa n GLY 133 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1oxa n ASP 134 N 0.12 -0.11 -3.54 1.61 5.68 -1.26 -4.90 116.55 114.15 1oxa n ASP 134 Ca 0.00 -1.59 -0.16 0.00 -0.50 0.00 0.00 54.79 52.55 1oxa n ASP 134 Cb 0.00 -0.01 -0.06 0.00 -1.14 0.00 0.00 41.12 39.91 1oxa n ASP 134 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1oxa s SER 135 N -0.71 -0.57 0.00 -1.12 1.04 -1.26 -4.12 113.70 106.95 1oxa s SER 135 Ca 0.04 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.09 1oxa s SER 135 Cb 0.05 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1oxa s SER 135 CO -0.02 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.28 1oxa n GLY 136 N 0.84 -1.88 3.87 7.32 0.00 -1.26 -4.81 105.19 109.27 1oxa n GLY 136 Ca -0.16 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.82 1oxa n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxa s VAL 137 N 0.00 5.36 0.07 1.61 1.01 -1.26 -1.48 120.40 125.71 1oxa s VAL 137 Ca 0.00 0.06 -0.06 0.00 0.00 0.00 0.00 61.98 61.98 1oxa s VAL 137 Cb 0.00 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 1oxa s VAL 137 CO 0.00 0.54 0.11 0.68 0.00 0.00 0.00 175.10 176.43 1oxa s VAL 138 N -1.09 0.16 -0.63 2.92 -7.23 -0.83 -4.98 120.40 108.72 1oxa s VAL 138 Ca 0.18 -1.33 -0.21 0.00 -1.81 0.00 0.00 61.98 58.81 1oxa s VAL 138 Cb -0.12 -1.29 0.08 0.00 0.56 0.00 0.00 36.38 35.61 1oxa s VAL 138 CO 0.08 -0.73 0.86 -0.62 -0.31 0.00 0.00 175.10 174.37 1oxa s ASP 139 N -2.71 6.18 0.54 4.85 -1.08 -1.26 -1.64 116.67 121.55 1oxa s ASP 139 Ca 0.03 -1.14 0.36 0.00 -0.52 0.00 0.00 52.55 51.28 1oxa s ASP 139 Cb 0.04 -2.37 1.81 0.00 -1.46 0.00 0.00 42.92 40.94 1oxa s ASP 139 CO -0.09 -1.30 2.09 -0.29 0.52 0.00 0.00 175.17 176.10 1oxa h ILE 140 N 5.95 0.00 0.07 4.11 6.09 -1.71 0.11 117.51 132.13 1oxa h ILE 140 Ca -0.29 -0.16 -0.00 0.00 -1.37 0.00 0.00 64.86 63.04 1oxa h ILE 140 Cb 1.08 1.04 0.00 0.00 0.47 0.00 0.00 36.82 39.41 1oxa h ILE 140 CO 1.14 0.00 -0.03 0.58 -3.07 0.00 0.00 178.15 176.77 1oxa h VAL 141 N 0.00 0.82 -0.65 2.19 2.07 -1.90 0.72 116.25 119.50 1oxa h VAL 141 Ca 0.00 -1.43 -0.03 0.00 0.82 0.00 0.00 66.70 66.05 1oxa h VAL 141 Cb 0.17 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1oxa h VAL 141 CO 0.00 0.26 0.27 -0.78 0.02 0.00 0.00 177.57 177.34 1oxa h ASP 142 N -0.96 0.88 1.30 0.57 3.58 -1.77 0.17 116.42 120.19 1oxa h ASP 142 Ca -0.01 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.28 1oxa h ASP 142 Cb 0.49 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.31 1oxa h ASP 142 CO 0.02 0.80 -0.28 0.03 -2.88 0.00 0.00 179.24 176.92 1oxa h ARG 143 N 0.90 0.00 0.00 0.28 2.47 -0.92 -3.39 114.38 113.72 1oxa h ARG 143 Ca 0.22 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.94 1oxa h ARG 143 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 1oxa h ARG 143 CO -0.02 0.00 0.00 0.34 0.56 0.00 0.00 179.97 180.85 1oxa n PHE 144 N -2.35 -1.49 -0.28 3.04 7.35 -0.56 -4.83 117.46 118.34 1oxa n PHE 144 Ca 0.04 0.27 0.15 0.00 -0.76 0.00 0.00 57.45 57.15 1oxa n PHE 144 Cb 0.45 0.82 0.42 0.00 0.35 0.00 0.00 39.48 41.53 1oxa n PHE 144 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1oxa h ALA 145 N 0.00 1.95 0.00 3.13 0.00 -0.78 -2.54 119.26 121.02 1oxa h ALA 145 Ca 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1oxa h ALA 145 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1oxa h ALA 145 CO 0.00 -0.24 -0.00 1.25 0.00 0.00 0.00 179.25 180.26 1oxa h HIS 146 N 0.59 -0.00 -0.97 0.00 -0.00 -0.89 -3.38 115.15 110.51 1oxa h HIS 146 Ca 0.49 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.89 1oxa h HIS 146 Cb 0.94 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 28.30 1oxa h HIS 146 CO -0.00 0.49 0.64 -1.35 -0.00 0.00 0.00 177.93 177.70 1oxa h PRO 147 N -1.00 1.19 0.15 5.26 0.11 -1.74 -3.16 132.00 132.81 1oxa h PRO 147 Ca -0.00 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1oxa h PRO 147 Cb 0.49 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 31.31 1oxa h PRO 147 CO 0.00 0.79 -0.33 1.25 -0.21 0.00 0.00 178.00 179.50 1oxa h LEU 148 N 1.23 -0.97 -1.38 2.35 6.46 -1.63 -0.00 115.31 121.36 1oxa h LEU 148 Ca 0.38 0.10 0.06 0.00 -0.12 0.00 0.00 57.88 58.29 1oxa h LEU 148 Cb -0.01 0.35 -0.04 0.00 -0.73 0.00 0.00 40.66 40.23 1oxa h LEU 148 CO -0.11 -0.37 0.47 -0.65 -0.62 0.00 0.00 178.44 177.15 1oxa h PRO 149 N -0.52 0.74 -0.32 5.25 0.11 -1.73 -1.67 132.00 133.86 1oxa h PRO 149 Ca -0.01 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.01 1oxa h PRO 149 Cb 0.50 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 1oxa h PRO 149 CO -0.14 0.49 0.02 0.82 -0.21 0.00 0.00 178.00 178.98 1oxa h ILE 150 N 0.76 1.25 -0.63 4.15 2.04 -1.45 -1.17 117.51 122.45 1oxa h ILE 150 Ca 0.30 -0.89 -0.06 0.00 1.00 0.00 0.00 64.86 65.21 1oxa h ILE 150 Cb 0.22 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 1oxa h ILE 150 CO -0.10 0.29 0.15 0.11 0.00 0.00 0.00 178.15 178.61 1oxa h LYS 151 N 0.36 1.01 0.11 2.37 1.57 -0.53 -1.30 116.57 120.15 1oxa h LYS 151 Ca 0.09 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1oxa h LYS 151 Cb 0.40 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1oxa h LYS 151 CO 0.01 0.92 -0.05 0.28 -0.57 0.00 0.00 179.45 180.04 1oxa h VAL 152 N 0.93 0.93 -0.33 0.50 2.07 -1.21 -2.22 116.25 116.92 1oxa h VAL 152 Ca 0.20 -0.11 -0.06 0.00 0.82 0.00 0.00 66.70 67.54 1oxa h VAL 152 Cb 0.36 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1oxa h VAL 152 CO 0.00 0.03 -0.06 -0.29 0.02 0.00 0.00 177.57 177.27 1oxa h ILE 153 N -0.19 1.22 -0.41 4.57 6.09 -1.12 -1.67 117.51 125.99 1oxa h ILE 153 Ca -0.01 -0.92 -0.08 0.00 -1.37 0.00 0.00 64.86 62.48 1oxa h ILE 153 Cb 0.15 1.04 -0.02 0.00 0.47 0.00 0.00 36.82 38.47 1oxa h ILE 153 CO 0.02 0.31 -0.06 0.00 -3.07 0.00 0.00 178.15 175.35 1oxa h GLU 155 N 0.64 0.67 -0.69 0.00 5.08 -0.94 0.35 114.58 119.70 1oxa h GLU 155 Ca 0.12 -0.53 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 1oxa h GLU 155 Cb 0.49 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.82 1oxa h GLU 155 CO 0.03 1.15 0.19 1.25 -1.00 0.00 0.00 179.01 180.63 1oxa h LEU 156 N 0.47 1.01 -0.53 1.33 6.46 -1.03 -3.17 115.31 119.85 1oxa h LEU 156 Ca -0.04 -0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.53 1oxa h LEU 156 Cb 1.34 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 41.00 1oxa h LEU 156 CO 0.14 0.96 -0.44 0.18 -0.62 0.00 0.00 178.44 178.66 1oxa n LEU 157 N -4.25 1.27 0.00 2.25 4.32 -0.08 -0.97 117.00 119.54 1oxa n LEU 157 Ca 0.05 -0.41 0.00 0.00 -0.02 0.00 0.00 56.01 55.64 1oxa n LEU 157 Cb 0.24 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1oxa n LEU 157 CO 0.42 0.25 0.00 0.61 -1.22 0.00 0.00 177.39 177.44 1oxa n GLY 158 N 1.40 0.47 3.63 -0.72 0.00 0.02 -4.35 105.19 105.65 1oxa n GLY 158 Ca 0.09 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.88 1oxa n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxa s VAL 159 N -2.00 4.60 0.81 1.61 1.01 0.10 -5.01 120.40 121.53 1oxa s VAL 159 Ca 0.00 1.55 -0.11 0.00 0.00 0.00 0.00 61.98 63.42 1oxa s VAL 159 Cb 0.00 -4.33 0.10 0.00 0.00 0.00 0.00 36.38 32.15 1oxa s VAL 159 CO 0.00 -0.41 1.17 -1.81 0.00 0.00 0.00 175.10 174.04 1oxa s ASP 160 N 1.65 4.29 0.13 3.32 1.01 -1.26 -4.48 116.67 121.33 1oxa s ASP 160 Ca 0.41 0.58 -0.32 0.00 0.71 0.00 0.00 52.55 53.93 1oxa s ASP 160 Cb -0.13 -1.02 -0.11 0.00 1.01 0.00 0.00 42.92 42.68 1oxa s ASP 160 CO 0.15 -2.00 1.54 -0.08 0.21 0.00 0.00 175.17 174.98 1oxa h GLU 161 N -1.06 -0.36 -4.79 8.23 4.81 -1.97 -3.19 114.58 116.23 1oxa h GLU 161 Ca -0.45 0.02 -0.58 0.00 -0.13 0.00 0.00 59.36 58.22 1oxa h GLU 161 Cb 1.31 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.77 1oxa h GLU 161 CO 0.59 -0.24 2.12 0.00 -0.73 0.00 0.00 179.01 180.74 1oxa n ALA 162 N -3.08 3.31 0.00 2.92 0.00 -1.26 -2.20 120.51 120.20 1oxa n ALA 162 Ca -0.03 -3.39 0.00 0.00 0.00 0.00 0.00 53.44 50.02 1oxa n ALA 162 Cb 0.33 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.20 1oxa n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oxa n ALA 163 N 9.09 0.00 -0.73 0.00 0.00 -1.21 -5.15 120.51 122.52 1oxa n ALA 163 Ca 0.49 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.64 1oxa n ALA 163 Cb 0.42 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.09 1oxa n ALA 163 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1oxa s ARG 164 N 0.00 -0.12 0.00 0.00 0.52 -0.94 -3.58 118.95 114.83 1oxa s ARG 164 Ca 0.00 0.95 0.00 0.00 -0.52 0.00 0.00 55.73 56.16 1oxa s ARG 164 Cb 0.00 -1.64 0.00 0.00 0.52 0.00 0.00 34.95 33.83 1oxa s ARG 164 CO 0.00 -3.22 0.00 0.41 0.02 0.00 0.00 175.30 172.51 1oxa n GLY 165 N 0.23 1.52 0.43 -3.53 0.00 -1.26 -4.66 105.19 97.92 1oxa n GLY 165 Ca 0.05 -0.02 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 1oxa n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oxa h ALA 166 N 0.00 -0.89 -0.06 4.61 0.00 -1.96 0.15 119.26 121.11 1oxa h ALA 166 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1oxa h ALA 166 Cb 0.00 0.93 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1oxa h ALA 166 CO 0.00 -1.04 0.26 0.27 0.00 0.00 0.00 179.25 178.74 1oxa h PHE 167 N -0.58 0.00 -0.26 0.00 -5.15 -1.83 -0.59 116.94 108.53 1oxa h PHE 167 Ca 0.02 0.00 0.03 0.00 -0.20 0.00 0.00 57.97 57.82 1oxa h PHE 167 Cb 0.64 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.78 1oxa h PHE 167 CO -0.52 0.00 0.06 0.78 -2.00 0.00 0.00 178.31 176.63 1oxa h GLY 168 N 0.00 0.30 1.73 6.09 0.00 -1.05 -0.59 103.07 109.54 1oxa h GLY 168 Ca 0.03 -0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1oxa h GLY 168 CO -0.00 0.00 -0.41 0.07 0.00 0.00 0.00 176.54 176.21 1oxa h ARG 169 N 0.16 0.30 0.21 4.80 0.11 -1.07 -2.88 114.38 116.02 1oxa h ARG 169 Ca 0.12 -0.14 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 1oxa h ARG 169 Cb 0.11 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.19 1oxa h ARG 169 CO -0.14 0.66 -0.10 -1.49 0.10 0.00 0.00 179.97 179.00 1oxa h TRP 170 N 0.25 -0.27 -0.88 4.08 6.55 -1.42 -3.07 115.95 121.20 1oxa h TRP 170 Ca 0.02 -0.01 0.15 0.00 0.95 0.00 0.00 58.89 60.01 1oxa h TRP 170 Cb 0.83 0.09 -0.07 0.00 -0.86 0.00 0.00 29.16 29.15 1oxa h TRP 170 CO 0.02 0.00 0.57 1.03 -1.05 0.00 0.00 178.44 179.01 1oxa h SER 171 N -0.51 0.61 -0.20 -3.49 0.87 -1.07 -0.89 113.55 108.87 1oxa h SER 171 Ca -0.03 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.60 1oxa h SER 171 Cb 0.39 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 1oxa h SER 171 CO 0.05 0.30 0.03 0.28 -0.53 0.00 0.00 176.83 176.96 1oxa h SER 172 N 0.64 -0.01 -0.75 6.23 0.02 -1.41 -1.77 113.55 116.50 1oxa h SER 172 Ca 0.44 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.46 1oxa h SER 172 Cb 0.77 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 63.32 1oxa h SER 172 CO -0.20 0.02 0.48 -0.33 -1.14 0.00 0.00 176.83 175.66 1oxa h GLU 173 N 0.11 0.91 0.00 3.45 4.39 -1.14 -2.26 114.58 120.04 1oxa h GLU 173 Ca 0.09 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.70 1oxa h GLU 173 Cb 0.10 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 1oxa h GLU 173 CO -0.13 0.60 -0.17 0.82 -1.16 0.00 0.00 179.01 178.97 1oxa h ILE 174 N 0.94 0.75 0.00 3.13 2.04 -0.99 -3.03 117.51 120.35 1oxa h ILE 174 Ca 0.30 -0.68 -0.04 0.00 1.00 0.00 0.00 64.86 65.43 1oxa h ILE 174 Cb -0.01 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1oxa h ILE 174 CO -0.10 0.17 -0.18 -0.07 0.00 0.00 0.00 178.15 177.96 1oxa h LEU 175 N 0.00 0.00 -9.36 1.44 3.38 -0.70 -3.43 115.31 106.64 1oxa h LEU 175 Ca -0.00 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.30 1oxa h LEU 175 Cb 0.40 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.01 1oxa h LEU 175 CO 0.02 0.18 -0.63 -0.69 0.09 0.00 0.00 178.44 177.41 1oxa s VAL 176 N -3.88 4.26 -0.76 1.22 1.01 -1.15 -4.56 120.40 116.53 1oxa s VAL 176 Ca -0.01 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1oxa s VAL 176 Cb 0.11 -2.87 0.19 0.00 0.00 0.00 0.00 36.38 33.81 1oxa s VAL 176 CO 0.61 0.45 0.59 -0.04 0.00 0.00 0.00 175.10 176.71 1oxa s MET 177 N -1.36 2.74 -0.32 2.72 -1.94 -1.26 -4.99 119.30 114.90 1oxa s MET 177 Ca 0.18 -3.26 -0.05 0.00 -1.71 0.00 0.00 55.69 50.85 1oxa s MET 177 Cb -0.11 -3.63 0.04 0.00 2.01 0.00 0.00 34.83 33.14 1oxa s MET 177 CO 0.08 -1.27 0.06 0.34 -0.01 0.00 0.00 175.02 174.22 1oxa s ASP 178 N -0.85 5.09 0.50 3.03 2.15 -1.26 -4.99 116.67 120.34 1oxa s ASP 178 Ca 0.25 -1.11 0.31 0.00 0.43 0.00 0.00 52.55 52.43 1oxa s ASP 178 Cb -0.07 -1.81 1.42 0.00 -0.30 0.00 0.00 42.92 42.16 1oxa s ASP 178 CO -0.14 -0.28 1.81 -0.65 -0.17 0.00 0.00 175.17 175.74 1oxa h PRO 179 N 8.14 0.10 -0.77 4.34 0.11 -1.99 0.11 132.00 142.04 1oxa h PRO 179 Ca -0.24 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 1oxa h PRO 179 Cb 1.08 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 1oxa h PRO 179 CO 0.58 0.07 0.44 0.93 -0.21 0.00 0.00 178.00 179.80 1oxa h GLU 180 N 0.11 1.07 -0.93 1.05 5.08 -2.03 -2.68 114.58 116.24 1oxa h GLU 180 Ca 0.55 -0.12 -0.41 0.00 -1.00 0.00 0.00 59.36 58.39 1oxa h GLU 180 Cb 1.97 -0.21 -0.24 0.00 0.50 0.00 0.00 28.75 30.77 1oxa h GLU 180 CO -0.09 0.78 0.52 0.54 -1.00 0.00 0.00 179.01 179.76 1oxa n ARG 181 N -4.45 2.62 -0.36 2.33 1.74 0.36 -4.64 116.66 114.25 1oxa n ARG 181 Ca 0.07 -2.88 0.02 0.00 -0.77 0.00 0.00 57.85 54.29 1oxa n ARG 181 Cb 0.08 -2.14 0.16 0.00 -1.02 0.00 0.00 32.46 29.54 1oxa n ARG 181 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1oxa h ALA 182 N 1.54 1.35 -0.12 7.54 0.00 -1.30 -0.57 119.26 127.69 1oxa h ALA 182 Ca 0.50 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.19 1oxa h ALA 182 Cb 2.64 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 20.12 1oxa h ALA 182 CO 0.95 0.45 -0.72 1.05 0.00 0.00 0.00 179.25 180.98 1oxa h GLU 183 N 1.17 0.56 -0.61 0.00 4.11 -1.85 -1.18 114.58 116.77 1oxa h GLU 183 Ca 0.42 -0.44 -0.07 0.00 0.07 0.00 0.00 59.36 59.33 1oxa h GLU 183 Cb 0.13 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1oxa h GLU 183 CO -0.16 1.07 0.09 1.96 0.07 0.00 0.00 179.01 182.04 1oxa h GLN 184 N 0.39 1.00 -0.16 1.06 7.50 -1.81 0.12 115.11 123.21 1oxa h GLN 184 Ca -0.03 -0.26 -0.01 0.00 0.50 0.00 0.00 58.65 58.85 1oxa h GLN 184 Cb 1.31 -0.12 -0.01 0.00 0.05 0.00 0.00 27.48 28.71 1oxa h GLN 184 CO 0.13 0.93 0.07 -0.09 -1.50 0.00 0.00 178.83 178.37 1oxa h ARG 185 N 0.94 0.23 -0.03 1.46 2.43 -0.99 -0.05 114.38 118.37 1oxa h ARG 185 Ca 0.19 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.29 1oxa h ARG 185 Cb 0.42 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 1oxa h ARG 185 CO 0.01 0.29 -0.12 0.78 -1.51 0.00 0.00 179.97 179.43 1oxa h GLY 186 N 0.11 0.05 0.62 2.80 0.00 -0.82 -1.61 103.07 104.21 1oxa h GLY 186 Ca 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.34 1oxa h GLY 186 CO -0.01 0.02 -0.03 -1.61 0.00 0.00 0.00 176.54 174.91 1oxa h GLN 187 N 0.04 0.11 -0.89 4.80 5.75 -0.03 -2.63 115.11 122.27 1oxa h GLN 187 Ca 0.01 -0.05 0.02 0.00 -0.15 0.00 0.00 58.65 58.48 1oxa h GLN 187 Cb 0.24 -0.00 -0.05 0.00 1.07 0.00 0.00 27.48 28.74 1oxa h GLN 187 CO 0.02 0.52 0.59 0.00 -2.65 0.00 0.00 178.83 177.31 1oxa h ALA 188 N 0.59 1.40 -0.58 3.38 0.00 -0.64 -2.26 119.26 121.14 1oxa h ALA 188 Ca 0.01 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1oxa h ALA 188 Cb 0.49 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1oxa h ALA 188 CO 0.01 0.54 0.37 0.00 0.00 0.00 0.00 179.25 180.17 1oxa h ALA 189 N 1.46 0.74 -0.29 0.00 0.00 -1.22 -1.80 119.26 118.16 1oxa h ALA 189 Ca 0.34 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 1oxa h ALA 189 Cb -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1oxa h ALA 189 CO -0.09 0.14 -0.08 -0.09 0.00 0.00 0.00 179.25 179.13 1oxa h ARG 190 N 0.75 0.47 -0.11 0.00 2.43 -1.05 -1.73 114.38 115.15 1oxa h ARG 190 Ca 0.22 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1oxa h ARG 190 Cb -0.05 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 1oxa h ARG 190 CO -0.06 0.57 0.06 0.93 -1.51 0.00 0.00 179.97 179.95 1oxa h GLU 191 N 0.45 0.16 -0.67 0.20 4.39 -0.81 -0.13 114.58 118.17 1oxa h GLU 191 Ca 0.09 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.71 1oxa h GLU 191 Cb 0.42 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 1oxa h GLU 191 CO 0.02 0.21 0.19 -0.39 -1.16 0.00 0.00 179.01 177.88 1oxa h VAL 192 N 0.07 1.25 -0.79 3.13 -1.51 -1.07 -0.48 116.25 116.84 1oxa h VAL 192 Ca 0.04 -0.89 -0.01 0.00 -1.23 0.00 0.00 66.70 64.60 1oxa h VAL 192 Cb 0.10 0.54 -0.04 0.00 -2.13 0.00 0.00 31.29 29.76 1oxa h VAL 192 CO -0.01 0.34 0.44 0.58 -1.23 0.00 0.00 177.57 177.70 1oxa h VAL 193 N 1.00 1.23 -0.13 7.19 2.07 -1.05 -0.12 116.25 126.44 1oxa h VAL 193 Ca 0.22 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 1oxa h VAL 193 Cb 0.32 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1oxa h VAL 193 CO -0.00 0.26 0.01 0.78 0.02 0.00 0.00 177.57 178.63 1oxa h ASN 194 N 1.10 0.22 -0.60 0.57 -0.26 -0.52 -1.82 115.58 114.28 1oxa h ASN 194 Ca 0.28 -0.29 0.08 0.00 -0.56 0.00 0.00 56.30 55.81 1oxa h ASN 194 Cb 0.02 -0.06 -0.07 0.00 -1.06 0.00 0.00 38.32 37.15 1oxa h ASN 194 CO -0.05 0.46 0.24 0.15 -1.06 0.00 0.00 177.43 177.18 1oxa h PHE 195 N -0.02 0.43 -0.57 1.19 3.57 -0.71 -2.23 116.94 118.60 1oxa h PHE 195 Ca 0.04 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.49 1oxa h PHE 195 Cb 0.34 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 1oxa h PHE 195 CO 0.03 0.14 0.04 0.82 -2.23 0.00 0.00 178.31 177.10 1oxa h ILE 196 N 0.44 1.26 -0.97 1.41 1.08 -0.93 -1.43 117.51 118.37 1oxa h ILE 196 Ca 0.29 -1.07 0.04 0.00 -0.39 0.00 0.00 64.86 63.73 1oxa h ILE 196 Cb 0.33 0.83 -0.06 0.00 -3.07 0.00 0.00 36.82 34.85 1oxa h ILE 196 CO -0.27 0.39 0.64 -0.07 -0.69 0.00 0.00 178.15 178.14 1oxa h LEU 197 N 0.87 1.05 -0.10 1.44 3.38 -0.80 0.10 115.31 121.25 1oxa h LEU 197 Ca 0.17 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1oxa h LEU 197 Cb 0.50 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1oxa h LEU 197 CO 0.02 0.71 -0.05 0.44 0.09 0.00 0.00 178.44 179.65 1oxa h ASP 198 N 1.21 0.21 -0.21 -0.43 5.19 -1.23 -1.84 116.42 119.32 1oxa h ASP 198 Ca 0.39 -0.42 0.06 0.00 -0.62 0.00 0.00 57.03 56.44 1oxa h ASP 198 Cb 0.04 -0.06 -0.06 0.00 0.18 0.00 0.00 39.33 39.43 1oxa h ASP 198 CO -0.13 0.59 -0.20 0.25 -3.12 0.00 0.00 179.24 176.63 1oxa h LEU 199 N -0.16 -0.65 -0.75 1.55 5.85 -0.70 -0.04 115.31 120.42 1oxa h LEU 199 Ca 0.02 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1oxa h LEU 199 Cb 0.51 0.31 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 1oxa h LEU 199 CO 0.02 -0.25 0.46 0.58 -0.34 0.00 0.00 178.44 178.91 1oxa h VAL 200 N -0.22 1.21 -0.14 1.05 2.07 -0.98 -0.75 116.25 118.49 1oxa h VAL 200 Ca 0.12 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1oxa h VAL 200 Cb 0.41 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1oxa h VAL 200 CO -0.33 0.22 0.03 -0.08 0.02 0.00 0.00 177.57 177.42 1oxa h GLU 201 N 1.02 0.23 0.00 1.57 4.81 -0.76 -1.46 114.58 119.99 1oxa h GLU 201 Ca 0.27 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.41 1oxa h GLU 201 Cb -0.04 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1oxa h GLU 201 CO -0.05 0.40 -0.17 0.00 -0.73 0.00 0.00 179.01 178.46 1oxa h ARG 202 N 0.02 0.00 0.00 1.92 3.08 -0.84 -1.65 114.38 116.91 1oxa h ARG 202 Ca 0.04 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.95 1oxa h ARG 202 Cb 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1oxa h ARG 202 CO 0.00 0.17 -0.66 -0.09 -1.07 0.00 0.00 179.97 178.32 1oxa h ARG 203 N 0.00 0.00 0.00 0.04 9.65 -0.74 -0.18 114.38 123.15 1oxa h ARG 203 Ca -0.00 0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 58.77 1oxa h ARG 203 Cb 0.35 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 1oxa h ARG 203 CO 0.02 0.66 -0.52 0.00 2.80 0.00 0.00 179.97 182.94 1oxa h ARG 204 N 0.00 0.00 0.08 0.20 3.08 -0.32 -3.10 114.38 114.32 1oxa h ARG 204 Ca -0.01 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.81 1oxa h ARG 204 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 1oxa h ARG 204 CO 0.09 0.52 -1.17 1.15 -1.07 0.00 0.00 179.97 179.48 1oxa h THR 205 N 0.00 1.14 -3.11 2.04 2.02 -1.34 -3.42 112.91 110.24 1oxa h THR 205 Ca -0.01 -2.37 -0.62 0.00 0.77 0.00 0.00 66.41 64.18 1oxa h THR 205 Cb 1.12 2.75 -0.42 0.00 -1.74 0.00 0.00 68.15 69.87 1oxa h THR 205 CO 0.07 0.63 -0.56 -0.70 0.37 0.00 0.00 175.52 175.32 1oxa s GLU 206 N -2.42 2.46 0.51 6.66 -6.30 -0.09 -5.10 118.70 114.42 1oxa s GLU 206 Ca -0.21 -3.31 -0.22 0.00 -2.50 0.00 0.00 54.97 48.74 1oxa s GLU 206 Cb 0.03 -3.43 -0.06 0.00 0.00 0.00 0.00 34.13 30.67 1oxa s GLU 206 CO 0.73 -1.28 1.24 -1.25 0.02 0.00 0.00 175.26 174.73 1oxa s PRO 207 N -1.39 3.40 0.00 4.30 0.04 -1.17 -4.66 135.00 135.51 1oxa s PRO 207 Ca 0.24 1.94 0.00 0.00 0.04 0.00 0.00 61.00 63.23 1oxa s PRO 207 Cb -0.06 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.22 1oxa s PRO 207 CO -0.16 -0.89 0.00 0.41 0.04 0.00 0.00 177.00 176.40 1oxa n GLY 208 N 0.55 5.56 0.02 0.56 0.00 -1.26 -5.05 105.19 105.56 1oxa n GLY 208 Ca 0.10 -1.44 0.11 0.00 0.00 0.00 0.00 46.02 44.79 1oxa n GLY 208 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oxa n ASP 209 N 0.00 0.64 -4.40 1.61 8.00 -1.26 -4.70 116.55 116.44 1oxa n ASP 209 Ca 0.00 -0.32 -0.32 0.00 0.71 0.00 0.00 54.79 54.86 1oxa n ASP 209 Cb 0.00 0.58 0.17 0.00 -0.02 0.00 0.00 41.12 41.85 1oxa n ASP 209 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1oxa n ASP 210 N -1.74 -1.88 -0.13 -2.24 5.75 -1.26 -4.79 116.55 110.26 1oxa n ASP 210 Ca 0.04 0.09 -0.03 0.00 -0.01 0.00 0.00 54.79 54.87 1oxa n ASP 210 Cb 0.38 -1.15 0.18 0.00 -1.03 0.00 0.00 41.12 39.50 1oxa n ASP 210 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1oxa h LEU 211 N -1.98 0.78 -0.63 -2.12 5.85 -1.35 -2.64 115.31 113.22 1oxa h LEU 211 Ca -0.50 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.03 1oxa h LEU 211 Cb 1.32 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 1oxa h LEU 211 CO 0.39 0.78 0.26 0.25 -0.34 0.00 0.00 178.44 179.78 1oxa h LEU 212 N 0.79 0.87 -0.32 2.25 5.85 -1.76 -0.09 115.31 122.91 1oxa h LEU 212 Ca 0.17 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1oxa h LEU 212 Cb 0.33 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1oxa h LEU 212 CO 0.00 0.80 0.16 0.28 -0.34 0.00 0.00 178.44 179.35 1oxa h SER 213 N 0.88 0.41 -0.78 1.25 0.02 -1.83 -2.06 113.55 111.45 1oxa h SER 213 Ca 0.21 -0.11 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1oxa h SER 213 Cb 0.20 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 1oxa h SER 213 CO -0.02 0.40 0.51 0.00 -1.14 0.00 0.00 176.83 176.59 1oxa h ALA 214 N 1.02 0.99 0.00 3.77 0.00 -1.12 -1.34 119.26 122.59 1oxa h ALA 214 Ca 0.11 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1oxa h ALA 214 Cb 0.09 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1oxa h ALA 214 CO -0.02 0.39 -0.01 -0.07 0.00 0.00 0.00 179.25 179.55 1oxa h LEU 215 N 1.05 0.00 -0.41 0.00 3.38 -0.74 -1.34 115.31 117.25 1oxa h LEU 215 Ca 0.29 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.07 1oxa h LEU 215 Cb -0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1oxa h LEU 215 CO -0.06 0.01 -0.76 0.40 0.09 0.00 0.00 178.44 178.12 1oxa h ILE 216 N 0.00 1.41 -0.01 1.22 2.04 -0.53 -3.29 117.51 118.35 1oxa h ILE 216 Ca -0.00 -2.26 0.00 0.00 1.00 0.00 0.00 64.86 63.60 1oxa h ILE 216 Cb 0.42 2.21 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 1oxa h ILE 216 CO 0.00 0.67 -0.53 -1.54 0.00 0.00 0.00 178.15 176.75 1oxa n SER 217 N -3.79 1.49 -4.76 1.72 3.41 -1.07 -4.96 113.62 105.66 1oxa n SER 217 Ca -0.04 -1.25 -0.41 0.00 -0.26 0.00 0.00 58.87 56.91 1oxa n SER 217 Cb 0.72 0.64 -0.01 0.00 -0.26 0.00 0.00 64.21 65.30 1oxa n SER 217 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1oxa s VAL 218 N -2.30 2.20 -0.06 -3.33 0.11 -0.53 -5.01 120.40 111.49 1oxa s VAL 218 Ca 0.13 0.18 -0.21 0.00 -2.93 0.00 0.00 61.98 59.15 1oxa s VAL 218 Cb 0.14 -3.12 0.04 0.00 -1.53 0.00 0.00 36.38 31.92 1oxa s VAL 218 CO 0.55 0.04 0.48 0.00 -3.33 0.00 0.00 175.10 172.84 1oxa s GLN 219 N -1.08 0.79 -0.07 1.54 -2.07 -1.26 -4.42 119.66 113.08 1oxa s GLN 219 Ca 0.58 0.16 0.03 0.00 -1.82 0.00 0.00 55.36 54.31 1oxa s GLN 219 Cb -0.46 0.37 0.01 0.00 -1.09 0.00 0.00 33.01 31.83 1oxa s GLN 219 CO 0.52 -0.21 -0.17 0.34 -1.32 0.00 0.00 175.29 174.46 1oxa s ASP 220 N -0.93 2.24 0.35 12.60 2.15 0.03 -4.98 116.67 128.13 1oxa s ASP 220 Ca -0.10 -0.39 0.16 0.00 0.43 0.00 0.00 52.55 52.66 1oxa s ASP 220 Cb -0.03 -0.96 1.19 0.00 -0.30 0.00 0.00 42.92 42.81 1oxa s ASP 220 CO 0.05 0.09 1.61 0.44 -0.17 0.00 0.00 175.17 177.19 1oxa h ASP 221 N 6.76 0.28 0.11 -0.34 3.32 -2.02 0.31 116.42 124.85 1oxa h ASP 221 Ca -0.28 0.24 -0.18 0.00 0.02 0.00 0.00 57.03 56.84 1oxa h ASP 221 Cb 1.20 0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.97 1oxa h ASP 221 CO 0.47 -0.33 -2.06 0.47 -1.72 0.00 0.00 179.24 176.07 1oxa n ASP 222 N -5.22 0.13 -0.25 6.45 8.00 -1.26 -4.51 116.55 119.89 1oxa n ASP 222 Ca 0.34 0.06 0.08 0.00 0.71 0.00 0.00 54.79 55.98 1oxa n ASP 222 Cb 1.12 1.30 -0.04 0.00 -0.02 0.00 0.00 41.12 43.49 1oxa n ASP 222 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1oxa n ASP 223 N -2.56 1.37 0.00 -2.24 8.00 -0.77 -5.09 116.55 115.26 1oxa n ASP 223 Ca -0.17 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.15 1oxa n ASP 223 Cb 0.85 0.67 0.00 0.00 -0.02 0.00 0.00 41.12 42.62 1oxa n ASP 223 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1oxa n GLY 224 N 1.28 1.36 3.27 0.44 0.00 0.10 -4.86 105.19 106.78 1oxa n GLY 224 Ca 0.06 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 1oxa n GLY 224 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1oxa s ARG 225 N 0.00 1.46 0.17 1.61 1.70 -1.26 -0.79 118.95 121.83 1oxa s ARG 225 Ca 0.00 -1.81 -0.30 0.00 -0.47 0.00 0.00 55.73 53.15 1oxa s ARG 225 Cb 0.00 0.12 -0.08 0.00 -0.57 0.00 0.00 34.95 34.42 1oxa s ARG 225 CO 0.00 -0.46 1.21 -0.51 -1.08 0.00 0.00 175.30 174.47 1oxa s LEU 226 N -3.29 4.43 0.85 -1.89 1.43 -1.26 -5.03 118.68 113.93 1oxa s LEU 226 Ca 0.38 2.22 -0.13 0.00 -1.03 0.00 0.00 54.13 55.57 1oxa s LEU 226 Cb 0.05 -3.60 0.11 0.00 0.03 0.00 0.00 46.19 42.78 1oxa s LEU 226 CO 0.17 -0.41 1.20 -0.94 0.23 0.00 0.00 176.35 176.60 1oxa s SER 227 N 0.32 4.09 0.19 2.29 1.04 -1.26 -4.76 113.70 115.61 1oxa s SER 227 Ca 0.54 0.72 -0.12 0.00 0.48 0.00 0.00 55.95 57.57 1oxa s SER 227 Cb -0.33 -1.14 0.17 0.00 0.10 0.00 0.00 66.02 64.83 1oxa s SER 227 CO 0.35 -2.16 1.79 0.00 0.98 0.00 0.00 173.24 174.20 1oxa h ALA 228 N -1.23 0.72 -0.03 5.32 0.00 -1.98 0.14 119.26 122.18 1oxa h ALA 228 Ca -0.46 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1oxa h ALA 228 Cb 1.31 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1oxa h ALA 228 CO 0.60 -0.07 0.01 -0.44 0.00 0.00 0.00 179.25 179.35 1oxa h ASP 229 N 0.53 0.05 -0.44 0.00 5.19 -1.97 0.59 116.42 120.37 1oxa h ASP 229 Ca 0.25 -0.22 0.03 0.00 -0.62 0.00 0.00 57.03 56.47 1oxa h ASP 229 Cb 0.17 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.64 1oxa h ASP 229 CO -0.18 0.25 0.24 -0.33 -3.12 0.00 0.00 179.24 176.11 1oxa h GLU 230 N -0.16 0.48 -0.51 3.56 5.08 -1.71 0.17 114.58 121.49 1oxa h GLU 230 Ca 0.01 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1oxa h GLU 230 Cb 0.22 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1oxa h GLU 230 CO -0.00 0.32 0.33 1.25 -1.00 0.00 0.00 179.01 179.91 1oxa h LEU 231 N 0.49 0.57 -0.55 1.33 7.12 -0.58 0.71 115.31 124.40 1oxa h LEU 231 Ca 0.18 -0.01 -0.07 0.00 0.13 0.00 0.00 57.88 58.11 1oxa h LEU 231 Cb 0.04 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.02 1oxa h LEU 231 CO -0.10 0.41 0.07 0.74 -0.13 0.00 0.00 178.44 179.43 1oxa h THR 232 N 0.68 1.26 -0.23 1.05 2.02 -0.30 -1.50 112.91 115.89 1oxa h THR 232 Ca 0.19 -0.99 -0.17 0.00 0.77 0.00 0.00 66.41 66.20 1oxa h THR 232 Cb -0.06 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1oxa h THR 232 CO -0.05 0.36 -0.54 -1.28 0.37 0.00 0.00 175.52 174.38 1oxa h SER 233 N 0.82 0.87 -0.47 4.18 0.87 -0.27 -2.27 113.55 117.27 1oxa h SER 233 Ca 0.17 -0.56 -0.02 0.00 -1.23 0.00 0.00 61.79 60.14 1oxa h SER 233 Cb 0.43 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 1oxa h SER 233 CO 0.01 1.27 0.20 0.40 -0.53 0.00 0.00 176.83 178.19 1oxa h ILE 234 N 0.50 1.20 -0.38 2.23 2.04 -0.82 -1.20 117.51 121.08 1oxa h ILE 234 Ca -0.00 -0.60 0.05 0.00 1.00 0.00 0.00 64.86 65.30 1oxa h ILE 234 Cb 1.15 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 1oxa h ILE 234 CO 0.12 0.23 0.13 0.00 0.00 0.00 0.00 178.15 178.62 1oxa h ALA 235 N 1.05 0.44 -0.17 1.87 0.00 -1.23 0.11 119.26 121.32 1oxa h ALA 235 Ca 0.16 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1oxa h ALA 235 Cb 0.16 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1oxa h ALA 235 CO -0.02 -0.26 0.04 1.25 0.00 0.00 0.00 179.25 180.27 1oxa h LEU 236 N 0.28 0.03 -0.71 0.00 7.12 -1.03 -1.34 115.31 119.66 1oxa h LEU 236 Ca 0.17 0.02 -0.13 0.00 0.13 0.00 0.00 57.88 58.07 1oxa h LEU 236 Cb 0.16 0.02 -0.01 0.00 -0.53 0.00 0.00 40.66 40.30 1oxa h LEU 236 CO -0.18 0.05 -0.49 1.62 -0.13 0.00 0.00 178.44 179.31 1oxa h VAL 237 N 0.12 1.33 -0.67 1.05 3.04 -0.90 -2.31 116.25 117.90 1oxa h VAL 237 Ca 0.08 -1.71 -0.07 0.00 -1.01 0.00 0.00 66.70 63.98 1oxa h VAL 237 Cb 0.06 1.75 -0.03 0.00 -2.01 0.00 0.00 31.29 31.06 1oxa h VAL 237 CO -0.09 0.52 0.13 -0.07 -1.01 0.00 0.00 177.57 177.05 1oxa h LEU 238 N 0.31 1.05 0.71 3.16 3.38 -0.52 0.14 115.31 123.54 1oxa h LEU 238 Ca 0.02 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 1oxa h LEU 238 Cb 0.97 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.45 1oxa h LEU 238 CO 0.08 1.03 -0.34 0.25 0.09 0.00 0.00 178.44 179.55 1oxa h LEU 239 N 1.03 -0.81 0.23 1.67 5.85 -1.12 0.38 115.31 122.54 1oxa h LEU 239 Ca 0.21 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 1oxa h LEU 239 Cb 0.41 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1oxa h LEU 239 CO 0.01 -0.47 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.46 1oxa h LEU 240 N -1.14 -0.26 -1.35 2.25 4.07 -1.39 -2.89 115.31 114.61 1oxa h LEU 240 Ca -0.10 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 57.74 1oxa h LEU 240 Cb 0.76 0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.56 1oxa h LEU 240 CO 0.16 -0.05 -0.06 0.00 -1.08 0.00 0.00 178.44 177.41 1oxa h ALA 241 N 0.28 1.01 0.00 1.53 0.00 -0.83 -2.72 119.26 118.53 1oxa h ALA 241 Ca -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1oxa h ALA 241 Cb 0.35 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1oxa h ALA 241 CO 0.05 0.07 -0.03 0.78 0.00 0.00 0.00 179.25 180.12 1oxa h GLY 242 N 2.08 0.00 0.00 0.00 0.00 -0.69 -3.38 103.07 101.07 1oxa h GLY 242 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1oxa h GLY 242 CO 0.01 0.00 -0.74 1.97 0.00 0.00 0.00 176.54 177.78 1oxa n PHE 243 N -3.16 0.00 -0.05 5.60 1.16 -1.17 -4.78 117.46 115.06 1oxa n PHE 243 Ca -0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.50 1oxa n PHE 243 Cb 0.28 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.14 1oxa n PHE 243 CO 0.00 0.00 0.00 0.93 -1.87 0.00 0.00 176.76 175.82 1oxa h GLU 244 N 0.00 -0.06 -0.03 3.97 4.39 -1.66 -1.00 114.58 120.19 1oxa h GLU 244 Ca 0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1oxa h GLU 244 Cb 0.74 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 1oxa h GLU 244 CO 0.00 -0.04 -0.35 0.00 -1.16 0.00 0.00 179.01 177.46 1oxa h ALA 245 N 1.15 1.36 -0.12 3.43 0.00 -1.83 -2.48 119.26 120.77 1oxa h ALA 245 Ca 0.12 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.56 1oxa h ALA 245 Cb 0.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1oxa h ALA 245 CO -0.28 0.47 -0.52 0.77 0.00 0.00 0.00 179.25 179.69 1oxa h SER 246 N 0.06 0.36 -0.34 0.00 0.02 -1.70 -0.95 113.55 111.00 1oxa h SER 246 Ca 0.01 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.75 1oxa h SER 246 Cb 0.65 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.07 1oxa h SER 246 CO 0.05 0.82 0.13 0.58 -1.14 0.00 0.00 176.83 177.27 1oxa h VAL 247 N 0.26 1.19 -0.49 2.27 2.07 -0.77 -1.60 116.25 119.17 1oxa h VAL 247 Ca 0.01 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1oxa h VAL 247 Cb 1.00 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 1oxa h VAL 247 CO 0.09 0.20 0.30 0.28 0.02 0.00 0.00 177.57 178.46 1oxa h SER 248 N 0.40 0.58 -0.08 0.57 0.02 -1.18 -1.09 113.55 112.78 1oxa h SER 248 Ca 0.11 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 1oxa h SER 248 Cb 0.19 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 1oxa h SER 248 CO -0.01 0.46 -0.09 0.25 -1.14 0.00 0.00 176.83 176.30 1oxa h LEU 249 N 0.66 -0.27 0.04 5.07 5.85 -0.88 0.15 115.31 125.92 1oxa h LEU 249 Ca 0.18 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 1oxa h LEU 249 Cb -0.02 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1oxa h LEU 249 CO -0.03 -0.12 -0.02 0.40 -0.34 0.00 0.00 178.44 178.33 1oxa h ILE 250 N -0.12 1.06 -0.49 4.05 2.04 -1.17 0.17 117.51 123.06 1oxa h ILE 250 Ca 0.06 -0.31 -0.07 0.00 1.00 0.00 0.00 64.86 65.55 1oxa h ILE 250 Cb 0.20 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 1oxa h ILE 250 CO -0.15 0.08 0.05 1.23 0.00 0.00 0.00 178.15 179.37 1oxa h GLY 251 N -0.19 0.90 0.94 5.37 0.00 -1.11 0.22 103.07 109.21 1oxa h GLY 251 Ca -0.01 -0.62 -0.12 0.00 0.00 0.00 0.00 47.33 46.58 1oxa h GLY 251 CO 0.01 0.58 -0.30 -2.22 0.00 0.00 0.00 176.54 174.60 1oxa h ILE 252 N 0.71 1.31 -0.99 2.60 2.04 -0.74 -2.37 117.51 120.07 1oxa h ILE 252 Ca 0.15 -1.48 0.05 0.00 1.00 0.00 0.00 64.86 64.58 1oxa h ILE 252 Cb 0.44 1.67 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 1oxa h ILE 252 CO 0.01 0.47 0.65 1.23 0.00 0.00 0.00 178.15 180.51 1oxa h GLY 253 N 0.37 1.48 0.97 5.37 0.00 -0.49 0.21 103.07 110.98 1oxa h GLY 253 Ca 0.03 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 1oxa h GLY 253 CO 0.07 0.37 -0.09 -0.84 0.00 0.00 0.00 176.54 176.06 1oxa h THR 254 N 1.20 1.27 -0.82 4.70 2.02 -0.87 -2.29 112.91 118.12 1oxa h THR 254 Ca 0.42 -1.17 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 1oxa h THR 254 Cb 0.11 1.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 1oxa h THR 254 CO -0.15 0.39 0.40 0.22 0.37 0.00 0.00 175.52 176.74 1oxa h TYR 255 N 0.57 1.18 -0.13 3.16 3.20 -0.81 -1.89 116.97 122.24 1oxa h TYR 255 Ca 0.10 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 1oxa h TYR 255 Cb 0.60 -0.37 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 1oxa h TYR 255 CO 0.05 0.85 -0.05 -0.07 -1.64 0.00 0.00 178.16 177.30 1oxa h LEU 256 N 1.16 0.27 -0.70 2.82 3.38 -0.89 -1.47 115.31 119.88 1oxa h LEU 256 Ca 0.28 -0.40 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 1oxa h LEU 256 Cb 0.12 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1oxa h LEU 256 CO -0.04 0.61 0.11 -0.07 0.09 0.00 0.00 178.44 179.15 1oxa h LEU 257 N -0.07 1.06 -0.54 1.67 3.38 -1.39 -0.26 115.31 119.15 1oxa h LEU 257 Ca 0.03 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1oxa h LEU 257 Cb 0.51 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1oxa h LEU 257 CO 0.02 1.05 0.33 -0.07 0.09 0.00 0.00 178.44 179.86 1oxa h LEU 258 N 1.04 0.64 -0.00 1.67 4.07 -1.35 -2.53 115.31 118.85 1oxa h LEU 258 Ca 0.21 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1oxa h LEU 258 Cb 0.44 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.01 1oxa h LEU 258 CO 0.01 0.50 -0.02 0.35 -1.08 0.00 0.00 178.44 178.20 1oxa n THR 259 N -4.67 0.00 -3.52 0.22 -2.24 -0.56 -4.17 114.28 99.34 1oxa n THR 259 Ca 0.03 -0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.54 1oxa n THR 259 Cb 0.05 -0.46 -0.09 0.00 -2.10 0.00 0.00 70.33 67.72 1oxa n THR 259 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1oxa n HIS 260 N -1.45 2.31 -0.26 4.78 8.25 -0.14 -4.96 115.22 123.74 1oxa n HIS 260 Ca 0.08 -4.00 0.03 0.00 -0.26 0.00 0.00 57.72 53.57 1oxa n HIS 260 Cb 0.32 -0.44 0.11 0.00 1.12 0.00 0.00 29.99 31.10 1oxa n HIS 260 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1oxa h PRO 261 N 4.68 0.02 -0.83 -0.41 0.11 -1.72 0.21 132.00 134.07 1oxa h PRO 261 Ca 0.17 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.38 1oxa h PRO 261 Cb 0.75 -0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.79 1oxa h PRO 261 CO 0.68 0.01 0.47 0.38 -0.21 0.00 0.00 178.00 179.33 1oxa h ASP 262 N 0.02 0.66 -0.08 -2.05 2.03 -1.93 0.47 116.42 115.54 1oxa h ASP 262 Ca 0.38 0.05 -0.22 0.00 -0.73 0.00 0.00 57.03 56.51 1oxa h ASP 262 Cb 0.61 -0.07 0.01 0.00 -0.83 0.00 0.00 39.33 39.05 1oxa h ASP 262 CO -0.76 0.37 -0.79 1.56 -1.03 0.00 0.00 179.24 178.58 1oxa h GLN 263 N 0.77 0.73 -0.53 4.15 1.08 -1.00 -2.78 115.11 117.54 1oxa h GLN 263 Ca 0.40 -0.61 -0.03 0.00 -1.45 0.00 0.00 58.65 56.96 1oxa h GLN 263 Cb 0.40 0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.93 1oxa h GLN 263 CO -0.26 1.22 0.20 1.25 -0.95 0.00 0.00 178.83 180.29 1oxa h LEU 264 N 0.50 0.74 -0.84 1.46 5.85 -0.54 -2.25 115.31 120.22 1oxa h LEU 264 Ca -0.05 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.50 1oxa h LEU 264 Cb 1.41 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 1oxa h LEU 264 CO 0.16 0.72 0.55 0.00 -0.34 0.00 0.00 178.44 179.53 1oxa h ALA 265 N 1.05 1.08 -0.61 1.25 0.00 -0.94 -0.41 119.26 120.68 1oxa h ALA 265 Ca 0.17 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1oxa h ALA 265 Cb 0.22 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1oxa h ALA 265 CO -0.01 0.44 0.34 1.25 0.00 0.00 0.00 179.25 181.27 1oxa h LEU 266 N 1.11 0.51 -0.38 0.00 7.12 -1.18 -0.05 115.31 122.45 1oxa h LEU 266 Ca 0.32 0.02 -0.09 0.00 0.13 0.00 0.00 57.88 58.26 1oxa h LEU 266 Cb -0.09 -0.08 -0.01 0.00 -0.53 0.00 0.00 40.66 39.96 1oxa h LEU 266 CO -0.08 0.34 -0.12 0.58 -0.13 0.00 0.00 178.44 179.03 1oxa h VAL 267 N 0.65 1.28 -0.52 1.05 2.07 -0.80 -0.79 116.25 119.18 1oxa h VAL 267 Ca 0.27 -1.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1oxa h VAL 267 Cb 0.14 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1oxa h VAL 267 CO -0.16 0.41 0.32 0.03 0.02 0.00 0.00 177.57 178.18 1oxa h ARG 268 N 0.55 0.70 -0.32 1.57 3.08 -0.56 -2.99 114.38 116.41 1oxa h ARG 268 Ca 0.09 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.00 1oxa h ARG 268 Cb 0.65 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1oxa h ARG 268 CO 0.04 0.50 -0.13 0.00 -1.07 0.00 0.00 179.97 179.32 1oxa h ALA 269 N 1.16 0.44 -3.52 0.04 0.00 -0.97 -3.39 119.26 113.02 1oxa h ALA 269 Ca 0.19 -0.32 -0.64 0.00 0.00 0.00 0.00 54.91 54.13 1oxa h ALA 269 Cb -0.02 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 17.26 1oxa h ALA 269 CO -0.04 0.32 -0.71 0.34 0.00 0.00 0.00 179.25 179.16 1oxa s ASP 270 N -6.31 4.52 0.57 0.00 2.15 -0.31 -4.96 116.67 112.33 1oxa s ASP 270 Ca -0.13 -2.21 0.33 0.00 0.43 0.00 0.00 52.55 50.97 1oxa s ASP 270 Cb 0.09 -1.47 1.73 0.00 -0.30 0.00 0.00 42.92 42.97 1oxa s ASP 270 CO 0.80 -0.36 2.15 -0.65 -0.17 0.00 0.00 175.17 176.94 1oxa h PRO 271 N 7.49 0.00 0.00 4.34 0.11 -1.75 -0.96 132.00 141.23 1oxa h PRO 271 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1oxa h PRO 271 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1oxa h PRO 271 CO 0.53 0.06 0.00 -1.13 -0.21 0.00 0.00 178.00 177.25 1oxa n SER 272 N -3.42 0.00 -0.59 -2.05 3.41 -1.26 -2.09 113.62 107.62 1oxa n SER 272 Ca -0.02 0.30 0.13 0.00 -0.26 0.00 0.00 58.87 59.02 1oxa n SER 272 Cb 0.19 -0.42 0.42 0.00 -0.26 0.00 0.00 64.21 64.15 1oxa n SER 272 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1oxa n ALA 273 N -1.42 2.54 -0.03 7.33 0.00 -0.36 -4.28 120.51 124.28 1oxa n ALA 273 Ca 0.07 -0.52 -0.14 0.00 0.00 0.00 0.00 53.44 52.85 1oxa n ALA 273 Cb 0.23 -1.09 -0.09 0.00 0.00 0.00 0.00 19.45 18.49 1oxa n ALA 273 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1oxa h LEU 274 N 2.73 0.27 -0.91 0.00 5.85 -1.55 -2.58 115.31 119.12 1oxa h LEU 274 Ca 0.00 -0.61 0.14 0.00 0.84 0.00 0.00 57.88 58.24 1oxa h LEU 274 Cb 0.58 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.44 1oxa h LEU 274 CO 0.00 0.84 0.52 -0.65 -0.34 0.00 0.00 178.44 178.81 1oxa h PRO 275 N -0.28 0.75 0.00 5.25 0.11 -1.79 0.53 132.00 136.57 1oxa h PRO 275 Ca -0.01 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.98 1oxa h PRO 275 Cb 0.81 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.74 1oxa h PRO 275 CO 0.04 0.50 -0.38 -0.97 -0.21 0.00 0.00 178.00 176.97 1oxa h ASN 276 N 0.77 0.00 -0.38 -2.05 -1.24 -1.83 -2.54 115.58 108.31 1oxa h ASN 276 Ca 0.48 0.00 -0.14 0.00 0.71 0.00 0.00 56.30 57.35 1oxa h ASN 276 Cb 0.60 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.64 1oxa h ASN 276 CO -0.32 0.38 -0.28 0.00 -1.29 0.00 0.00 177.43 175.92 1oxa h ALA 277 N 1.62 0.71 -0.61 1.57 0.00 -0.54 -0.51 119.26 121.50 1oxa h ALA 277 Ca -0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1oxa h ALA 277 Cb 1.06 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1oxa h ALA 277 CO 0.05 0.67 0.27 0.28 0.00 0.00 0.00 179.25 180.52 1oxa h VAL 278 N 0.77 1.22 -0.58 0.00 2.07 -0.81 0.87 116.25 119.79 1oxa h VAL 278 Ca 0.09 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 66.88 1oxa h VAL 278 Cb 0.84 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1oxa h VAL 278 CO 0.07 0.26 0.07 -0.33 0.02 0.00 0.00 177.57 177.67 1oxa h GLU 279 N 0.84 0.94 0.00 1.57 4.39 -1.29 -2.12 114.58 118.91 1oxa h GLU 279 Ca 0.21 -0.24 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 1oxa h GLU 279 Cb 0.15 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1oxa h GLU 279 CO -0.02 0.89 -0.41 1.49 -1.16 0.00 0.00 179.01 179.79 1oxa h GLU 280 N 0.89 0.00 -0.27 2.33 4.57 -0.49 -1.69 114.58 119.92 1oxa h GLU 280 Ca 0.18 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.27 1oxa h GLU 280 Cb 0.42 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 1oxa h GLU 280 CO 0.01 0.41 -0.19 0.82 -1.18 0.00 0.00 179.01 178.88 1oxa h ILE 281 N 0.00 1.30 -0.67 2.32 2.04 -0.34 -0.58 117.51 121.59 1oxa h ILE 281 Ca -0.00 -1.32 -0.07 0.00 1.00 0.00 0.00 64.86 64.46 1oxa h ILE 281 Cb 0.91 1.57 -0.03 0.00 -0.74 0.00 0.00 36.82 38.54 1oxa h ILE 281 CO 0.05 0.42 0.15 -0.07 0.00 0.00 0.00 178.15 178.70 1oxa h LEU 282 N 0.34 1.01 -0.24 1.44 3.38 -1.27 -2.43 115.31 117.55 1oxa h LEU 282 Ca 0.05 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1oxa h LEU 282 Cb 0.73 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1oxa h LEU 282 CO 0.05 0.98 -0.08 -0.09 0.09 0.00 0.00 178.44 179.39 1oxa h ARG 283 N 1.01 0.47 0.68 1.13 2.43 -1.21 -2.77 114.38 116.12 1oxa h ARG 283 Ca 0.21 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 1oxa h ARG 283 Cb 0.38 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1oxa h ARG 283 CO 0.00 0.72 -0.41 -0.92 -1.51 0.00 0.00 179.97 177.86 1oxa h TYR 284 N 0.20 -1.09 -3.00 2.20 3.20 -0.96 -3.38 116.97 114.14 1oxa h TYR 284 Ca 0.06 -0.01 -0.61 0.00 3.14 0.00 0.00 58.73 61.30 1oxa h TYR 284 Cb 0.56 0.39 -0.40 0.00 1.54 0.00 0.00 36.73 38.82 1oxa h TYR 284 CO 0.06 -0.62 -0.74 0.42 -1.64 0.00 0.00 178.16 175.64 1oxa s ILE 285 N -5.99 1.38 0.07 1.81 1.01 -0.93 -4.96 121.20 113.59 1oxa s ILE 285 Ca -0.18 -2.48 -0.31 0.00 0.00 0.00 0.00 60.65 57.68 1oxa s ILE 285 Cb 0.04 -1.97 -0.08 0.00 0.01 0.00 0.00 42.46 40.46 1oxa s ILE 285 CO 0.61 -0.88 1.58 0.00 0.00 0.00 0.00 174.94 176.26 1oxa s ALA 286 N 0.43 3.67 0.09 9.38 0.00 -1.05 -4.66 121.76 129.62 1oxa s ALA 286 Ca 0.17 1.15 -0.22 0.00 0.00 0.00 0.00 51.96 53.06 1oxa s ALA 286 Cb -0.24 -3.66 -0.14 0.00 0.00 0.00 0.00 23.12 19.08 1oxa s ALA 286 CO -0.01 -1.01 1.71 -1.35 0.00 0.00 0.00 175.76 175.10 1oxa h PRO 287 N 8.01 0.06 -4.79 0.00 0.11 -1.85 -3.22 132.00 130.32 1oxa h PRO 287 Ca -0.42 -0.01 -0.71 0.00 0.11 0.00 0.00 66.00 64.98 1oxa h PRO 287 Cb 1.20 -0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.20 1oxa h PRO 287 CO 0.92 0.08 2.31 -2.30 -0.21 0.00 0.00 178.00 178.80 1oxa n PRO 288 N -5.04 3.18 0.23 1.05 -0.02 -1.26 -0.32 135.00 132.82 1oxa n PRO 288 Ca -0.06 -3.21 0.13 0.00 -2.02 0.00 0.00 63.50 58.33 1oxa n PRO 288 Cb 0.05 -3.28 0.74 0.00 -0.02 0.00 0.00 33.50 30.99 1oxa n PRO 288 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1oxa h GLU 289 N 6.78 0.00 -3.35 -0.52 4.81 -1.64 -3.40 114.58 117.26 1oxa h GLU 289 Ca 0.46 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.45 1oxa h GLU 289 Cb 0.77 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 29.84 1oxa h GLU 289 CO 1.57 0.00 -0.61 0.99 -0.73 0.00 0.00 179.01 180.23 1oxa s THR 290 N -4.90 -0.04 -0.02 0.32 2.01 -0.77 -1.83 115.64 110.41 1oxa s THR 290 Ca -0.05 0.13 0.07 0.00 0.31 0.00 0.00 61.69 62.15 1oxa s THR 290 Cb 0.17 -0.20 -0.02 0.00 0.01 0.00 0.00 72.50 72.46 1oxa s THR 290 CO 0.63 0.05 -0.25 0.42 -0.69 0.00 0.00 174.62 174.79 1oxa s THR 291 N 0.82 1.96 0.01 -0.82 -4.23 -0.41 -4.70 115.64 108.27 1oxa s THR 291 Ca -0.06 -1.06 -0.07 0.00 -1.18 0.00 0.00 61.69 59.32 1oxa s THR 291 Cb -0.08 -1.63 -0.05 0.00 1.34 0.00 0.00 72.50 72.07 1oxa s THR 291 CO -0.04 0.55 0.28 -0.89 -0.54 0.00 0.00 174.62 173.99 1oxa s THR 292 N -0.53 5.27 0.03 3.99 2.01 -1.26 -0.63 115.64 124.53 1oxa s THR 292 Ca 0.08 0.24 -0.00 0.00 0.31 0.00 0.00 61.69 62.31 1oxa s THR 292 Cb -0.10 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 1oxa s THR 292 CO -0.00 0.38 -0.03 -0.13 -0.69 0.00 0.00 174.62 174.14 1oxa s ARG 293 N -1.71 0.43 -0.13 4.92 1.81 0.42 -4.83 118.95 119.85 1oxa s ARG 293 Ca 0.27 -0.83 0.02 0.00 -1.72 0.00 0.00 55.73 53.48 1oxa s ARG 293 Cb -0.13 0.12 0.01 0.00 -0.45 0.00 0.00 34.95 34.49 1oxa s ARG 293 CO 0.16 -0.06 -0.21 0.12 -0.68 0.00 0.00 175.30 174.62 1oxa s PHE 294 N -2.29 2.67 -0.80 -0.53 5.36 -0.14 -0.13 117.98 122.12 1oxa s PHE 294 Ca -0.08 -1.21 -0.26 0.00 -0.96 0.00 0.00 56.93 54.42 1oxa s PHE 294 Cb -0.04 -1.81 0.01 0.00 -0.34 0.00 0.00 43.02 40.85 1oxa s PHE 294 CO -0.04 -0.54 1.52 0.00 -1.46 0.00 0.00 175.22 174.71 1oxa s ALA 295 N 0.71 2.49 0.25 11.12 0.00 -0.07 0.18 121.76 136.43 1oxa s ALA 295 Ca -0.09 -1.46 0.21 0.00 0.00 0.00 0.00 51.96 50.62 1oxa s ALA 295 Cb -0.16 -4.37 0.90 0.00 0.00 0.00 0.00 23.12 19.49 1oxa s ALA 295 CO 0.01 -3.69 1.84 0.00 0.00 0.00 0.00 175.76 173.92 1oxa h ALA 296 N 11.15 1.12 -2.31 0.00 0.00 -1.54 0.67 119.26 128.34 1oxa h ALA 296 Ca -0.11 -0.26 -0.32 0.00 0.00 0.00 0.00 54.91 54.21 1oxa h ALA 296 Cb 1.06 -0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.66 1oxa h ALA 296 CO 1.30 0.36 -0.64 -1.21 0.00 0.00 0.00 179.25 179.06 1oxa s GLU 297 N -3.83 1.27 0.40 0.00 2.02 -1.25 -4.58 118.70 112.73 1oxa s GLU 297 Ca -0.01 -1.66 -0.26 0.00 0.02 0.00 0.00 54.97 53.06 1oxa s GLU 297 Cb 0.12 -0.28 -0.09 0.00 0.10 0.00 0.00 34.13 33.99 1oxa s GLU 297 CO 0.66 -0.22 1.25 -2.00 0.02 0.00 0.00 175.26 174.97 1oxa s GLU 298 N -3.98 4.02 -0.03 1.61 2.12 -1.26 -4.42 118.70 116.75 1oxa s GLU 298 Ca 0.31 2.03 -0.02 0.00 0.36 0.00 0.00 54.97 57.66 1oxa s GLU 298 Cb 0.07 -2.74 0.02 0.00 0.26 0.00 0.00 34.13 31.74 1oxa s GLU 298 CO 0.09 -0.41 0.07 0.08 -0.54 0.00 0.00 175.26 174.56 1oxa s VAL 299 N -1.31 -0.04 -0.28 3.70 1.01 -0.82 -4.95 120.40 117.72 1oxa s VAL 299 Ca 0.56 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.58 1oxa s VAL 299 Cb -0.35 -0.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 1oxa s VAL 299 CO 0.45 0.05 0.16 -0.70 0.00 0.00 0.00 175.10 175.06 1oxa s GLU 300 N 0.74 3.79 -0.15 2.72 2.12 -1.26 0.48 118.70 127.14 1oxa s GLU 300 Ca -0.06 -0.42 0.01 0.00 0.36 0.00 0.00 54.97 54.86 1oxa s GLU 300 Cb -0.08 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.75 1oxa s GLU 300 CO -0.03 -0.22 -0.17 0.42 -0.54 0.00 0.00 175.26 174.72 1oxa s ILE 301 N 1.71 1.76 -1.44 -3.70 -1.09 0.18 -4.77 121.20 113.85 1oxa s ILE 301 Ca 0.07 -0.77 -0.11 0.00 -2.23 0.00 0.00 60.65 57.61 1oxa s ILE 301 Cb -0.16 -1.61 0.04 0.00 -1.58 0.00 0.00 42.46 39.15 1oxa s ILE 301 CO 0.09 0.49 1.08 0.61 -1.23 0.00 0.00 174.94 175.98 1oxa n GLY 302 N 4.49 -0.53 2.57 6.18 0.00 -1.26 -1.45 105.19 115.19 1oxa n GLY 302 Ca -0.19 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1oxa n GLY 302 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oxa n GLY 303 N -1.86 2.68 3.76 -0.02 0.00 -1.26 -4.94 105.19 103.55 1oxa n GLY 303 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1oxa n GLY 303 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxa s VAL 304 N -2.11 5.24 -0.44 1.61 1.01 -0.53 -5.05 120.40 120.13 1oxa s VAL 304 Ca 0.00 0.66 -0.19 0.00 0.00 0.00 0.00 61.98 62.44 1oxa s VAL 304 Cb 0.00 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.74 1oxa s VAL 304 CO 0.00 0.43 0.58 0.00 0.00 0.00 0.00 175.10 176.11 1oxa s ALA 305 N 0.09 3.38 -0.28 5.51 0.00 -1.26 0.47 121.76 129.67 1oxa s ALA 305 Ca 0.20 -1.38 -0.26 0.00 0.00 0.00 0.00 51.96 50.51 1oxa s ALA 305 Cb -0.14 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.75 1oxa s ALA 305 CO 0.07 -1.76 0.91 0.42 0.00 0.00 0.00 175.76 175.40 1oxa s ILE 306 N 2.58 4.71 0.59 0.00 1.01 0.18 -4.95 121.20 125.33 1oxa s ILE 306 Ca 0.18 1.57 -0.18 0.00 0.00 0.00 0.00 60.65 62.22 1oxa s ILE 306 Cb -0.16 -4.23 -0.06 0.00 0.01 0.00 0.00 42.46 38.02 1oxa s ILE 306 CO 0.16 -0.25 0.77 -2.65 0.00 0.00 0.00 174.94 172.98 1oxa n PRO 307 N 6.34 0.71 -1.95 2.79 -0.02 -1.26 -1.95 135.00 139.65 1oxa n PRO 307 Ca 0.08 0.28 -0.36 0.00 -2.02 0.00 0.00 63.50 61.48 1oxa n PRO 307 Cb 0.47 -1.97 0.04 0.00 -0.02 0.00 0.00 33.50 32.03 1oxa n PRO 307 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1oxa s GLN 308 N -2.49 2.89 -1.27 -0.52 0.74 -1.26 -2.88 119.66 114.88 1oxa s GLN 308 Ca 0.73 1.83 0.00 0.00 0.05 0.00 0.00 55.36 57.97 1oxa s GLN 308 Cb -0.43 -1.92 0.00 0.00 1.10 0.00 0.00 33.01 31.77 1oxa s GLN 308 CO 0.50 -1.27 0.00 0.66 -0.55 0.00 0.00 175.29 174.63 1oxa n TYR 309 N -1.70 -0.18 -3.19 1.67 4.01 0.23 -4.96 117.16 113.04 1oxa n TYR 309 Ca 0.14 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.61 1oxa n TYR 309 Cb 0.50 -2.46 -0.02 0.00 -0.31 0.00 0.00 39.34 37.05 1oxa n TYR 309 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1oxa s SER 310 N -2.73 6.34 -0.24 7.72 0.01 -1.14 -4.84 113.70 118.82 1oxa s SER 310 Ca 0.00 0.65 -0.10 0.00 1.31 0.00 0.00 55.95 57.81 1oxa s SER 310 Cb 0.00 -2.12 -0.05 0.00 0.21 0.00 0.00 66.02 64.06 1oxa s SER 310 CO 0.00 -0.33 0.15 -0.89 0.41 0.00 0.00 173.24 172.58 1oxa s THR 311 N -2.33 5.24 -0.11 1.44 2.01 -1.26 -0.89 115.64 119.74 1oxa s THR 311 Ca 0.43 0.14 -0.00 0.00 0.31 0.00 0.00 61.69 62.57 1oxa s THR 311 Cb -0.10 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 68.94 1oxa s THR 311 CO 0.36 0.34 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.84 1oxa s VAL 312 N 1.14 3.40 -0.36 3.82 1.01 0.81 -1.60 120.40 128.62 1oxa s VAL 312 Ca 0.07 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 1oxa s VAL 312 Cb -0.14 -2.42 0.08 0.00 0.00 0.00 0.00 36.38 33.91 1oxa s VAL 312 CO 0.05 0.55 0.11 -0.76 0.00 0.00 0.00 175.10 175.05 1oxa s LEU 313 N -0.13 4.65 -0.38 3.92 1.43 0.11 -0.44 118.68 127.84 1oxa s LEU 313 Ca 0.00 -1.68 -0.28 0.00 -1.03 0.00 0.00 54.13 51.14 1oxa s LEU 313 Cb -0.13 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.33 1oxa s LEU 313 CO 0.03 -0.41 1.02 -0.69 0.23 0.00 0.00 176.35 176.53 1oxa s VAL 314 N 1.19 4.47 -1.24 -1.59 1.01 0.20 -1.28 120.40 123.16 1oxa s VAL 314 Ca 0.03 1.37 -0.16 0.00 0.00 0.00 0.00 61.98 63.21 1oxa s VAL 314 Cb -0.21 -4.43 0.12 0.00 0.00 0.00 0.00 36.38 31.86 1oxa s VAL 314 CO -0.03 -0.64 1.57 0.00 0.00 0.00 0.00 175.10 176.01 1oxa s ALA 315 N 3.77 3.64 0.34 5.51 0.00 -0.32 -1.29 121.76 133.41 1oxa s ALA 315 Ca 0.43 -3.12 0.12 0.00 0.00 0.00 0.00 51.96 49.39 1oxa s ALA 315 Cb -0.11 -4.38 0.95 0.00 0.00 0.00 0.00 23.12 19.58 1oxa s ALA 315 CO 0.21 -3.04 1.74 -0.91 0.00 0.00 0.00 175.76 173.75 1oxa h ASN 316 N 7.43 0.61 -0.02 0.00 4.21 -1.59 -0.05 115.58 126.17 1oxa h ASN 316 Ca 0.37 0.12 -0.13 0.00 1.21 0.00 0.00 56.30 57.87 1oxa h ASN 316 Cb 0.88 0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 38.09 1oxa h ASN 316 CO 1.35 0.10 -0.41 1.23 -1.29 0.00 0.00 177.43 178.41 1oxa h GLY 317 N 0.53 0.59 1.19 2.83 0.00 -1.68 -2.52 103.07 104.01 1oxa h GLY 317 Ca 0.63 -0.59 -0.20 0.00 0.00 0.00 0.00 47.33 47.18 1oxa h GLY 317 CO -0.43 0.53 -0.63 0.00 0.00 0.00 0.00 176.54 176.01 1oxa h ALA 318 N 1.11 0.43 -0.94 3.60 0.00 -1.29 -3.20 119.26 118.97 1oxa h ALA 318 Ca 0.04 -0.55 0.03 0.00 0.00 0.00 0.00 54.91 54.44 1oxa h ALA 318 Cb 0.90 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1oxa h ALA 318 CO 0.08 0.68 0.61 0.00 0.00 0.00 0.00 179.25 180.63 1oxa h ALA 319 N 0.67 1.24 0.00 0.00 0.00 -1.20 -0.03 119.26 119.94 1oxa h ALA 319 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1oxa h ALA 319 Cb 1.24 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1oxa h ALA 319 CO 0.13 0.49 0.00 0.09 0.00 0.00 0.00 179.25 179.97 1oxa n ASN 320 N -4.48 0.00 -0.58 0.00 3.02 -0.96 -1.79 115.26 110.47 1oxa n ASN 320 Ca 0.12 0.34 0.07 0.00 -0.03 0.00 0.00 54.58 55.08 1oxa n ASN 320 Cb 0.09 -0.40 0.20 0.00 -0.61 0.00 0.00 39.78 39.05 1oxa n ASN 320 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1oxa n ARG 321 N -1.40 1.92 -2.82 3.52 5.12 -0.03 -4.85 116.66 118.13 1oxa n ARG 321 Ca 0.03 -2.86 -0.42 0.00 -1.93 0.00 0.00 57.85 52.67 1oxa n ARG 321 Cb 0.10 -1.68 -0.04 0.00 -1.16 0.00 0.00 32.46 29.68 1oxa n ARG 321 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1oxa s ASP 322 N -2.58 6.82 0.28 0.55 -1.08 -0.74 -4.81 116.67 115.11 1oxa s ASP 322 Ca 0.38 0.92 0.02 0.00 -0.52 0.00 0.00 52.55 53.35 1oxa s ASP 322 Cb 0.33 -2.46 0.65 0.00 -1.46 0.00 0.00 42.92 39.97 1oxa s ASP 322 CO 0.03 -0.67 1.73 -0.65 0.52 0.00 0.00 175.17 176.12 1oxa h PRO 323 N 7.95 0.50 0.00 4.34 0.11 -1.91 0.14 132.00 143.13 1oxa h PRO 323 Ca -0.22 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1oxa h PRO 323 Cb 1.08 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1oxa h PRO 323 CO 0.93 0.33 0.00 0.66 -0.21 0.00 0.00 178.00 179.71 1oxa h SER 324 N 0.51 0.00 0.00 -2.05 4.64 -1.98 -3.09 113.55 111.58 1oxa h SER 324 Ca 0.52 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.61 1oxa h SER 324 Cb 0.88 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.93 1oxa h SER 324 CO -0.45 0.00 -1.88 1.67 -0.87 0.00 0.00 176.83 175.30 1oxa n GLN 325 N -2.97 0.80 -3.84 4.77 -0.06 0.11 -4.90 117.38 111.30 1oxa n GLN 325 Ca -0.02 0.07 -0.30 0.00 -2.00 0.00 0.00 57.00 54.75 1oxa n GLN 325 Cb 0.14 -1.31 -0.15 0.00 -4.06 0.00 0.00 30.24 24.86 1oxa n GLN 325 CO 0.00 0.00 0.00 -0.06 -0.20 0.00 0.00 177.06 176.80 1oxa s PHE 326 N -2.31 2.46 0.13 3.69 0.08 0.28 -5.05 117.98 117.25 1oxa s PHE 326 Ca -0.17 -2.20 -0.31 0.00 0.12 0.00 0.00 56.93 54.37 1oxa s PHE 326 Cb 0.05 -2.16 -0.11 0.00 -0.57 0.00 0.00 43.02 40.24 1oxa s PHE 326 CO 0.40 -0.90 1.82 -1.25 -0.10 0.00 0.00 175.22 175.18 1oxa s PRO 327 N 1.36 4.13 -1.17 0.24 0.04 -1.22 -2.03 135.00 136.36 1oxa s PRO 327 Ca 0.10 2.60 -0.01 0.00 0.04 0.00 0.00 61.00 63.73 1oxa s PRO 327 Cb -0.18 -3.54 -0.01 0.00 0.04 0.00 0.00 34.50 30.81 1oxa s PRO 327 CO -0.19 -0.83 0.98 -3.47 0.04 0.00 0.00 177.00 173.53 1oxa n ASP 328 N 5.49 -2.99 0.22 6.66 2.03 -1.26 -4.87 116.55 121.82 1oxa n ASP 328 Ca 0.18 -0.64 0.18 0.00 0.52 0.00 0.00 54.79 55.03 1oxa n ASP 328 Cb 0.38 -5.14 0.82 0.00 -0.72 0.00 0.00 41.12 36.46 1oxa n ASP 328 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1oxa h PRO 329 N -1.73 0.00 -0.12 -0.67 0.13 -1.72 0.34 132.00 128.23 1oxa h PRO 329 Ca -0.59 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1oxa h PRO 329 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1oxa h PRO 329 CO 0.49 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.98 1oxa n HIS 330 N -3.41 0.16 -3.73 1.56 8.25 -1.26 -4.77 115.22 112.01 1oxa n HIS 330 Ca 0.02 -0.08 -0.37 0.00 -0.26 0.00 0.00 57.72 57.04 1oxa n HIS 330 Cb 0.43 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.42 1oxa n HIS 330 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1oxa s ARG 331 N -1.84 3.74 -0.51 -0.41 3.52 0.11 -5.05 118.95 118.50 1oxa s ARG 331 Ca 0.25 -0.44 -0.29 0.00 -0.13 0.00 0.00 55.73 55.13 1oxa s ARG 331 Cb 0.13 -3.39 0.03 0.00 -1.56 0.00 0.00 34.95 30.15 1oxa s ARG 331 CO 0.20 -0.17 1.22 0.12 -0.81 0.00 0.00 175.30 175.86 1oxa s PHE 332 N 1.59 2.65 -0.23 5.12 5.36 -1.26 -4.98 117.98 126.23 1oxa s PHE 332 Ca 0.06 0.59 -0.02 0.00 -0.96 0.00 0.00 56.93 56.61 1oxa s PHE 332 Cb -0.15 -4.45 0.07 0.00 -0.34 0.00 0.00 43.02 38.15 1oxa s PHE 332 CO 0.05 -1.53 0.03 0.34 -1.46 0.00 0.00 175.22 172.65 1oxa s ASP 333 N 2.98 3.36 0.49 6.13 2.15 -1.26 -4.97 116.67 125.54 1oxa s ASP 333 Ca 0.48 -1.07 0.33 0.00 0.43 0.00 0.00 52.55 52.72 1oxa s ASP 333 Cb -0.08 -0.79 1.77 0.00 -0.30 0.00 0.00 42.92 43.52 1oxa s ASP 333 CO 0.29 -0.31 2.00 0.58 -0.17 0.00 0.00 175.17 177.56 1oxa h VAL 334 N 6.55 0.00 0.00 1.11 2.07 -1.93 -2.18 116.25 121.87 1oxa h VAL 334 Ca -0.16 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1oxa h VAL 334 Cb 1.09 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 1oxa h VAL 334 CO 0.38 0.00 -1.09 0.35 0.02 0.00 0.00 177.57 177.23 1oxa n THR 335 N -2.65 0.03 -0.95 2.57 -2.24 -1.26 -4.21 114.28 105.58 1oxa n THR 335 Ca -0.02 -0.12 -0.30 0.00 -2.27 0.00 0.00 64.05 61.34 1oxa n THR 335 Cb 0.05 0.62 0.16 0.00 -2.10 0.00 0.00 70.33 69.06 1oxa n THR 335 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oxa s ARG 336 N -3.11 0.84 -0.22 -0.78 1.70 -0.82 -4.96 118.95 111.59 1oxa s ARG 336 Ca 0.05 1.04 -0.27 0.00 -0.47 0.00 0.00 55.73 56.08 1oxa s ARG 336 Cb 0.16 -1.74 0.00 0.00 -0.57 0.00 0.00 34.95 32.79 1oxa s ARG 336 CO 0.84 -2.59 0.94 0.34 -1.08 0.00 0.00 175.30 173.75 1oxa s ASP 337 N -3.05 7.00 0.00 -2.89 2.15 -1.26 -4.90 116.67 113.73 1oxa s ASP 337 Ca 0.65 1.25 0.19 0.00 0.43 0.00 0.00 52.55 55.07 1oxa s ASP 337 Cb -0.20 -2.50 0.03 0.00 -0.30 0.00 0.00 42.92 39.95 1oxa s ASP 337 CO 0.59 -0.57 0.99 0.35 -0.17 0.00 0.00 175.17 176.35 1oxa n THR 338 N 5.19 0.00 -1.59 1.71 -2.24 -1.26 -5.01 114.28 111.08 1oxa n THR 338 Ca 0.09 -0.34 -0.49 0.00 -2.27 0.00 0.00 64.05 61.04 1oxa n THR 338 Cb 0.47 1.26 -0.04 0.00 -2.10 0.00 0.00 70.33 69.92 1oxa n THR 338 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1oxa n ARG 339 N 0.17 1.23 -0.08 -0.78 1.74 -1.26 -2.27 116.66 115.40 1oxa n ARG 339 Ca 0.09 0.44 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 1oxa n ARG 339 Cb 0.42 -1.97 0.00 0.00 -1.02 0.00 0.00 32.46 29.88 1oxa n ARG 339 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1oxa n GLY 340 N 2.11 0.95 3.70 -0.13 0.00 -1.26 -5.06 105.19 105.50 1oxa n GLY 340 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1oxa n GLY 340 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1oxa s HIS 341 N -2.42 1.85 -0.37 1.61 -3.43 -0.96 -4.94 115.29 106.62 1oxa s HIS 341 Ca 0.00 1.65 0.15 0.00 -0.80 0.00 0.00 55.06 56.06 1oxa s HIS 341 Cb 0.00 -3.50 0.74 0.00 -1.43 0.00 0.00 32.58 28.39 1oxa s HIS 341 CO 0.00 -2.83 1.66 1.28 -2.00 0.00 0.00 174.74 172.84 1oxa n LEU 342 N -3.15 5.16 0.25 5.38 4.77 -1.26 -4.60 117.00 123.56 1oxa n LEU 342 Ca 0.14 -2.87 0.13 0.00 -0.03 0.00 0.00 56.01 53.38 1oxa n LEU 342 Cb 0.50 -0.63 0.65 0.00 -2.33 0.00 0.00 43.42 41.61 1oxa n LEU 342 CO 0.48 0.67 0.92 0.28 -1.33 0.00 0.00 177.39 178.41 1oxa h SER 343 N 3.51 0.00 -0.55 -1.43 0.02 -1.87 -2.08 113.55 111.15 1oxa h SER 343 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1oxa h SER 343 Cb 1.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.31 1oxa h SER 343 CO 0.39 0.14 0.00 0.49 -1.14 0.00 0.00 176.83 176.71 1oxa n PHE 344 N -3.43 0.73 -0.54 3.45 3.72 -1.26 -4.81 117.46 115.32 1oxa n PHE 344 Ca -0.01 -0.46 0.00 0.00 -0.05 0.00 0.00 57.45 56.94 1oxa n PHE 344 Cb 0.31 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 1oxa n PHE 344 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oxa n GLY 345 N 1.23 -1.84 3.65 1.37 0.00 -0.79 -0.17 105.19 108.64 1oxa n GLY 345 Ca 0.19 -1.93 -0.01 0.00 0.00 0.00 0.00 46.02 44.28 1oxa n GLY 345 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1oxa s GLN 346 N 0.00 0.17 0.44 1.61 2.00 -1.26 -4.65 119.66 117.97 1oxa s GLN 346 Ca 0.00 0.26 0.00 0.00 -2.00 0.00 0.00 55.36 53.62 1oxa s GLN 346 Cb 0.00 0.05 0.00 0.00 0.80 0.00 0.00 33.01 33.86 1oxa s GLN 346 CO 0.00 -0.03 0.00 0.41 -0.50 0.00 0.00 175.29 175.17 1oxa n GLY 347 N 2.88 -1.39 0.28 2.59 0.00 -1.26 -4.42 105.19 103.88 1oxa n GLY 347 Ca -0.16 -1.82 0.14 0.00 0.00 0.00 0.00 46.02 44.18 1oxa n GLY 347 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1oxa h ILE 348 N 0.00 0.49 -0.50 -0.61 3.07 -1.97 -2.16 117.51 115.83 1oxa h ILE 348 Ca 0.00 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.09 1oxa h ILE 348 Cb 0.00 1.21 0.00 0.00 -0.27 0.00 0.00 36.82 37.76 1oxa h ILE 348 CO 0.00 0.07 0.00 1.41 -1.05 0.00 0.00 178.15 178.58 1oxa n HIS 349 N -3.64 1.21 -1.53 0.16 8.25 -1.26 -4.98 115.22 113.42 1oxa n HIS 349 Ca -0.02 -0.47 -0.44 0.00 -0.26 0.00 0.00 57.72 56.53 1oxa n HIS 349 Cb 0.18 -0.22 -0.01 0.00 1.12 0.00 0.00 29.99 31.05 1oxa n HIS 349 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1oxa n PHE 350 N 0.79 0.59 -1.70 4.41 7.35 -0.81 -4.74 117.46 123.35 1oxa n PHE 350 Ca 0.20 0.71 -0.55 0.00 -0.76 0.00 0.00 57.45 57.05 1oxa n PHE 350 Cb 0.74 -2.14 -0.07 0.00 0.35 0.00 0.00 39.48 38.36 1oxa n PHE 350 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1oxa h MET 352 N 7.33 0.00 -0.60 0.00 2.86 -1.90 -3.29 114.93 119.33 1oxa h MET 352 Ca -0.47 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.17 1oxa h MET 352 Cb 1.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.97 1oxa h MET 352 CO 0.94 0.77 0.00 0.41 1.06 0.00 0.00 176.91 180.09 1oxa n GLY 353 N 1.04 1.78 0.27 8.32 0.00 -1.26 -4.53 105.19 110.80 1oxa n GLY 353 Ca 0.00 -0.54 0.06 0.00 0.00 0.00 0.00 46.02 45.54 1oxa n GLY 353 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1oxa h ARG 354 N 2.62 0.29 -0.52 1.61 2.43 -1.97 -0.24 114.38 118.60 1oxa h ARG 354 Ca 0.00 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1oxa h ARG 354 Cb 1.01 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.46 1oxa h ARG 354 CO 0.15 0.19 0.33 -1.35 -1.51 0.00 0.00 179.97 177.78 1oxa h PRO 355 N 0.30 0.64 -0.36 0.20 0.11 -1.90 -1.46 132.00 129.53 1oxa h PRO 355 Ca 0.41 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.34 1oxa h PRO 355 Cb 0.70 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1oxa h PRO 355 CO -0.49 0.42 -0.35 1.25 -0.21 0.00 0.00 178.00 178.62 1oxa h LEU 356 N 0.66 0.87 -0.73 2.35 5.85 -1.69 -2.28 115.31 120.34 1oxa h LEU 356 Ca 0.20 -0.38 -0.06 0.00 0.84 0.00 0.00 57.88 58.48 1oxa h LEU 356 Cb -0.02 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 1oxa h LEU 356 CO -0.07 1.13 0.22 0.00 -0.34 0.00 0.00 178.44 179.38 1oxa h ALA 357 N 0.91 0.95 -0.21 1.25 0.00 -0.80 -1.14 119.26 120.22 1oxa h ALA 357 Ca 0.06 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.56 1oxa h ALA 357 Cb 0.91 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1oxa h ALA 357 CO 0.08 0.65 -0.62 0.87 0.00 0.00 0.00 179.25 180.23 1oxa h LYS 358 N 1.08 0.71 0.11 0.00 1.57 -1.26 -1.75 116.57 117.03 1oxa h LYS 358 Ca 0.23 -0.49 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 1oxa h LYS 358 Cb 0.32 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1oxa h LYS 358 CO -0.01 1.11 -0.05 1.25 -0.57 0.00 0.00 179.45 181.18 1oxa h LEU 359 N 0.53 -0.13 -0.29 2.94 6.46 -1.23 -0.80 115.31 122.79 1oxa h LEU 359 Ca -0.01 -0.06 0.01 0.00 -0.12 0.00 0.00 57.88 57.70 1oxa h LEU 359 Cb 1.21 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 41.15 1oxa h LEU 359 CO 0.13 -0.02 0.18 -0.33 -0.62 0.00 0.00 178.44 177.77 1oxa h GLU 360 N -0.22 0.35 -0.63 1.25 5.08 -1.23 -0.66 114.58 118.52 1oxa h GLU 360 Ca -0.02 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1oxa h GLU 360 Cb 0.18 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1oxa h GLU 360 CO 0.03 0.23 0.31 0.78 -1.00 0.00 0.00 179.01 179.36 1oxa h GLY 361 N 0.36 0.97 0.67 -3.84 0.00 -1.19 -1.30 103.07 98.75 1oxa h GLY 361 Ca 0.11 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1oxa h GLY 361 CO -0.04 0.45 -0.16 0.83 0.00 0.00 0.00 176.54 177.62 1oxa h GLU 362 N 0.86 -0.42 -0.65 4.80 5.08 -0.95 -2.00 114.58 121.31 1oxa h GLU 362 Ca 0.22 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.66 1oxa h GLU 362 Cb 0.11 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 1oxa h GLU 362 CO -0.03 -0.11 0.36 0.28 -1.00 0.00 0.00 179.01 178.51 1oxa h VAL 363 N -0.77 0.97 0.18 3.13 2.07 -1.15 -1.54 116.25 119.13 1oxa h VAL 363 Ca -0.04 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1oxa h VAL 363 Cb 0.51 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1oxa h VAL 363 CO 0.07 0.12 -0.09 0.00 0.02 0.00 0.00 177.57 177.70 1oxa h ALA 364 N 1.33 -0.24 -0.66 1.67 0.00 -1.28 -2.19 119.26 117.90 1oxa h ALA 364 Ca 0.29 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1oxa h ALA 364 Cb 0.17 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1oxa h ALA 364 CO -0.18 -0.48 0.16 -0.07 0.00 0.00 0.00 179.25 178.68 1oxa h LEU 365 N -0.55 1.01 0.03 0.00 3.38 -1.33 -0.11 115.31 117.74 1oxa h LEU 365 Ca -0.02 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 57.73 1oxa h LEU 365 Cb 0.41 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1oxa h LEU 365 CO 0.04 0.98 -0.13 -0.09 0.09 0.00 0.00 178.44 179.33 1oxa h ARG 366 N 0.98 -0.23 -0.08 1.13 2.43 -1.32 -1.77 114.38 115.54 1oxa h ARG 366 Ca 0.21 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1oxa h ARG 366 Cb 0.37 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1oxa h ARG 366 CO 0.00 -0.15 0.04 0.00 -1.51 0.00 0.00 179.97 178.35 1oxa h ALA 367 N 0.70 0.10 0.26 2.80 0.00 -1.23 -0.04 119.26 121.84 1oxa h ALA 367 Ca 0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1oxa h ALA 367 Cb 0.28 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1oxa h ALA 367 CO -0.11 -0.33 -0.43 1.25 0.00 0.00 0.00 179.25 179.62 1oxa h LEU 368 N -0.01 -1.25 -1.42 0.00 6.46 -0.88 -1.06 115.31 117.15 1oxa h LEU 368 Ca 0.03 0.12 -0.04 0.00 -0.12 0.00 0.00 57.88 57.86 1oxa h LEU 368 Cb 0.13 0.44 -0.01 0.00 -0.73 0.00 0.00 40.66 40.50 1oxa h LEU 368 CO -0.00 -0.51 -0.21 -0.26 -0.62 0.00 0.00 178.44 176.83 1oxa h PHE 369 N -0.73 0.00 0.00 1.25 0.04 -1.34 -1.80 116.94 114.36 1oxa h PHE 369 Ca -0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1oxa h PHE 369 Cb 0.68 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.83 1oxa h PHE 369 CO -0.33 0.21 -0.25 0.78 -0.60 0.00 0.00 178.31 178.13 1oxa h GLY 370 N 1.53 0.00 0.94 -1.45 0.00 -0.80 -3.31 103.07 99.97 1oxa h GLY 370 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 1oxa h GLY 370 CO 0.03 0.00 -1.72 -2.13 0.00 0.00 0.00 176.54 172.72 1oxa n ARG 371 N -2.98 0.63 -3.74 4.80 3.00 -0.42 -4.58 116.66 113.37 1oxa n ARG 371 Ca 0.03 0.28 -0.28 0.00 -0.00 0.00 0.00 57.85 57.88 1oxa n ARG 371 Cb 0.53 -1.78 -0.11 0.00 0.00 0.00 0.00 32.46 31.10 1oxa n ARG 371 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1oxa n PHE 372 N -3.02 2.03 0.41 -0.14 3.72 -0.72 -4.93 117.46 114.82 1oxa n PHE 372 Ca -0.17 -4.02 0.04 0.00 -0.05 0.00 0.00 57.45 53.26 1oxa n PHE 372 Cb 1.04 -0.37 0.22 0.00 -0.94 0.00 0.00 39.48 39.44 1oxa n PHE 372 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1oxa n PRO 373 N 2.18 0.13 -0.10 -1.08 -0.04 -1.25 -1.55 135.00 133.28 1oxa n PRO 373 Ca 0.23 0.20 0.04 0.00 -0.04 0.00 0.00 63.50 63.93 1oxa n PRO 373 Cb 0.39 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.45 1oxa n PRO 373 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1oxa n ALA 374 N -1.28 2.24 -1.66 0.55 0.00 -1.26 -5.04 120.51 114.06 1oxa n ALA 374 Ca 0.04 -0.95 -0.44 0.00 0.00 0.00 0.00 53.44 52.09 1oxa n ALA 374 Cb 0.07 -0.33 -0.02 0.00 0.00 0.00 0.00 19.45 19.17 1oxa n ALA 374 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1oxa n LEU 375 N 0.35 2.99 -3.92 0.00 7.94 -0.60 -3.23 117.00 120.53 1oxa n LEU 375 Ca 0.08 1.17 -0.09 0.00 -1.11 0.00 0.00 56.01 56.06 1oxa n LEU 375 Cb 0.34 -1.42 -0.05 0.00 0.53 0.00 0.00 43.42 42.82 1oxa n LEU 375 CO 0.06 -0.66 0.19 -0.94 -1.11 0.00 0.00 177.39 174.93 1oxa s SER 376 N -0.05 -0.12 0.36 1.96 1.04 -0.78 -4.98 113.70 111.13 1oxa s SER 376 Ca 0.63 -0.79 -0.26 0.00 0.48 0.00 0.00 55.95 56.01 1oxa s SER 376 Cb -0.64 0.57 -0.09 0.00 0.10 0.00 0.00 66.02 65.96 1oxa s SER 376 CO 0.56 -1.09 1.06 -0.76 0.98 0.00 0.00 173.24 173.98 1oxa s LEU 377 N -2.97 4.26 0.00 2.42 1.43 -1.26 -0.66 118.68 121.90 1oxa s LEU 377 Ca 0.17 2.10 0.24 0.00 -1.03 0.00 0.00 54.13 55.62 1oxa s LEU 377 Cb -0.00 -4.02 0.52 0.00 0.03 0.00 0.00 46.19 42.71 1oxa s LEU 377 CO 0.04 -0.39 1.44 0.61 0.23 0.00 0.00 176.35 178.29 1oxa n GLY 378 N 0.60 0.88 3.15 -3.19 0.00 0.15 -4.63 105.19 102.15 1oxa n GLY 378 Ca 0.03 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.34 1oxa n GLY 378 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1oxa s ILE 379 N -1.83 0.50 0.23 -0.61 -4.36 -1.26 -4.98 121.20 108.90 1oxa s ILE 379 Ca 0.34 -1.90 -0.30 0.00 -0.26 0.00 0.00 60.65 58.53 1oxa s ILE 379 Cb 0.21 -1.72 -0.09 0.00 1.25 0.00 0.00 42.46 42.11 1oxa s ILE 379 CO 0.31 -0.83 1.27 -0.62 0.24 0.00 0.00 174.94 175.31 1oxa s ASP 380 N -3.02 6.94 0.39 4.36 2.15 -1.26 -4.89 116.67 121.34 1oxa s ASP 380 Ca 0.13 2.42 0.21 0.00 0.43 0.00 0.00 52.55 55.74 1oxa s ASP 380 Cb 0.06 -2.62 1.21 0.00 -0.30 0.00 0.00 42.92 41.28 1oxa s ASP 380 CO -0.05 -0.46 1.69 0.00 -0.17 0.00 0.00 175.17 176.18 1oxa h ALA 381 N 4.77 2.33 0.00 3.66 0.00 -2.00 0.28 119.26 128.29 1oxa h ALA 381 Ca -0.46 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1oxa h ALA 381 Cb 1.22 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1oxa h ALA 381 CO 0.73 -0.87 0.00 -0.25 0.00 0.00 0.00 179.25 178.86 1oxa n ASP 382 N -4.77 0.36 -0.19 0.00 8.00 -1.26 -3.11 116.55 115.57 1oxa n ASP 382 Ca 0.31 0.56 0.12 0.00 0.71 0.00 0.00 54.79 56.50 1oxa n ASP 382 Cb 1.10 -0.65 0.28 0.00 -0.02 0.00 0.00 41.12 41.83 1oxa n ASP 382 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1oxa n ASP 383 N -1.87 0.97 -4.73 -2.24 9.92 0.97 -4.92 116.55 114.66 1oxa n ASP 383 Ca 0.04 -0.78 -0.42 0.00 -0.53 0.00 0.00 54.79 53.10 1oxa n ASP 383 Cb 0.27 0.25 -0.03 0.00 -0.64 0.00 0.00 41.12 40.97 1oxa n ASP 383 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1oxa s VAL 384 N -2.66 2.12 -0.26 2.53 1.01 -1.18 -4.96 120.40 117.01 1oxa s VAL 384 Ca 0.19 0.09 -0.14 0.00 0.00 0.00 0.00 61.98 62.12 1oxa s VAL 384 Cb 0.18 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1oxa s VAL 384 CO 0.59 0.01 0.34 -0.69 0.00 0.00 0.00 175.10 175.35 1oxa s VAL 385 N 0.81 5.21 0.01 2.92 1.01 -1.26 -5.07 120.40 124.03 1oxa s VAL 385 Ca 0.71 0.51 -0.15 0.00 0.00 0.00 0.00 61.98 63.05 1oxa s VAL 385 Cb -0.48 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.17 1oxa s VAL 385 CO 0.37 0.20 0.43 0.26 0.00 0.00 0.00 175.10 176.36 1oxa s TRP 386 N 1.80 3.74 0.19 5.22 0.52 -1.26 -4.36 118.94 124.79 1oxa s TRP 386 Ca 0.14 1.04 -0.32 0.00 0.02 0.00 0.00 56.10 56.98 1oxa s TRP 386 Cb -0.15 -2.32 -0.11 0.00 -1.15 0.00 0.00 33.47 29.74 1oxa s TRP 386 CO 0.09 0.63 1.64 0.50 0.02 0.00 0.00 176.95 179.84 1oxa s ARG 387 N -1.11 4.17 -1.34 4.98 3.52 0.64 -4.88 118.95 124.93 1oxa s ARG 387 Ca 0.25 2.49 -0.13 0.00 -0.13 0.00 0.00 55.73 58.21 1oxa s ARG 387 Cb -0.17 -3.11 0.11 0.00 -1.56 0.00 0.00 34.95 30.22 1oxa s ARG 387 CO 0.14 -0.67 1.93 -2.13 -0.81 0.00 0.00 175.30 173.76 1oxa n ARG 388 N 3.88 3.25 -3.75 5.12 0.63 -1.26 -4.50 116.66 120.03 1oxa n ARG 388 Ca 0.14 -3.19 -0.12 0.00 -0.92 0.00 0.00 57.85 53.76 1oxa n ARG 388 Cb 0.37 -3.15 -0.12 0.00 0.45 0.00 0.00 32.46 30.01 1oxa n ARG 388 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1oxa s SER 389 N 2.39 -0.31 0.05 6.15 0.15 -1.26 -4.71 113.70 116.16 1oxa s SER 389 Ca 0.45 0.59 0.24 0.00 0.70 0.00 0.00 55.95 57.92 1oxa s SER 389 Cb 0.09 0.54 0.23 0.00 -1.71 0.00 0.00 66.02 65.17 1oxa s SER 389 CO -0.02 -0.13 1.20 0.18 1.20 0.00 0.00 173.24 175.67 1oxa n LEU 390 N 3.54 0.62 -0.03 3.45 4.77 -1.26 -3.88 117.00 124.21 1oxa n LEU 390 Ca -0.18 0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.67 1oxa n LEU 390 Cb 0.56 -0.16 -0.11 0.00 -2.33 0.00 0.00 43.42 41.38 1oxa n LEU 390 CO 0.15 0.06 0.44 0.25 -1.33 0.00 0.00 177.39 176.96 1oxa h LEU 391 N 0.00 0.13 -6.28 2.23 5.85 -1.84 -2.06 115.31 113.35 1oxa h LEU 391 Ca 0.00 -0.77 -0.16 0.00 0.84 0.00 0.00 57.88 57.79 1oxa h LEU 391 Cb 0.65 -0.04 -0.28 0.00 0.37 0.00 0.00 40.66 41.37 1oxa h LEU 391 CO 0.00 0.88 -0.52 -0.22 -0.34 0.00 0.00 178.44 178.24 1oxa s LEU 392 N -8.59 -0.88 0.66 2.25 1.98 -1.25 -4.10 118.68 108.75 1oxa s LEU 392 Ca -0.17 -0.30 -0.15 0.00 -2.89 0.00 0.00 54.13 50.63 1oxa s LEU 392 Cb 0.00 1.21 0.00 0.00 0.66 0.00 0.00 46.19 48.07 1oxa s LEU 392 CO 0.72 -0.35 1.11 -0.60 -1.89 0.00 0.00 176.35 175.34 1oxa s ARG 393 N 2.58 2.78 0.00 1.98 6.06 0.56 -4.70 118.95 128.22 1oxa s ARG 393 Ca 0.10 1.36 0.00 0.00 -2.50 0.00 0.00 55.73 54.69 1oxa s ARG 393 Cb -0.12 -1.95 0.00 0.00 0.06 0.00 0.00 34.95 32.94 1oxa s ARG 393 CO -0.29 -1.26 0.00 0.41 -2.50 0.00 0.00 175.30 171.66 1oxa n GLY 394 N -0.61 -1.50 3.05 8.12 0.00 -1.26 -4.74 105.19 108.25 1oxa n GLY 394 Ca 0.10 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 1oxa n GLY 394 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oxa s ILE 395 N -2.02 1.64 -0.55 -0.61 1.01 -1.26 -0.26 121.20 119.15 1oxa s ILE 395 Ca 0.00 -0.69 0.23 0.00 0.00 0.00 0.00 60.65 60.20 1oxa s ILE 395 Cb 0.00 -1.51 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 1oxa s ILE 395 CO 0.00 0.47 1.19 0.47 0.00 0.00 0.00 174.94 177.07 1oxa n ASP 396 N 4.57 0.70 -3.64 3.58 8.00 -1.26 -4.83 116.55 123.68 1oxa n ASP 396 Ca -0.18 0.08 -0.14 0.00 0.71 0.00 0.00 54.79 55.26 1oxa n ASP 396 Cb 0.50 0.39 -0.13 0.00 -0.02 0.00 0.00 41.12 41.86 1oxa n ASP 396 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1oxa s HIS 397 N -3.22 -0.43 -0.32 1.24 2.46 -1.26 -4.71 115.29 109.06 1oxa s HIS 397 Ca 0.04 0.91 -0.02 0.00 0.47 0.00 0.00 55.06 56.46 1oxa s HIS 397 Cb 0.13 -0.06 0.11 0.00 -0.13 0.00 0.00 32.58 32.63 1oxa s HIS 397 CO 0.76 -0.39 0.16 -1.17 -2.47 0.00 0.00 174.74 171.63 1oxa s LEU 398 N 2.42 0.86 -0.08 8.88 2.96 -1.26 -4.69 118.68 127.77 1oxa s LEU 398 Ca 0.02 -1.65 -0.30 0.00 -0.22 0.00 0.00 54.13 51.99 1oxa s LEU 398 Cb -0.12 -0.42 -0.02 0.00 0.50 0.00 0.00 46.19 46.12 1oxa s LEU 398 CO -0.09 -0.39 1.12 -2.16 -1.32 0.00 0.00 176.35 173.51 1oxa s PRO 399 N 1.68 4.38 0.25 0.98 0.04 -1.26 -1.77 135.00 139.30 1oxa s PRO 399 Ca 0.12 1.56 0.10 0.00 0.04 0.00 0.00 61.00 62.82 1oxa s PRO 399 Cb -0.19 -3.55 -0.05 0.00 0.04 0.00 0.00 34.50 30.75 1oxa s PRO 399 CO -0.23 -0.40 -0.18 0.14 0.04 0.00 0.00 177.00 176.38 1oxa s VAL 400 N 2.14 2.20 -0.20 -0.36 -7.23 -0.65 0.30 120.40 116.60 1oxa s VAL 400 Ca 0.53 -2.33 -0.04 0.00 -1.81 0.00 0.00 61.98 58.33 1oxa s VAL 400 Cb -0.22 -2.20 -0.02 0.00 0.56 0.00 0.00 36.38 34.50 1oxa s VAL 400 CO 0.20 -0.47 -0.04 -0.13 -0.31 0.00 0.00 175.10 174.35 1oxa s ARG 401 N -3.55 3.47 -0.04 4.82 0.52 0.16 -1.97 118.95 122.36 1oxa s ARG 401 Ca 0.27 -0.60 -0.25 0.00 -0.52 0.00 0.00 55.73 54.63 1oxa s ARG 401 Cb -0.03 -2.97 -0.21 0.00 0.52 0.00 0.00 34.95 32.25 1oxa s ARG 401 CO 0.12 -0.06 1.15 -0.07 0.02 0.00 0.00 175.30 176.47 1oxa h LEU 402 N 7.66 0.09 0.00 2.53 3.38 -1.56 -2.09 115.31 125.33 1oxa h LEU 402 Ca -0.37 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 56.98 1oxa h LEU 402 Cb 1.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1oxa h LEU 402 CO 0.60 0.70 -0.13 -2.24 0.09 0.00 0.00 178.44 177.46 1oxa h ASP 403 N -0.51 0.00 0.00 -0.43 2.03 -1.80 -3.18 116.42 112.53 1oxa h ASP 403 Ca -0.00 -0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.28 1oxa h ASP 403 Cb 0.69 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.19 1oxa h ASP 403 CO 0.01 0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.84