#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uop s LEU 2 N 0.00 5.75 -0.42 -0.89 1.02 -1.26 -4.91 118.68 117.97 1uop s LEU 2 Ca 0.00 -1.71 0.05 0.00 0.02 0.00 0.00 54.13 52.48 1uop s LEU 2 Cb 0.00 -2.27 0.55 0.00 0.02 0.00 0.00 46.19 44.49 1uop s LEU 2 CO 0.00 -0.98 1.71 -1.20 0.02 0.00 0.00 176.35 175.90 1uop n SER 3 N 5.77 4.17 -4.21 2.29 7.64 -1.26 -4.94 113.62 123.07 1uop n SER 3 Ca -0.06 -3.73 -0.12 0.00 1.01 0.00 0.00 58.87 55.96 1uop n SER 3 Cb 0.43 -0.75 -0.10 0.00 -1.01 0.00 0.00 64.21 62.78 1uop n SER 3 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1uop s PHE 4 N -3.42 1.16 -0.03 1.43 -0.12 -1.26 -5.16 117.98 110.58 1uop s PHE 4 Ca 0.54 -1.25 0.04 0.00 -0.05 0.00 0.00 56.93 56.20 1uop s PHE 4 Cb 0.45 -0.62 -0.03 0.00 -0.63 0.00 0.00 43.02 42.19 1uop s PHE 4 CO 0.04 -0.49 -0.13 -0.65 -0.05 0.00 0.00 175.22 173.94 1uop s GLN 5 N -4.07 2.47 0.40 1.99 -0.21 -1.26 -5.11 119.66 113.87 1uop s GLN 5 Ca 0.33 -0.73 -0.26 0.00 0.02 0.00 0.00 55.36 54.72 1uop s GLN 5 Cb 0.07 -2.39 -0.09 0.00 1.00 0.00 0.00 33.01 31.60 1uop s GLN 5 CO 0.08 0.61 1.25 0.71 -2.12 0.00 0.00 175.29 175.83 1uop s TYR 6 N -0.82 2.93 0.68 0.91 2.02 -1.26 -4.98 117.35 116.83 1uop s TYR 6 Ca 0.13 1.47 -0.17 0.00 -0.37 0.00 0.00 57.07 58.13 1uop s TYR 6 Cb -0.11 -3.57 0.01 0.00 -0.40 0.00 0.00 41.96 37.90 1uop s TYR 6 CO 0.03 -1.78 1.23 -2.14 -1.57 0.00 0.00 175.55 171.31 1uop s PRO 7 N -2.22 2.43 0.15 -1.71 0.02 -1.26 -4.97 135.00 127.44 1uop s PRO 7 Ca 0.56 1.85 -0.31 0.00 0.02 0.00 0.00 61.00 63.12 1uop s PRO 7 Cb -0.35 -1.86 -0.10 0.00 0.02 0.00 0.00 34.50 32.21 1uop s PRO 7 CO 0.45 -1.63 1.59 -0.51 -0.33 0.00 0.00 177.00 176.57 1uop s ASP 8 N -1.78 6.59 -0.13 2.53 1.01 -1.26 -5.01 116.67 118.61 1uop s ASP 8 Ca 0.77 2.59 -0.03 0.00 0.71 0.00 0.00 52.55 56.59 1uop s ASP 8 Cb -0.31 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.08 1uop s ASP 8 CO 0.41 -0.84 0.04 -0.69 0.21 0.00 0.00 175.17 174.30 1uop s VAL 9 N 1.45 0.28 0.29 -1.27 1.01 -1.26 -5.00 120.40 115.90 1uop s VAL 9 Ca 0.71 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1uop s VAL 9 Cb -0.43 -0.69 -0.11 0.00 0.00 0.00 0.00 36.38 35.16 1uop s VAL 9 CO 0.31 -0.03 1.51 -0.47 0.00 0.00 0.00 175.10 176.42 1uop s TYR 10 N 1.99 2.84 -0.28 5.22 5.04 -1.26 -5.00 117.35 125.89 1uop s TYR 10 Ca 0.02 0.94 -0.08 0.00 -2.44 0.00 0.00 57.07 55.51 1uop s TYR 10 Cb -0.15 -3.96 -0.02 0.00 0.35 0.00 0.00 41.96 38.19 1uop s TYR 10 CO -0.07 -3.12 0.11 1.03 -1.34 0.00 0.00 175.55 172.16 1uop s ARG 11 N -0.73 3.48 -0.96 4.97 0.52 -1.26 -4.73 118.95 120.24 1uop s ARG 11 Ca 0.60 -0.61 -0.20 0.00 -0.52 0.00 0.00 55.73 55.00 1uop s ARG 11 Cb -0.45 -3.44 0.10 0.00 0.52 0.00 0.00 34.95 31.68 1uop s ARG 11 CO 0.49 -0.31 1.23 0.34 0.02 0.00 0.00 175.30 177.07 1uop s ASP 12 N 1.61 6.58 0.00 0.23 2.15 0.08 -4.85 116.67 122.47 1uop s ASP 12 Ca 0.05 -1.84 0.14 0.00 0.43 0.00 0.00 52.55 51.33 1uop s ASP 12 Cb -0.16 -2.45 0.64 0.00 -0.30 0.00 0.00 42.92 40.64 1uop s ASP 12 CO 0.05 -1.21 1.44 -0.62 -0.17 0.00 0.00 175.17 174.65 1uop n GLU 13 N 7.31 0.06 0.03 4.34 -0.58 -1.26 -2.03 120.64 128.51 1uop n GLU 13 Ca 0.27 0.23 0.12 0.00 -0.42 0.00 0.00 57.16 57.36 1uop n GLU 13 Cb 0.50 -1.50 0.31 0.00 -0.57 0.00 0.00 31.44 30.18 1uop n GLU 13 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1uop n THR 14 N -1.44 0.18 -2.46 2.62 -2.24 -1.26 -4.70 114.28 104.98 1uop n THR 14 Ca 0.04 -0.12 -0.39 0.00 -2.27 0.00 0.00 64.05 61.31 1uop n THR 14 Cb 0.15 -0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1uop n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uop s ALA 15 N -3.07 2.74 -0.09 6.98 0.00 -0.86 -4.91 121.76 122.56 1uop s ALA 15 Ca 0.10 -2.43 0.03 0.00 0.00 0.00 0.00 51.96 49.65 1uop s ALA 15 Cb 0.16 -4.60 0.01 0.00 0.00 0.00 0.00 23.12 18.69 1uop s ALA 15 CO 0.66 -3.80 -0.17 0.42 0.00 0.00 0.00 175.76 172.87 1uop s ILE 16 N 5.90 1.57 0.00 0.00 1.01 -1.26 -0.48 121.20 127.93 1uop s ILE 16 Ca 0.54 -0.72 0.07 0.00 0.00 0.00 0.00 60.65 60.54 1uop s ILE 16 Cb 0.01 -1.40 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 1uop s ILE 16 CO 0.01 0.45 -0.21 -1.58 0.00 0.00 0.00 174.94 173.61 1uop s GLN 17 N 0.62 1.65 -0.28 2.79 0.74 0.01 -4.95 119.66 120.24 1uop s GLN 17 Ca -0.14 -0.82 -0.15 0.00 0.05 0.00 0.00 55.36 54.29 1uop s GLN 17 Cb -0.16 -1.64 -0.03 0.00 1.10 0.00 0.00 33.01 32.27 1uop s GLN 17 CO 0.04 0.44 0.39 0.34 -0.55 0.00 0.00 175.29 175.96 1uop s ASP 18 N -0.71 6.27 -0.43 6.67 2.15 -1.26 -0.19 116.67 129.17 1uop s ASP 18 Ca 0.08 0.26 -0.06 0.00 0.43 0.00 0.00 52.55 53.27 1uop s ASP 18 Cb -0.08 -2.22 0.11 0.00 -0.30 0.00 0.00 42.92 40.43 1uop s ASP 18 CO -0.00 -0.22 0.25 -0.31 -0.17 0.00 0.00 175.17 174.73 1uop s TYR 19 N 2.11 3.51 -1.50 -5.34 1.51 0.27 -4.75 117.35 113.15 1uop s TYR 19 Ca 0.16 -2.15 -0.14 0.00 -1.01 0.00 0.00 57.07 53.93 1uop s TYR 19 Cb -0.16 -3.28 0.10 0.00 -0.11 0.00 0.00 41.96 38.51 1uop s TYR 19 CO 0.10 -0.97 0.74 0.72 -1.11 0.00 0.00 175.55 175.04 1uop n HIS 20 N 4.73 -1.95 0.00 2.71 8.25 -1.26 -0.57 115.22 127.13 1uop n HIS 20 Ca -0.05 0.71 0.00 0.00 -0.26 0.00 0.00 57.72 58.12 1uop n HIS 20 Cb 0.41 -3.32 0.00 0.00 1.12 0.00 0.00 29.99 28.21 1uop n HIS 20 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1uop n GLY 21 N -1.41 2.89 3.59 -1.41 0.00 -1.26 -5.04 105.19 102.54 1uop n GLY 21 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1uop n GLY 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1uop s HIS 22 N -2.81 3.23 -0.04 1.61 5.65 0.26 -5.05 115.29 118.15 1uop s HIS 22 Ca 0.00 0.39 -0.28 0.00 0.25 0.00 0.00 55.06 55.42 1uop s HIS 22 Cb 0.00 -2.75 -0.03 0.00 -1.18 0.00 0.00 32.58 28.63 1uop s HIS 22 CO 0.00 -0.36 0.91 0.15 -0.65 0.00 0.00 174.74 174.79 1uop s LYS 23 N 2.26 4.50 -0.15 2.88 -0.14 -1.26 -0.57 119.74 127.26 1uop s LYS 23 Ca 0.18 1.26 0.02 0.00 -1.36 0.00 0.00 55.97 56.07 1uop s LYS 23 Cb -0.16 -3.47 0.02 0.00 -1.68 0.00 0.00 37.83 32.54 1uop s LYS 23 CO 0.11 -0.07 -0.19 0.08 -0.76 0.00 0.00 175.35 174.52 1uop s VAL 24 N 1.15 1.85 -0.03 3.17 1.01 0.74 -4.96 120.40 123.33 1uop s VAL 24 Ca 0.47 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 61.44 1uop s VAL 24 Cb -0.20 -1.67 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 1uop s VAL 24 CO 0.23 0.51 0.51 0.00 0.00 0.00 0.00 175.10 176.35 1uop n ASP 26 N 2.64 2.26 0.20 0.00 2.03 0.36 -4.97 116.55 119.08 1uop n ASP 26 Ca -0.09 -3.11 0.14 0.00 0.52 0.00 0.00 54.79 52.25 1uop n ASP 26 Cb 0.51 -0.66 0.68 0.00 -0.72 0.00 0.00 41.12 40.94 1uop n ASP 26 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1uop h PRO 27 N 4.36 0.00 -0.40 -0.67 0.13 -1.78 -1.86 132.00 131.78 1uop h PRO 27 Ca 0.16 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.20 1uop h PRO 27 Cb 0.76 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.83 1uop h PRO 27 CO 0.67 0.00 0.05 0.66 -0.23 0.00 0.00 178.00 179.15 1uop n TYR 28 N -2.52 1.36 0.11 1.56 4.01 -1.26 -0.75 117.16 119.67 1uop n TYR 28 Ca -0.00 -1.12 0.11 0.00 -0.16 0.00 0.00 57.90 56.73 1uop n TYR 28 Cb 0.14 -0.45 0.61 0.00 -0.31 0.00 0.00 39.34 39.34 1uop n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1uop h ALA 29 N 1.86 2.11 -0.02 -0.72 0.00 -1.71 -0.39 119.26 120.39 1uop h ALA 29 Ca 0.11 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1uop h ALA 29 Cb 1.72 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 1uop h ALA 29 CO 0.39 -0.17 0.08 0.11 0.00 0.00 0.00 179.25 179.66 1uop h TRP 30 N 0.12 0.00 0.00 0.00 5.08 -1.85 -0.54 115.95 118.76 1uop h TRP 30 Ca 0.12 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.09 1uop h TRP 30 Cb 0.35 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.51 1uop h TRP 30 CO -0.00 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 178.44 1uop n LEU 31 N -3.27 0.00 0.24 0.11 4.77 -0.16 -2.68 117.00 116.01 1uop n LEU 31 Ca -0.02 0.28 0.16 0.00 -0.03 0.00 0.00 56.01 56.39 1uop n LEU 31 Cb 0.15 -0.28 0.58 0.00 -2.33 0.00 0.00 43.42 41.55 1uop n LEU 31 CO 0.21 -0.11 0.95 -0.33 -1.33 0.00 0.00 177.39 176.77 1uop h GLU 32 N 0.00 0.00 -4.98 3.23 5.08 -1.27 -3.41 114.58 113.23 1uop h GLU 32 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 1uop h GLU 32 Cb 0.17 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.24 1uop h GLU 32 CO 0.00 0.00 0.14 0.34 -1.00 0.00 0.00 179.01 178.49 1uop s ASP 33 N -5.44 6.22 0.54 1.42 -1.08 -1.09 -4.92 116.67 112.31 1uop s ASP 33 Ca 0.03 -1.03 0.34 0.00 -0.52 0.00 0.00 52.55 51.36 1uop s ASP 33 Cb 0.09 -2.31 1.42 0.00 -1.46 0.00 0.00 42.92 40.65 1uop s ASP 33 CO 0.53 -1.02 1.99 1.55 0.52 0.00 0.00 175.17 178.74 1uop h PRO 34 N 9.12 0.00 -0.00 4.34 0.13 -1.86 -3.17 132.00 140.55 1uop h PRO 34 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1uop h PRO 34 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1uop h PRO 34 CO 1.03 0.00 -0.58 -0.25 -0.23 0.00 0.00 178.00 177.97 1uop n ASP 35 N -3.03 0.81 -4.80 1.44 8.00 -1.26 -4.51 116.55 113.21 1uop n ASP 35 Ca 0.00 -0.63 -0.33 0.00 0.71 0.00 0.00 54.79 54.54 1uop n ASP 35 Cb 0.28 0.43 -0.00 0.00 -0.02 0.00 0.00 41.12 41.81 1uop n ASP 35 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1uop s SER 36 N -2.88 5.88 0.37 -2.24 1.04 -1.20 -4.90 113.70 109.77 1uop s SER 36 Ca 0.13 1.90 0.04 0.00 0.48 0.00 0.00 55.95 58.50 1uop s SER 36 Cb 0.17 -2.55 0.69 0.00 0.10 0.00 0.00 66.02 64.44 1uop s SER 36 CO 0.70 -1.10 2.01 -0.33 0.98 0.00 0.00 173.24 175.51 1uop h GLU 37 N 0.81 0.73 -0.21 4.02 4.39 -1.92 -1.44 114.58 120.96 1uop h GLU 37 Ca -0.48 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.17 1uop h GLU 37 Cb 1.23 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 1uop h GLU 37 CO 0.58 0.50 0.12 1.96 -1.16 0.00 0.00 179.01 181.01 1uop h GLN 38 N 0.74 0.28 -0.21 2.33 7.50 -1.94 0.35 115.11 124.17 1uop h GLN 38 Ca 0.20 -0.03 -0.09 0.00 0.50 0.00 0.00 58.65 59.23 1uop h GLN 38 Cb -0.05 -0.06 -0.00 0.00 0.05 0.00 0.00 27.48 27.42 1uop h GLN 38 CO -0.04 0.24 -0.22 1.15 -1.50 0.00 0.00 178.83 178.46 1uop h THR 39 N 0.25 1.33 -0.96 -0.54 2.02 -1.75 -1.28 112.91 111.97 1uop h THR 39 Ca 0.07 -1.39 0.03 0.00 0.77 0.00 0.00 66.41 65.90 1uop h THR 39 Cb 0.03 1.75 -0.06 0.00 -1.74 0.00 0.00 68.15 68.13 1uop h THR 39 CO -0.01 0.43 0.63 0.11 0.37 0.00 0.00 175.52 177.04 1uop h LYS 40 N 0.20 1.19 -0.38 6.66 1.57 -1.21 -0.62 116.57 123.97 1uop h LYS 40 Ca 0.03 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 1uop h LYS 40 Cb 0.77 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1uop h LYS 40 CO 0.05 0.79 -0.21 0.00 -0.57 0.00 0.00 179.45 179.52 1uop h ALA 41 N 1.39 0.92 -0.18 3.86 0.00 -0.83 -1.79 119.26 122.63 1uop h ALA 41 Ca 0.38 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1uop h ALA 41 Cb -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1uop h ALA 41 CO -0.12 0.62 0.10 0.35 0.00 0.00 0.00 179.25 180.20 1uop h PHE 42 N 0.65 0.25 -0.32 0.00 3.57 -0.50 -0.74 116.94 119.86 1uop h PHE 42 Ca 0.10 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1uop h PHE 42 Cb 0.70 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.34 1uop h PHE 42 CO 0.03 0.24 0.18 0.28 -2.23 0.00 0.00 178.31 176.81 1uop h VAL 43 N 0.19 1.13 -0.38 1.41 2.07 -1.04 -1.53 116.25 118.10 1uop h VAL 43 Ca 0.06 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1uop h VAL 43 Cb 0.07 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1uop h VAL 43 CO -0.01 0.13 0.25 -0.33 0.02 0.00 0.00 177.57 177.64 1uop h GLU 44 N 0.40 0.50 -0.48 1.57 4.39 -1.14 -1.06 114.58 118.76 1uop h GLU 44 Ca 0.11 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 1uop h GLU 44 Cb 0.06 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 1uop h GLU 44 CO -0.02 0.33 0.13 0.00 -1.16 0.00 0.00 179.01 178.30 1uop h ALA 45 N 1.14 1.33 -0.08 3.43 0.00 -0.99 -1.02 119.26 123.07 1uop h ALA 45 Ca 0.14 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1uop h ALA 45 Cb -0.06 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1uop h ALA 45 CO -0.03 0.48 -0.10 1.96 0.00 0.00 0.00 179.25 181.56 1uop h GLN 46 N 0.70 0.21 -0.21 0.00 1.08 -0.91 -3.03 115.11 112.96 1uop h GLN 46 Ca 0.16 -0.12 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1uop h GLN 46 Cb 0.24 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1uop h GLN 46 CO -0.01 0.67 0.12 -0.91 -0.95 0.00 0.00 178.83 177.75 1uop h ASN 47 N -0.23 0.25 0.12 1.46 2.35 -1.10 -1.85 115.58 116.58 1uop h ASN 47 Ca 0.01 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1uop h ASN 47 Cb 0.64 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.94 1uop h ASN 47 CO 0.02 0.19 -0.08 0.50 -1.65 0.00 0.00 177.43 176.41 1uop h LYS 48 N 0.29 0.00 0.01 0.81 3.64 -1.06 -1.78 116.57 118.47 1uop h LYS 48 Ca 0.08 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.10 1uop h LYS 48 Cb -0.00 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.75 1uop h LYS 48 CO -0.01 0.08 -2.23 0.44 -2.27 0.00 0.00 179.45 175.46 1uop n ILE 49 N -4.18 1.48 -0.05 2.00 -5.35 -0.89 -4.46 119.36 107.90 1uop n ILE 49 Ca -0.03 -0.79 -0.12 0.00 -0.27 0.00 0.00 62.75 61.54 1uop n ILE 49 Cb 0.17 -0.82 -0.06 0.00 -1.74 0.00 0.00 39.64 37.18 1uop n ILE 49 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1uop h THR 50 N 0.00 1.29 0.17 7.28 2.02 -1.16 -2.99 112.91 119.52 1uop h THR 50 Ca -0.49 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 65.67 1uop h THR 50 Cb 2.13 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 70.20 1uop h THR 50 CO 0.03 0.30 -0.08 0.58 0.37 0.00 0.00 175.52 176.71 1uop h VAL 51 N -0.02 0.90 -0.61 3.16 2.07 -1.57 -1.05 116.25 119.14 1uop h VAL 51 Ca 0.04 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.34 1uop h VAL 51 Cb 0.48 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 1uop h VAL 51 CO 0.02 0.07 0.41 -0.65 0.02 0.00 0.00 177.57 177.43 1uop h PRO 52 N -0.36 0.49 -0.31 1.57 0.11 -1.78 -1.14 132.00 130.56 1uop h PRO 52 Ca -0.02 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 1uop h PRO 52 Cb 0.29 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 1uop h PRO 52 CO 0.04 0.32 0.12 0.35 -0.21 0.00 0.00 178.00 178.62 1uop h PHE 53 N 0.51 0.48 0.00 0.65 3.57 -1.25 -1.74 116.94 119.16 1uop h PHE 53 Ca 0.28 -0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.65 1uop h PHE 53 Cb 0.43 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1uop h PHE 53 CO -0.00 0.47 -0.42 -0.07 -2.23 0.00 0.00 178.31 176.06 1uop h LEU 54 N 0.36 0.00 -1.02 0.59 3.38 -0.52 -3.26 115.31 114.84 1uop h LEU 54 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1uop h LEU 54 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1uop h LEU 54 CO -0.01 0.42 -0.46 -0.62 0.09 0.00 0.00 178.44 177.86 1uop n GLU 55 N -3.99 1.27 0.02 1.13 1.02 -0.50 -4.52 120.64 115.06 1uop n GLU 55 Ca -0.02 -1.02 -0.10 0.00 -0.02 0.00 0.00 57.16 56.00 1uop n GLU 55 Cb 0.45 -1.47 -0.05 0.00 -0.02 0.00 0.00 31.44 30.36 1uop n GLU 55 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1uop h GLN 56 N 2.47 -0.09 -6.27 3.49 4.15 -1.36 -3.42 115.11 114.07 1uop h GLN 56 Ca 0.00 0.01 -0.55 0.00 0.77 0.00 0.00 58.65 58.88 1uop h GLN 56 Cb 0.75 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.43 1uop h GLN 56 CO 0.00 -0.06 0.16 0.00 -1.93 0.00 0.00 178.83 177.00 1uop n PRO 58 N 2.93 0.09 -0.19 0.00 -0.04 -1.26 -2.35 135.00 134.19 1uop n PRO 58 Ca -0.02 0.57 0.09 0.00 -0.04 0.00 0.00 63.50 64.10 1uop n PRO 58 Cb 0.50 -2.04 0.39 0.00 -0.04 0.00 0.00 33.50 32.31 1uop n PRO 58 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1uop h ILE 59 N 0.00 0.94 -0.61 0.52 2.10 -1.94 -1.24 117.51 117.28 1uop h ILE 59 Ca 0.00 -0.23 0.01 0.00 1.08 0.00 0.00 64.86 65.72 1uop h ILE 59 Cb 0.47 0.22 -0.03 0.00 -1.09 0.00 0.00 36.82 36.38 1uop h ILE 59 CO 0.00 0.12 0.40 -0.09 -1.08 0.00 0.00 178.15 177.50 1uop h ARG 60 N 0.66 0.79 -0.53 2.19 2.43 -1.75 0.33 114.38 118.50 1uop h ARG 60 Ca 0.34 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.35 1uop h ARG 60 Cb 0.46 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1uop h ARG 60 CO -0.12 0.52 -0.14 0.78 -1.51 0.00 0.00 179.97 179.50 1uop h GLY 61 N 0.81 1.11 0.90 2.80 0.00 -1.48 0.71 103.07 107.92 1uop h GLY 61 Ca 0.23 -0.92 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 1uop h GLY 61 CO -0.06 0.84 0.09 1.41 0.00 0.00 0.00 176.54 178.82 1uop h LEU 62 N 0.90 0.46 -0.09 3.11 3.38 -1.09 -1.08 115.31 120.91 1uop h LEU 62 Ca 0.13 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1uop h LEU 62 Cb 0.71 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1uop h LEU 62 CO 0.05 0.56 0.05 0.22 0.09 0.00 0.00 178.44 179.41 1uop h TYR 63 N 0.35 0.12 -0.63 1.13 5.03 -0.82 -0.82 116.97 121.32 1uop h TYR 63 Ca 0.10 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.44 1uop h TYR 63 Cb 0.27 -0.04 -0.04 0.00 1.55 0.00 0.00 36.73 38.47 1uop h TYR 63 CO 0.01 0.13 0.38 -0.22 -1.32 0.00 0.00 178.16 177.14 1uop h LYS 64 N 0.07 0.73 -0.18 1.82 3.64 -0.80 0.21 116.57 122.05 1uop h LYS 64 Ca 0.03 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1uop h LYS 64 Cb 0.05 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1uop h LYS 64 CO -0.01 0.48 0.08 1.49 -2.27 0.00 0.00 179.45 179.22 1uop h GLU 65 N 0.75 0.27 -0.62 1.90 4.81 -1.09 -0.16 114.58 120.44 1uop h GLU 65 Ca 0.26 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 1uop h GLU 65 Cb 0.04 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1uop h GLU 65 CO -0.11 0.32 0.27 -0.09 -0.73 0.00 0.00 179.01 178.67 1uop h ARG 66 N 0.15 0.91 -0.68 1.92 9.65 -0.73 -1.15 114.38 124.45 1uop h ARG 66 Ca 0.06 -0.15 -0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1uop h ARG 66 Cb 0.15 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.54 1uop h ARG 66 CO -0.01 0.75 0.42 1.98 2.80 0.00 0.00 179.97 185.91 1uop h MET 67 N 0.85 0.92 -0.67 0.20 4.05 -0.48 0.11 114.93 119.90 1uop h MET 67 Ca 0.21 -0.08 -0.06 0.00 -0.28 0.00 0.00 59.70 59.49 1uop h MET 67 Cb 0.17 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 30.75 1uop h MET 67 CO -0.02 0.65 0.20 1.15 0.23 0.00 0.00 176.91 179.12 1uop h THR 68 N 0.92 1.25 0.11 -0.77 2.02 -0.74 0.64 112.91 116.35 1uop h THR 68 Ca 0.24 -0.88 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 1uop h THR 68 Cb -0.04 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1uop h THR 68 CO -0.05 0.34 -0.05 -0.33 0.37 0.00 0.00 175.52 175.80 1uop h GLU 69 N 0.98 -0.14 0.00 6.66 5.08 -0.94 -3.15 114.58 123.08 1uop h GLU 69 Ca 0.22 0.01 -0.18 0.00 -1.00 0.00 0.00 59.36 58.40 1uop h GLU 69 Cb 0.31 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1uop h GLU 69 CO -0.01 0.21 -0.85 -0.07 -1.00 0.00 0.00 179.01 177.30 1uop h LEU 70 N -0.51 0.10 -0.03 1.33 3.38 -0.71 -2.92 115.31 115.94 1uop h LEU 70 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1uop h LEU 70 Cb 0.41 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1uop h LEU 70 CO 0.02 0.90 0.00 0.00 0.09 0.00 0.00 178.44 179.45 1uop n TYR 71 N -3.59 0.17 -2.18 1.13 9.36 0.21 -4.37 117.16 117.88 1uop n TYR 71 Ca -0.02 0.05 -0.42 0.00 3.32 0.00 0.00 57.90 60.83 1uop n TYR 71 Cb 0.80 -0.58 -0.00 0.00 -0.63 0.00 0.00 39.34 38.93 1uop n TYR 71 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 1uop n ASP 72 N -1.64 4.43 -4.06 2.98 2.03 -1.11 -4.73 116.55 114.45 1uop n ASP 72 Ca 0.06 -2.88 -0.13 0.00 0.52 0.00 0.00 54.79 52.36 1uop n ASP 72 Cb 0.31 -1.71 -0.11 0.00 -0.72 0.00 0.00 41.12 38.89 1uop n ASP 72 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1uop s TYR 73 N 3.80 0.66 0.28 -0.67 -0.85 -1.26 -4.94 117.35 114.37 1uop s TYR 73 Ca 0.51 -0.53 -0.30 0.00 -0.52 0.00 0.00 57.07 56.23 1uop s TYR 73 Cb 0.09 -0.40 -0.12 0.00 0.38 0.00 0.00 41.96 41.91 1uop s TYR 73 CO 0.00 -0.09 1.63 -0.35 -1.52 0.00 0.00 175.55 175.22 1uop n PRO 74 N 1.39 2.75 -4.02 -3.49 -0.04 -1.24 -3.98 135.00 126.37 1uop n PRO 74 Ca -0.22 0.98 -0.31 0.00 -0.04 0.00 0.00 63.50 63.91 1uop n PRO 74 Cb 0.55 -2.78 -0.16 0.00 -0.04 0.00 0.00 33.50 31.07 1uop n PRO 74 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1uop s LYS 75 N -0.25 2.21 0.04 0.54 1.02 -0.20 -4.93 119.74 118.18 1uop s LYS 75 Ca 0.66 -0.78 0.07 0.00 0.02 0.00 0.00 55.97 55.93 1uop s LYS 75 Cb -0.49 -2.36 -0.03 0.00 -0.52 0.00 0.00 37.83 34.43 1uop s LYS 75 CO 0.46 -0.36 -0.18 0.71 -0.92 0.00 0.00 175.35 175.06 1uop s TYR 76 N 1.40 2.56 0.55 3.18 2.02 -1.26 -0.73 117.35 125.07 1uop s TYR 76 Ca 0.01 -0.25 -0.02 0.00 -0.37 0.00 0.00 57.07 56.43 1uop s TYR 76 Cb -0.15 -1.47 0.02 0.00 -0.40 0.00 0.00 41.96 39.96 1uop s TYR 76 CO -0.09 0.25 0.81 -1.54 -1.57 0.00 0.00 175.55 173.41 1uop s SER 77 N -1.40 5.49 0.43 2.29 1.04 -0.07 -4.99 113.70 116.48 1uop s SER 77 Ca 0.14 0.37 -0.25 0.00 0.48 0.00 0.00 55.95 56.69 1uop s SER 77 Cb -0.10 -1.37 -0.09 0.00 0.10 0.00 0.00 66.02 64.55 1uop s SER 77 CO 0.05 -1.04 1.29 0.00 0.98 0.00 0.00 173.24 174.53 1uop s HIS 79 N -1.20 2.35 -0.00 0.00 3.76 -1.26 -4.54 115.29 114.40 1uop s HIS 79 Ca 0.61 1.36 -0.03 0.00 -0.15 0.00 0.00 55.06 56.85 1uop s HIS 79 Cb -0.50 -3.81 -0.00 0.00 1.11 0.00 0.00 32.58 29.38 1uop s HIS 79 CO 0.58 -2.85 0.05 -0.59 -0.85 0.00 0.00 174.74 171.08 1uop s PHE 80 N -1.29 0.08 -0.16 1.40 -0.71 0.26 -4.66 117.98 112.90 1uop s PHE 80 Ca 0.69 -0.17 -0.09 0.00 -1.04 0.00 0.00 56.93 56.33 1uop s PHE 80 Cb -0.41 -0.07 -0.05 0.00 -1.21 0.00 0.00 43.02 41.28 1uop s PHE 80 CO 0.49 -0.16 0.13 0.21 -1.34 0.00 0.00 175.22 174.55 1uop s LYS 81 N -0.89 3.84 -0.08 1.99 2.20 -1.26 -0.46 119.74 125.08 1uop s LYS 81 Ca -0.10 -0.18 -0.01 0.00 -0.36 0.00 0.00 55.97 55.32 1uop s LYS 81 Cb -0.06 -3.31 0.03 0.00 -1.51 0.00 0.00 37.83 32.98 1uop s LYS 81 CO 0.00 0.52 -0.03 0.15 -0.36 0.00 0.00 175.35 175.64 1uop s LYS 82 N -0.28 0.89 7.25 4.03 -0.14 -0.22 -4.99 119.74 126.27 1uop s LYS 82 Ca 0.11 -0.02 0.00 0.00 -1.36 0.00 0.00 55.97 54.71 1uop s LYS 82 Cb -0.11 -1.13 0.00 0.00 -1.68 0.00 0.00 37.83 34.91 1uop s LYS 82 CO 0.01 -0.27 0.00 0.41 -0.76 0.00 0.00 175.35 174.74 1uop n GLY 83 N 4.96 3.42 1.24 -3.33 0.00 -1.25 -2.10 105.19 108.13 1uop n GLY 83 Ca -0.11 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.82 1uop n GLY 83 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1uop n LYS 84 N 14.00 2.98 -4.39 1.61 2.85 -1.26 -4.94 118.16 129.02 1uop n LYS 84 Ca 0.00 -2.11 -0.24 0.00 -1.05 0.00 0.00 58.31 54.92 1uop n LYS 84 Cb 0.00 -1.71 -0.11 0.00 -0.65 0.00 0.00 35.03 32.55 1uop n LYS 84 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1uop s ARG 85 N -1.74 1.42 -0.01 -1.58 0.52 -0.89 -4.63 118.95 112.04 1uop s ARG 85 Ca 0.38 -1.51 -0.00 0.00 -0.52 0.00 0.00 55.73 54.08 1uop s ARG 85 Cb 0.24 -1.57 -0.04 0.00 0.52 0.00 0.00 34.95 34.10 1uop s ARG 85 CO 0.19 0.32 0.07 0.71 0.02 0.00 0.00 175.30 176.61 1uop s TYR 86 N -2.00 3.27 0.11 -0.53 2.02 0.93 -1.06 117.35 120.10 1uop s TYR 86 Ca 0.20 0.20 0.06 0.00 -0.37 0.00 0.00 57.07 57.16 1uop s TYR 86 Cb -0.06 -1.74 -0.04 0.00 -0.40 0.00 0.00 41.96 39.72 1uop s TYR 86 CO 0.09 0.54 -0.15 -0.06 -1.57 0.00 0.00 175.55 174.40 1uop s PHE 87 N -1.18 1.45 0.03 2.71 0.40 0.40 -0.51 117.98 121.28 1uop s PHE 87 Ca 0.22 -0.52 -0.27 0.00 -0.60 0.00 0.00 56.93 55.77 1uop s PHE 87 Cb -0.12 -0.77 0.07 0.00 0.51 0.00 0.00 43.02 42.71 1uop s PHE 87 CO 0.13 0.15 0.62 1.52 0.70 0.00 0.00 175.22 178.34 1uop s TYR 88 N -1.87 -0.57 0.11 0.36 1.13 -0.92 -0.58 117.35 115.02 1uop s TYR 88 Ca 0.07 0.74 -0.11 0.00 -1.41 0.00 0.00 57.07 56.37 1uop s TYR 88 Cb -0.06 0.44 -0.06 0.00 -1.10 0.00 0.00 41.96 41.17 1uop s TYR 88 CO 0.03 -0.68 0.45 -0.06 -2.51 0.00 0.00 175.55 172.78 1uop s PHE 89 N -2.22 3.57 -0.21 -3.49 0.08 -1.26 -0.45 117.98 114.01 1uop s PHE 89 Ca -0.06 0.86 -0.15 0.00 0.12 0.00 0.00 56.93 57.69 1uop s PHE 89 Cb -0.01 -2.21 0.06 0.00 -0.57 0.00 0.00 43.02 40.29 1uop s PHE 89 CO 0.01 0.47 0.52 -0.47 -0.10 0.00 0.00 175.22 175.65 1uop s TYR 90 N -1.46 -0.69 -0.13 0.36 5.04 0.04 -0.90 117.35 119.60 1uop s TYR 90 Ca 0.36 1.53 0.03 0.00 -2.44 0.00 0.00 57.07 56.54 1uop s TYR 90 Cb -0.14 0.31 0.01 0.00 0.35 0.00 0.00 41.96 42.49 1uop s TYR 90 CO 0.19 -0.35 -0.21 1.21 -1.34 0.00 0.00 175.55 175.04 1uop s ASN 91 N 0.94 3.03 0.60 4.32 3.84 0.09 -0.75 114.94 127.01 1uop s ASN 91 Ca -0.05 -0.58 0.32 0.00 0.21 0.00 0.00 52.86 52.76 1uop s ASN 91 Cb -0.06 -1.40 1.90 0.00 -0.55 0.00 0.00 41.25 41.14 1uop s ASN 91 CO -0.08 0.08 2.26 0.71 -2.79 0.00 0.00 177.10 177.27 1uop h THR 92 N 5.83 0.43 0.00 -5.21 1.35 -1.88 -0.51 112.91 112.92 1uop h THR 92 Ca -0.31 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1uop h THR 92 Cb 1.19 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1uop h THR 92 CO 0.54 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.44 1uop n GLY 93 N -1.18 0.51 0.02 5.82 0.00 -1.26 -3.65 105.19 105.45 1uop n GLY 93 Ca -0.03 0.13 0.02 0.00 0.00 0.00 0.00 46.02 46.14 1uop n GLY 93 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uop n LEU 94 N 0.00 2.01 -4.76 0.99 4.77 -1.26 -4.41 117.00 114.33 1uop n LEU 94 Ca 0.00 -2.19 -0.39 0.00 -0.03 0.00 0.00 56.01 53.40 1uop n LEU 94 Cb 0.00 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 1uop n LEU 94 CO 0.00 0.53 0.98 -1.10 -1.33 0.00 0.00 177.39 176.48 1uop s GLN 95 N -1.40 3.68 0.28 3.23 -0.21 -1.26 -4.81 119.66 119.17 1uop s GLN 95 Ca 0.07 2.21 -0.04 0.00 0.02 0.00 0.00 55.36 57.62 1uop s GLN 95 Cb 0.06 -2.58 0.37 0.00 1.00 0.00 0.00 33.01 31.87 1uop s GLN 95 CO 0.01 -0.75 1.95 -0.91 -2.12 0.00 0.00 175.29 173.47 1uop h ASN 96 N 2.23 1.04 -4.27 5.90 2.35 -1.95 -3.40 115.58 117.48 1uop h ASN 96 Ca -0.50 -0.03 -0.47 0.00 -0.55 0.00 0.00 56.30 54.76 1uop h ASN 96 Cb 1.26 -0.26 -0.27 0.00 0.05 0.00 0.00 38.32 39.11 1uop h ASN 96 CO 0.61 0.75 -0.80 -1.10 -1.65 0.00 0.00 177.43 175.23 1uop s GLN 97 N -6.01 1.03 0.61 0.81 -1.52 -1.26 -1.44 119.66 111.88 1uop s GLN 97 Ca -0.12 -0.66 -0.18 0.00 -1.95 0.00 0.00 55.36 52.46 1uop s GLN 97 Cb 0.18 -1.03 -0.02 0.00 -0.22 0.00 0.00 33.01 31.92 1uop s GLN 97 CO 0.80 0.27 1.16 -0.98 -0.25 0.00 0.00 175.29 176.29 1uop s ARG 98 N -0.80 2.95 -0.07 2.91 1.70 -1.26 -4.75 118.95 119.63 1uop s ARG 98 Ca 0.03 1.64 -0.00 0.00 -0.47 0.00 0.00 55.73 56.94 1uop s ARG 98 Cb -0.07 -1.95 -0.03 0.00 -0.57 0.00 0.00 34.95 32.33 1uop s ARG 98 CO 0.01 -1.18 -0.04 0.08 -1.08 0.00 0.00 175.30 173.08 1uop s VAL 99 N -1.88 3.94 -0.22 4.99 1.01 0.07 -4.57 120.40 123.75 1uop s VAL 99 Ca 0.73 -0.41 -0.20 0.00 0.00 0.00 0.00 61.98 62.10 1uop s VAL 99 Cb -0.26 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 1uop s VAL 99 CO 0.35 0.58 0.61 -0.22 0.00 0.00 0.00 175.10 176.42 1uop s LEU 100 N -0.90 4.11 0.20 3.92 2.96 -0.06 -0.78 118.68 128.13 1uop s LEU 100 Ca 0.13 0.75 0.06 0.00 -0.22 0.00 0.00 54.13 54.86 1uop s LEU 100 Cb -0.11 -2.85 -0.04 0.00 0.50 0.00 0.00 46.19 43.69 1uop s LEU 100 CO 0.02 -0.30 0.12 -0.31 -1.32 0.00 0.00 176.35 174.56 1uop s TYR 101 N 2.14 3.04 0.03 5.38 1.51 0.40 -0.08 117.35 129.78 1uop s TYR 101 Ca 0.27 -0.08 0.05 0.00 -1.01 0.00 0.00 57.07 56.30 1uop s TYR 101 Cb -0.16 -1.43 -0.02 0.00 -0.11 0.00 0.00 41.96 40.25 1uop s TYR 101 CO 0.09 0.53 -0.16 0.54 -1.11 0.00 0.00 175.55 175.45 1uop s VAL 102 N -1.91 1.24 0.01 0.71 0.11 -0.35 -2.17 120.40 118.04 1uop s VAL 102 Ca 0.31 -0.98 -0.01 0.00 -2.93 0.00 0.00 61.98 58.36 1uop s VAL 102 Cb -0.09 -1.10 -0.01 0.00 -1.53 0.00 0.00 36.38 33.65 1uop s VAL 102 CO 0.23 0.10 0.01 0.00 -3.33 0.00 0.00 175.10 172.10 1uop s GLN 103 N -1.03 0.23 0.06 1.54 -2.07 0.33 -0.79 119.66 117.94 1uop s GLN 103 Ca 0.03 -0.35 0.27 0.00 -1.82 0.00 0.00 55.36 53.50 1uop s GLN 103 Cb -0.08 0.09 1.09 0.00 -1.09 0.00 0.00 33.01 33.02 1uop s GLN 103 CO 0.01 -0.04 1.86 -0.25 -1.32 0.00 0.00 175.29 175.55 1uop n ASP 104 N 2.12 0.23 -3.48 12.60 8.00 -1.26 -0.05 116.55 134.71 1uop n ASP 104 Ca -0.20 0.52 -0.11 0.00 0.71 0.00 0.00 54.79 55.72 1uop n ASP 104 Cb 0.57 -0.59 -0.02 0.00 -0.02 0.00 0.00 41.12 41.06 1uop n ASP 104 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1uop s SER 105 N -3.43 -0.49 0.47 -2.24 1.04 -1.26 -4.64 113.70 103.14 1uop s SER 105 Ca 0.13 -0.06 0.17 0.00 0.48 0.00 0.00 55.95 56.67 1uop s SER 105 Cb 0.17 0.56 1.16 0.00 0.10 0.00 0.00 66.02 68.01 1uop s SER 105 CO 0.53 -0.92 2.01 0.25 0.98 0.00 0.00 173.24 176.09 1uop h LEU 106 N 2.00 0.22 -0.67 2.42 5.85 -1.97 0.34 115.31 123.50 1uop h LEU 106 Ca -0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1uop h LEU 106 Cb 1.29 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1uop h LEU 106 CO 0.35 0.13 -0.41 -0.62 -0.34 0.00 0.00 178.44 177.55 1uop n GLU 107 N -4.46 0.92 -2.26 1.25 1.02 -1.26 -4.98 120.64 110.87 1uop n GLU 107 Ca 0.08 -0.67 -0.33 0.00 -0.02 0.00 0.00 57.16 56.22 1uop n GLU 107 Cb 0.38 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.30 1uop n GLU 107 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1uop s GLY 108 N -2.54 2.14 0.19 0.62 0.00 0.11 -5.00 107.32 102.83 1uop s GLY 108 Ca 0.20 0.32 -0.31 0.00 0.00 0.00 0.00 44.72 44.93 1uop s GLY 108 CO 0.57 0.62 1.60 1.85 0.00 0.00 0.00 173.10 177.75 1uop s GLU 109 N -3.98 4.19 0.27 2.90 2.12 -1.26 -4.80 118.70 118.13 1uop s GLU 109 Ca 0.62 2.44 -0.12 0.00 0.36 0.00 0.00 54.97 58.27 1uop s GLU 109 Cb -0.13 -3.12 -0.08 0.00 0.26 0.00 0.00 34.13 31.06 1uop s GLU 109 CO 0.32 -0.64 0.63 0.00 -0.54 0.00 0.00 175.26 175.04 1uop s ALA 110 N 0.97 3.46 0.09 6.30 0.00 -1.26 -4.48 121.76 126.85 1uop s ALA 110 Ca 0.70 -0.13 0.02 0.00 0.00 0.00 0.00 51.96 52.55 1uop s ALA 110 Cb -0.46 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.04 1uop s ALA 110 CO 0.34 0.43 -0.08 -0.98 0.00 0.00 0.00 175.76 175.47 1uop s ARG 111 N -2.84 0.82 0.17 0.00 1.70 0.03 -4.97 118.95 113.85 1uop s ARG 111 Ca 0.50 -1.24 -0.32 0.00 -0.47 0.00 0.00 55.73 54.20 1uop s ARG 111 Cb -0.11 -0.31 -0.11 0.00 -0.57 0.00 0.00 34.95 33.85 1uop s ARG 111 CO 0.19 0.02 1.79 0.28 -1.08 0.00 0.00 175.30 176.50 1uop n VAL 112 N 0.25 0.20 -0.11 4.99 0.31 -1.26 -1.21 118.33 121.49 1uop n VAL 112 Ca -0.14 -0.04 -0.22 0.00 -0.01 0.00 0.00 64.34 63.94 1uop n VAL 112 Cb 0.59 -2.07 -0.07 0.00 -0.91 0.00 0.00 33.84 31.38 1uop n VAL 112 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1uop n PHE 113 N 4.88 0.00 -3.68 3.52 7.35 0.89 -4.81 117.46 125.61 1uop n PHE 113 Ca 0.17 0.00 -0.21 0.00 -0.76 0.00 0.00 57.45 56.65 1uop n PHE 113 Cb 0.36 -0.76 -0.18 0.00 0.35 0.00 0.00 39.48 39.26 1uop n PHE 113 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1uop s LEU 114 N -7.32 0.24 -0.45 -2.13 2.96 -0.60 -4.97 118.68 106.41 1uop s LEU 114 Ca -0.31 -0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1uop s LEU 114 Cb 0.11 -0.20 0.12 0.00 0.50 0.00 0.00 46.19 46.72 1uop s LEU 114 CO 0.39 -0.26 0.22 -0.62 -1.32 0.00 0.00 176.35 174.77 1uop s ASP 115 N 2.14 4.99 0.62 3.68 2.15 -1.26 -0.88 116.67 128.11 1uop s ASP 115 Ca 0.05 -2.37 0.40 0.00 0.43 0.00 0.00 52.55 51.05 1uop s ASP 115 Cb -0.13 -1.76 2.03 0.00 -0.30 0.00 0.00 42.92 42.77 1uop s ASP 115 CO -0.04 -0.42 2.23 -0.65 -0.17 0.00 0.00 175.17 176.12 1uop h PRO 116 N 7.50 0.00 -0.02 4.34 0.11 -1.90 -3.08 132.00 138.95 1uop h PRO 116 Ca -0.08 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1uop h PRO 116 Cb 1.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1uop h PRO 116 CO 0.66 0.01 -0.04 -0.91 -0.21 0.00 0.00 178.00 177.50 1uop h ASN 117 N 0.00 0.03 0.16 -2.05 2.35 -1.86 -1.42 115.58 112.79 1uop h ASN 117 Ca -0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1uop h ASN 117 Cb 0.18 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1uop h ASN 117 CO 0.00 0.08 -0.01 2.30 -1.65 0.00 0.00 177.43 178.15 1uop n ILE 118 N -4.47 0.00 1.05 2.81 -5.35 -1.16 -3.59 119.36 108.64 1uop n ILE 118 Ca -0.02 -0.02 0.13 0.00 -0.27 0.00 0.00 62.75 62.56 1uop n ILE 118 Cb 0.13 -0.39 0.38 0.00 -1.74 0.00 0.00 39.64 38.03 1uop n ILE 118 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1uop n LEU 119 N -0.97 0.40 -3.49 7.28 4.77 -0.53 -4.91 117.00 119.55 1uop n LEU 119 Ca 0.21 0.11 -0.16 0.00 -0.03 0.00 0.00 56.01 56.14 1uop n LEU 119 Cb 0.17 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 40.92 1uop n LEU 119 CO 0.20 0.09 0.41 -0.94 -1.33 0.00 0.00 177.39 175.82 1uop s SER 120 N -2.93 -0.61 0.32 -1.43 1.04 -1.24 -4.84 113.70 104.02 1uop s SER 120 Ca 0.14 0.44 0.00 0.00 0.48 0.00 0.00 55.95 57.01 1uop s SER 120 Cb 0.18 0.56 0.52 0.00 0.10 0.00 0.00 66.02 67.38 1uop s SER 120 CO 0.63 -0.74 1.94 0.44 0.98 0.00 0.00 173.24 176.49 1uop h ASP 121 N 2.66 0.78 -0.25 7.02 5.19 -1.91 -3.25 116.42 126.65 1uop h ASP 121 Ca -0.30 -0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 1uop h ASP 121 Cb 1.20 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.51 1uop h ASP 121 CO 0.39 0.64 0.00 -0.90 -3.12 0.00 0.00 179.24 176.24 1uop n ASP 122 N -4.38 3.06 -1.53 6.45 5.68 -1.26 -4.97 116.55 119.60 1uop n ASP 122 Ca 0.06 -2.38 -0.15 0.00 -0.50 0.00 0.00 54.79 51.82 1uop n ASP 122 Cb 0.10 -0.31 -0.02 0.00 -1.14 0.00 0.00 41.12 39.75 1uop n ASP 122 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uop n GLY 123 N -0.05 0.25 1.18 6.12 0.00 -1.23 -4.82 105.19 106.63 1uop n GLY 123 Ca 0.13 -0.28 0.10 0.00 0.00 0.00 0.00 46.02 45.97 1uop n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uop n THR 124 N -3.62 0.86 -3.86 2.61 -2.24 -1.26 -4.04 114.28 102.73 1uop n THR 124 Ca -0.17 -0.86 -0.36 0.00 -2.27 0.00 0.00 64.05 60.40 1uop n THR 124 Cb 0.59 0.42 -0.11 0.00 -2.10 0.00 0.00 70.33 69.14 1uop n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1uop s VAL 125 N -1.15 4.68 0.05 2.28 1.01 -1.26 0.16 120.40 126.17 1uop s VAL 125 Ca 0.43 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.39 1uop s VAL 125 Cb 0.22 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1uop s VAL 125 CO 0.29 0.38 -0.12 0.00 0.00 0.00 0.00 175.10 175.65 1uop s ALA 126 N 1.03 1.01 0.23 5.51 0.00 -0.45 -4.79 121.76 124.28 1uop s ALA 126 Ca 0.05 -0.84 -0.30 0.00 0.00 0.00 0.00 51.96 50.86 1uop s ALA 126 Cb -0.14 -0.10 -0.10 0.00 0.00 0.00 0.00 23.12 22.78 1uop s ALA 126 CO 0.03 0.15 1.48 -1.17 0.00 0.00 0.00 175.76 176.25 1uop s LEU 127 N -1.38 4.38 -0.34 0.00 2.96 -1.26 -0.95 118.68 122.09 1uop s LEU 127 Ca -0.02 2.66 -0.01 0.00 -0.22 0.00 0.00 54.13 56.54 1uop s LEU 127 Cb -0.09 -3.62 0.13 0.00 0.50 0.00 0.00 46.19 43.11 1uop s LEU 127 CO 0.01 -0.75 0.18 -0.60 -1.32 0.00 0.00 176.35 173.88 1uop s ARG 128 N 0.06 0.50 0.00 1.98 3.52 0.79 -4.85 118.95 120.95 1uop s ARG 128 Ca 0.63 -1.12 0.00 0.00 -0.13 0.00 0.00 55.73 55.11 1uop s ARG 128 Cb -0.43 -1.37 0.00 0.00 -1.56 0.00 0.00 34.95 31.59 1uop s ARG 128 CO 0.40 -1.14 0.00 0.41 -0.81 0.00 0.00 175.30 174.16 1uop n GLY 129 N 4.42 -0.97 3.51 8.12 0.00 -1.26 -3.69 105.19 115.32 1uop n GLY 129 Ca 0.06 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.55 1uop n GLY 129 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1uop s TYR 130 N -2.90 -0.41 -0.20 1.61 -0.85 -1.26 -0.73 117.35 112.62 1uop s TYR 130 Ca 0.00 0.20 -0.11 0.00 -0.52 0.00 0.00 57.07 56.64 1uop s TYR 130 Cb 0.00 0.57 0.06 0.00 0.38 0.00 0.00 41.96 42.98 1uop s TYR 130 CO 0.00 -0.77 0.48 0.00 -1.52 0.00 0.00 175.55 173.74 1uop s ALA 131 N -3.50 -1.25 0.19 9.51 0.00 -0.28 -4.94 121.76 121.49 1uop s ALA 131 Ca 0.04 1.75 -0.13 0.00 0.00 0.00 0.00 51.96 53.62 1uop s ALA 131 Cb -0.01 -1.05 -0.07 0.00 0.00 0.00 0.00 23.12 21.98 1uop s ALA 131 CO -0.09 -0.29 0.58 -0.06 0.00 0.00 0.00 175.76 175.90 1uop s PHE 132 N 1.45 3.53 0.90 0.00 0.40 -1.26 -0.79 117.98 122.20 1uop s PHE 132 Ca -0.10 1.04 -0.12 0.00 -0.60 0.00 0.00 56.93 57.16 1uop s PHE 132 Cb -0.08 -2.37 0.09 0.00 0.51 0.00 0.00 43.02 41.18 1uop s PHE 132 CO -0.14 0.34 0.90 -1.13 0.70 0.00 0.00 175.22 175.89 1uop n SER 133 N 0.39 -0.34 -0.26 1.36 3.41 0.22 -4.72 113.62 113.68 1uop n SER 133 Ca -0.02 0.44 0.06 0.00 -0.26 0.00 0.00 58.87 59.08 1uop n SER 133 Cb 0.52 -1.39 0.29 0.00 -0.26 0.00 0.00 64.21 63.37 1uop n SER 133 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1uop h GLU 134 N -1.51 0.88 -0.00 4.33 4.57 -1.87 0.33 114.58 121.31 1uop h GLU 134 Ca -0.44 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 1uop h GLU 134 Cb 1.28 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 1uop h GLU 134 CO 0.40 0.58 -0.01 -0.40 -1.18 0.00 0.00 179.01 178.40 1uop n ASP 135 N -4.50 0.21 0.00 1.04 5.68 -1.26 -4.57 116.55 113.15 1uop n ASP 135 Ca 0.13 -0.91 0.00 0.00 -0.50 0.00 0.00 54.79 53.52 1uop n ASP 135 Cb 0.25 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 1uop n ASP 135 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uop n GLY 136 N 1.08 0.35 0.05 6.12 0.00 0.11 -3.77 105.19 109.12 1uop n GLY 136 Ca 0.21 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.35 1uop n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uop n GLU 137 N -1.62 0.38 -4.26 1.61 -0.58 -1.26 -4.67 120.64 110.23 1uop n GLU 137 Ca 0.00 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.55 1uop n GLU 137 Cb 0.16 -1.63 -0.11 0.00 -0.57 0.00 0.00 31.44 29.29 1uop n GLU 137 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1uop s TYR 138 N -3.25 1.50 -0.06 -0.32 1.51 -1.26 -0.63 117.35 114.83 1uop s TYR 138 Ca 0.02 -0.53 -0.02 0.00 -1.01 0.00 0.00 57.07 55.53 1uop s TYR 138 Cb 0.13 -0.78 0.04 0.00 -0.11 0.00 0.00 41.96 41.25 1uop s TYR 138 CO 0.81 0.18 0.12 0.12 -1.11 0.00 0.00 175.55 175.67 1uop s PHE 139 N -2.05 -0.12 -0.02 2.71 5.36 -0.42 -0.61 117.98 122.83 1uop s PHE 139 Ca 0.10 0.45 0.02 0.00 -0.96 0.00 0.00 56.93 56.54 1uop s PHE 139 Cb -0.05 -0.20 -0.03 0.00 -0.34 0.00 0.00 43.02 42.39 1uop s PHE 139 CO 0.04 -0.19 -0.06 0.00 -1.46 0.00 0.00 175.22 173.55 1uop s ALA 140 N 1.60 3.04 -0.05 11.12 0.00 0.03 -0.69 121.76 136.82 1uop s ALA 140 Ca -0.04 -0.96 -0.09 0.00 0.00 0.00 0.00 51.96 50.87 1uop s ALA 140 Cb -0.12 -1.20 0.02 0.00 0.00 0.00 0.00 23.12 21.82 1uop s ALA 140 CO -0.05 0.60 0.21 1.52 0.00 0.00 0.00 175.76 178.04 1uop s TYR 141 N -0.94 -0.15 -0.04 0.00 1.13 -0.19 -1.12 117.35 116.04 1uop s TYR 141 Ca 0.16 0.33 -0.11 0.00 -1.41 0.00 0.00 57.07 56.03 1uop s TYR 141 Cb -0.11 0.05 -0.05 0.00 -1.10 0.00 0.00 41.96 40.74 1uop s TYR 141 CO 0.06 -0.21 0.30 0.20 -2.51 0.00 0.00 175.55 173.39 1uop s GLY 142 N -0.53 2.35 -0.07 5.49 0.00 0.09 -0.69 107.32 113.96 1uop s GLY 142 Ca -0.06 -0.39 0.05 0.00 0.00 0.00 0.00 44.72 44.31 1uop s GLY 142 CO 0.01 -0.08 -0.22 1.08 0.00 0.00 0.00 173.10 173.89 1uop s LEU 143 N -1.12 2.01 -0.06 0.66 1.43 0.07 -0.15 118.68 121.52 1uop s LEU 143 Ca 0.21 -0.48 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 1uop s LEU 143 Cb -0.15 -1.27 -0.02 0.00 0.03 0.00 0.00 46.19 44.78 1uop s LEU 143 CO 0.10 0.17 -0.18 -0.44 0.23 0.00 0.00 176.35 176.24 1uop s SER 144 N 0.16 3.69 -0.11 2.29 0.01 -0.13 -1.36 113.70 118.25 1uop s SER 144 Ca -0.11 -0.32 -0.04 0.00 1.31 0.00 0.00 55.95 56.79 1uop s SER 144 Cb -0.15 -0.88 -0.04 0.00 0.21 0.00 0.00 66.02 65.16 1uop s SER 144 CO 0.06 0.30 0.05 0.00 0.41 0.00 0.00 173.24 174.05 1uop s ALA 145 N -0.45 3.45 -1.95 1.44 0.00 -1.26 -1.35 121.76 121.65 1uop s ALA 145 Ca 0.05 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1uop s ALA 145 Cb -0.12 -1.69 0.00 0.00 0.00 0.00 0.00 23.12 21.32 1uop s ALA 145 CO 0.02 0.51 0.00 0.43 0.00 0.00 0.00 175.76 176.72 1uop n SER 146 N 2.38 -5.64 0.00 0.00 7.64 0.12 -2.34 113.62 115.79 1uop n SER 146 Ca -0.19 0.23 0.00 0.00 1.01 0.00 0.00 58.87 59.93 1uop n SER 146 Cb 0.54 -4.79 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 1uop n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uop n GLY 147 N -0.75 0.83 3.77 0.23 0.00 -1.26 -2.26 105.19 105.75 1uop n GLY 147 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 1uop n GLY 147 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uop s SER 148 N -2.75 5.80 0.54 1.61 0.15 -0.99 -3.92 113.70 114.15 1uop s SER 148 Ca 0.00 2.27 0.31 0.00 0.70 0.00 0.00 55.95 59.23 1uop s SER 148 Cb 0.00 -2.59 1.50 0.00 -1.71 0.00 0.00 66.02 63.21 1uop s SER 148 CO 0.00 -1.17 2.06 0.44 1.20 0.00 0.00 173.24 175.77 1uop h ASP 149 N 1.48 0.00 -3.82 5.45 3.32 -1.91 -3.42 116.42 117.52 1uop h ASP 149 Ca -0.50 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.01 1uop h ASP 149 Cb 1.26 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.92 1uop h ASP 149 CO 0.58 0.09 0.81 0.26 -1.72 0.00 0.00 179.24 179.26 1uop s TRP 150 N -3.99 2.59 0.01 4.55 0.52 -1.26 -4.59 118.94 116.78 1uop s TRP 150 Ca -0.02 1.07 0.06 0.00 0.02 0.00 0.00 56.10 57.24 1uop s TRP 150 Cb 0.12 -4.05 -0.02 0.00 -1.15 0.00 0.00 33.47 28.37 1uop s TRP 150 CO 0.56 -3.19 -0.19 0.08 0.02 0.00 0.00 176.95 174.23 1uop s VAL 151 N -0.89 1.52 -0.20 4.03 1.01 0.63 -4.31 120.40 122.19 1uop s VAL 151 Ca 0.55 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.53 1uop s VAL 151 Cb -0.47 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1uop s VAL 151 CO 0.61 0.32 -0.02 -0.89 0.00 0.00 0.00 175.10 175.11 1uop s THR 152 N -0.60 3.67 -0.11 3.92 2.01 -0.47 -3.08 115.64 120.99 1uop s THR 152 Ca 0.07 -0.40 -0.19 0.00 0.31 0.00 0.00 61.69 61.47 1uop s THR 152 Cb -0.08 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.73 1uop s THR 152 CO 0.00 0.43 0.52 -0.63 -0.69 0.00 0.00 174.62 174.25 1uop s ILE 153 N 1.15 5.16 0.42 1.82 1.01 -0.28 -0.75 121.20 129.73 1uop s ILE 153 Ca 0.02 1.04 0.05 0.00 0.00 0.00 0.00 60.65 61.77 1uop s ILE 153 Cb -0.15 -3.86 -0.06 0.00 0.01 0.00 0.00 42.46 38.41 1uop s ILE 153 CO 0.00 0.31 0.02 -0.54 0.00 0.00 0.00 174.94 174.73 1uop s LYS 154 N 0.68 1.96 0.04 2.79 1.02 0.13 -0.96 119.74 125.40 1uop s LYS 154 Ca 0.28 -2.14 0.01 0.00 0.02 0.00 0.00 55.97 54.14 1uop s LYS 154 Cb -0.16 -1.45 -0.02 0.00 -0.52 0.00 0.00 37.83 35.68 1uop s LYS 154 CO 0.12 -0.16 -0.06 -0.06 -0.92 0.00 0.00 175.35 174.27 1uop s PHE 155 N -2.86 0.53 0.01 3.18 0.40 -1.25 -1.02 117.98 116.97 1uop s PHE 155 Ca 0.29 -0.53 -0.01 0.00 -0.60 0.00 0.00 56.93 56.08 1uop s PHE 155 Cb 0.08 -0.33 -0.01 0.00 0.51 0.00 0.00 43.02 43.27 1uop s PHE 155 CO 0.14 -0.13 0.00 -1.64 0.70 0.00 0.00 175.22 174.30 1uop s MET 156 N -1.63 0.23 -0.11 0.44 -1.94 0.14 -1.88 119.30 114.54 1uop s MET 156 Ca -0.11 -0.38 -0.22 0.00 -1.71 0.00 0.00 55.69 53.27 1uop s MET 156 Cb -0.09 0.08 -0.03 0.00 2.01 0.00 0.00 34.83 36.80 1uop s MET 156 CO -0.00 -0.04 0.67 0.21 -0.01 0.00 0.00 175.02 175.85 1uop s LYS 157 N -0.95 4.37 0.08 2.03 2.20 -0.28 -1.30 119.74 125.89 1uop s LYS 157 Ca -0.10 0.78 -0.20 0.00 -0.36 0.00 0.00 55.97 56.09 1uop s LYS 157 Cb -0.06 -3.48 -0.10 0.00 -1.51 0.00 0.00 37.83 32.68 1uop s LYS 157 CO -0.00 -0.02 1.58 0.28 -0.36 0.00 0.00 175.35 176.82 1uop h VAL 158 N 4.88 1.20 -2.14 4.02 2.07 -1.18 -1.13 116.25 123.96 1uop h VAL 158 Ca -0.38 -0.64 -0.59 0.00 0.82 0.00 0.00 66.70 65.92 1uop h VAL 158 Cb 1.18 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1uop h VAL 158 CO 0.77 0.20 1.44 -0.62 0.02 0.00 0.00 177.57 179.38 1uop s ASP 159 N -5.69 5.56 0.00 0.57 2.15 -1.26 -0.95 116.67 117.06 1uop s ASP 159 Ca -0.14 1.79 0.00 0.00 0.43 0.00 0.00 52.55 54.63 1uop s ASP 159 Cb 0.07 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 1uop s ASP 159 CO 0.71 -1.89 0.00 0.61 -0.17 0.00 0.00 175.17 174.43 1uop n GLY 160 N 5.66 0.83 4.00 2.66 0.00 -1.26 -4.29 105.19 112.79 1uop n GLY 160 Ca 0.28 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.97 1uop n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uop n ALA 161 N 0.49 -2.27 -2.68 4.61 0.00 -0.12 -4.90 120.51 115.64 1uop n ALA 161 Ca 0.00 -0.37 -0.40 0.00 0.00 0.00 0.00 53.44 52.67 1uop n ALA 161 Cb 0.00 -2.16 -0.05 0.00 0.00 0.00 0.00 19.45 17.23 1uop n ALA 161 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1uop s LYS 162 N -6.81 4.31 0.17 0.00 -0.14 -0.44 -4.90 119.74 111.93 1uop s LYS 162 Ca 0.22 0.78 -0.31 0.00 -1.36 0.00 0.00 55.97 55.29 1uop s LYS 162 Cb -0.10 -3.53 -0.09 0.00 -1.68 0.00 0.00 37.83 32.43 1uop s LYS 162 CO 0.93 -0.14 1.47 -1.21 -0.76 0.00 0.00 175.35 175.64 1uop s GLU 163 N 1.52 4.27 0.24 1.68 2.02 -1.26 -1.13 118.70 126.04 1uop s GLU 163 Ca 0.33 2.25 0.06 0.00 0.02 0.00 0.00 54.97 57.63 1uop s GLU 163 Cb -0.17 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 30.86 1uop s GLU 163 CO 0.13 -0.49 0.24 -0.51 0.02 0.00 0.00 175.26 174.65 1uop s LEU 164 N 0.67 3.97 0.39 1.80 1.43 -0.79 -4.89 118.68 121.26 1uop s LEU 164 Ca 0.65 -0.14 0.26 0.00 -1.03 0.00 0.00 54.13 53.87 1uop s LEU 164 Cb -0.41 -2.51 0.79 0.00 0.03 0.00 0.00 46.19 44.10 1uop s LEU 164 CO 0.34 -0.04 1.76 1.55 0.23 0.00 0.00 176.35 180.19 1uop h PRO 165 N 1.49 0.00 -6.63 1.29 0.14 -1.96 -3.42 132.00 122.92 1uop h PRO 165 Ca -0.49 0.00 -0.52 0.00 0.14 0.00 0.00 66.00 65.13 1uop h PRO 165 Cb 1.23 0.00 0.06 0.00 0.14 0.00 0.00 31.00 32.43 1uop h PRO 165 CO 0.61 0.00 1.04 -0.51 0.14 0.00 0.00 178.00 179.28 1uop s ASP 166 N -5.43 6.38 -0.02 1.44 1.11 -1.26 -5.00 116.67 113.89 1uop s ASP 166 Ca 0.06 2.85 -0.00 0.00 0.18 0.00 0.00 52.55 55.64 1uop s ASP 166 Cb 0.08 -2.59 0.03 0.00 1.07 0.00 0.00 42.92 41.51 1uop s ASP 166 CO 0.58 -0.98 0.03 -0.69 1.18 0.00 0.00 175.17 175.29 1uop s VAL 167 N 1.51 -0.03 -0.15 -1.27 1.01 -1.26 -3.76 120.40 116.44 1uop s VAL 167 Ca 0.76 0.22 -0.00 0.00 0.00 0.00 0.00 61.98 62.96 1uop s VAL 167 Cb -0.49 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 1uop s VAL 167 CO 0.33 0.11 -0.14 -0.76 0.00 0.00 0.00 175.10 174.64 1uop s LEU 168 N 1.18 2.58 0.31 3.92 1.43 -0.14 -4.55 118.68 123.41 1uop s LEU 168 Ca -0.08 -0.42 0.09 0.00 -1.03 0.00 0.00 54.13 52.69 1uop s LEU 168 Cb -0.13 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1uop s LEU 168 CO -0.03 0.10 0.08 -1.61 0.23 0.00 0.00 176.35 175.12 1uop s GLU 169 N 0.74 2.35 -0.94 1.70 0.41 -1.26 -1.13 118.70 120.57 1uop s GLU 169 Ca -0.06 -1.49 0.00 0.00 -0.41 0.00 0.00 54.97 53.02 1uop s GLU 169 Cb -0.15 -2.17 0.00 0.00 -1.78 0.00 0.00 34.13 30.02 1uop s GLU 169 CO 0.01 0.23 0.00 0.54 -0.49 0.00 0.00 175.26 175.55 1uop n ARG 170 N -1.04 -0.83 -3.20 1.61 1.74 -1.26 -4.86 116.66 108.83 1uop n ARG 170 Ca -0.05 0.57 -0.39 0.00 -0.77 0.00 0.00 57.85 57.22 1uop n ARG 170 Cb 0.60 -4.64 -0.06 0.00 -1.02 0.00 0.00 32.46 27.35 1uop n ARG 170 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1uop s VAL 171 N -2.51 5.11 -0.19 1.55 1.01 -1.18 -0.97 120.40 123.23 1uop s VAL 171 Ca 0.00 1.14 -0.21 0.00 0.00 0.00 0.00 61.98 62.91 1uop s VAL 171 Cb 0.00 -3.91 0.05 0.00 0.00 0.00 0.00 36.38 32.53 1uop s VAL 171 CO 0.00 0.25 0.56 -0.75 0.00 0.00 0.00 175.10 175.17 1uop s LYS 172 N 0.99 0.70 -1.41 2.72 2.20 -1.26 -0.27 119.74 123.42 1uop s LYS 172 Ca 0.30 0.68 -0.00 0.00 -0.36 0.00 0.00 55.97 56.59 1uop s LYS 172 Cb -0.16 0.34 0.00 0.00 -1.51 0.00 0.00 37.83 36.50 1uop s LYS 172 CO 0.12 -0.11 0.39 1.19 -0.36 0.00 0.00 175.35 176.59 1uop n PHE 173 N 2.50 -1.63 -4.17 4.03 3.72 -1.26 -4.80 117.46 115.85 1uop n PHE 173 Ca -0.15 0.74 -0.32 0.00 -0.05 0.00 0.00 57.45 57.67 1uop n PHE 173 Cb 0.56 -3.70 -0.08 0.00 -0.94 0.00 0.00 39.48 35.33 1uop n PHE 173 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1uop s SER 174 N -4.38 5.36 0.78 4.37 0.15 -1.26 -4.92 113.70 113.80 1uop s SER 174 Ca 0.00 0.03 -0.12 0.00 0.70 0.00 0.00 55.95 56.56 1uop s SER 174 Cb -0.00 -1.44 0.06 0.00 -1.71 0.00 0.00 66.02 62.92 1uop s SER 174 CO 0.89 0.25 1.13 0.00 1.20 0.00 0.00 173.24 176.72 1uop s MET 176 N -5.41 0.18 -0.16 0.00 -1.94 -1.25 -4.02 119.30 106.70 1uop s MET 176 Ca 0.60 0.34 -0.04 0.00 -1.71 0.00 0.00 55.69 54.88 1uop s MET 176 Cb -0.12 -0.91 0.07 0.00 2.01 0.00 0.00 34.83 35.89 1uop s MET 176 CO 0.51 -0.57 0.21 0.00 -0.01 0.00 0.00 175.02 175.15 1uop s ALA 177 N 2.35 -0.26 0.18 3.03 0.00 -0.84 -4.79 121.76 121.43 1uop s ALA 177 Ca 0.06 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.16 1uop s ALA 177 Cb -0.15 -1.12 -0.08 0.00 0.00 0.00 0.00 23.12 21.78 1uop s ALA 177 CO -0.11 -0.93 0.96 -1.58 0.00 0.00 0.00 175.76 174.09 1uop s TRP 178 N 2.33 3.89 0.53 0.00 0.52 -1.26 -0.37 118.94 124.57 1uop s TRP 178 Ca 0.05 1.85 -0.20 0.00 0.02 0.00 0.00 56.10 57.82 1uop s TRP 178 Cb -0.14 -3.03 -0.06 0.00 -1.15 0.00 0.00 33.47 29.09 1uop s TRP 178 CO -0.10 0.30 1.14 0.95 0.02 0.00 0.00 176.95 179.26 1uop s THR 179 N -0.63 3.14 -0.88 2.01 -4.23 -0.79 -4.79 115.64 109.48 1uop s THR 179 Ca 0.44 0.74 0.21 0.00 -1.18 0.00 0.00 61.69 61.89 1uop s THR 179 Cb -0.25 -3.31 0.19 0.00 1.34 0.00 0.00 72.50 70.46 1uop s THR 179 CO 0.31 -0.12 1.65 1.41 -0.54 0.00 0.00 174.62 177.32 1uop n HIS 180 N -1.14 0.24 1.03 3.99 -0.00 -1.26 -1.17 115.22 116.91 1uop n HIS 180 Ca 0.11 0.09 0.11 0.00 -0.00 0.00 0.00 57.72 58.02 1uop n HIS 180 Cb 0.50 -0.64 0.55 0.00 -0.00 0.00 0.00 29.99 30.40 1uop n HIS 180 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1uop n ASP 181 N -1.71 0.00 -0.30 0.41 5.75 -1.26 -4.87 116.55 114.56 1uop n ASP 181 Ca 0.04 -0.05 -0.04 0.00 -0.01 0.00 0.00 54.79 54.73 1uop n ASP 181 Cb 0.24 -0.27 -0.02 0.00 -1.03 0.00 0.00 41.12 40.04 1uop n ASP 181 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uop n GLY 182 N 0.54 0.59 0.16 6.12 0.00 -0.32 -4.90 105.19 107.38 1uop n GLY 182 Ca 0.10 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 1uop n GLY 182 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1uop h LYS 183 N 0.30 0.34 0.00 1.61 3.64 -1.91 -3.47 116.57 117.08 1uop h LYS 183 Ca -0.08 -0.32 0.13 0.00 -1.27 0.00 0.00 60.65 59.11 1uop h LYS 183 Cb 0.61 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1uop h LYS 183 CO 0.12 0.99 0.37 0.41 -2.27 0.00 0.00 179.45 179.07 1uop n GLY 184 N 0.74 0.61 2.91 5.01 0.00 -1.26 -1.51 105.19 111.68 1uop n GLY 184 Ca -0.05 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 1uop n GLY 184 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1uop s MET 185 N -2.01 0.06 0.36 1.61 1.75 -0.32 -1.88 119.30 118.86 1uop s MET 185 Ca 0.13 0.14 -0.25 0.00 -1.25 0.00 0.00 55.69 54.46 1uop s MET 185 Cb -0.01 -0.04 -0.10 0.00 2.84 0.00 0.00 34.83 37.52 1uop s MET 185 CO 0.01 -0.05 0.95 -0.06 -0.65 0.00 0.00 175.02 175.21 1uop s PHE 186 N 0.35 3.57 0.27 4.11 0.08 0.50 -0.49 117.98 126.36 1uop s PHE 186 Ca -0.03 1.73 -0.21 0.00 0.12 0.00 0.00 56.93 58.54 1uop s PHE 186 Cb -0.04 -2.91 0.03 0.00 -0.57 0.00 0.00 43.02 39.53 1uop s PHE 186 CO -0.01 0.09 0.76 1.52 -0.10 0.00 0.00 175.22 177.47 1uop s TYR 187 N -1.78 -0.16 0.03 0.36 1.13 -0.57 -1.99 117.35 114.37 1uop s TYR 187 Ca 0.54 -0.30 0.05 0.00 -1.41 0.00 0.00 57.07 55.94 1uop s TYR 187 Cb -0.16 0.71 -0.03 0.00 -1.10 0.00 0.00 41.96 41.38 1uop s TYR 187 CO 0.21 -1.21 -0.09 -0.80 -2.51 0.00 0.00 175.55 171.15 1uop s ASN 188 N -2.94 4.49 0.05 -0.18 -0.87 -1.26 -0.51 114.94 113.71 1uop s ASN 188 Ca 0.12 -0.23 -0.02 0.00 -1.57 0.00 0.00 52.86 51.16 1uop s ASN 188 Cb -0.05 -0.97 -0.03 0.00 -0.02 0.00 0.00 41.25 40.17 1uop s ASN 188 CO 0.07 0.25 -0.00 0.00 -2.57 0.00 0.00 177.10 174.85 1uop s ALA 189 N -1.04 0.33 0.00 0.60 0.00 -0.87 -4.04 121.76 116.75 1uop s ALA 189 Ca 0.18 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.15 1uop s ALA 189 Cb -0.11 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 1uop s ALA 189 CO 0.09 -0.33 0.12 0.71 0.00 0.00 0.00 175.76 176.35 1uop s TYR 190 N -3.30 3.37 0.91 0.00 2.02 -0.15 -1.09 117.35 119.12 1uop s TYR 190 Ca 0.01 0.25 -0.11 0.00 -0.37 0.00 0.00 57.07 56.85 1uop s TYR 190 Cb 0.03 -1.76 0.14 0.00 -0.40 0.00 0.00 41.96 39.98 1uop s TYR 190 CO -0.08 0.58 1.12 -2.14 -1.57 0.00 0.00 175.55 173.46 1uop s PRO 191 N -1.90 1.09 0.48 -1.71 0.02 -1.26 -4.88 135.00 126.85 1uop s PRO 191 Ca 0.25 1.34 -0.22 0.00 0.02 0.00 0.00 61.00 62.39 1uop s PRO 191 Cb -0.12 -1.75 -0.09 0.00 0.02 0.00 0.00 34.50 32.56 1uop s PRO 191 CO 0.17 -2.51 0.99 1.04 -0.33 0.00 0.00 177.00 176.36 1uop n GLN 192 N -4.13 1.23 -4.10 5.54 1.13 -1.26 -5.03 117.38 110.76 1uop n GLN 192 Ca 0.10 0.45 -0.13 0.00 -1.94 0.00 0.00 57.00 55.48 1uop n GLN 192 Cb 0.53 -2.08 -0.11 0.00 0.11 0.00 0.00 30.24 28.68 1uop n GLN 192 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1uop s GLN 193 N -2.22 0.64 0.58 -1.09 -2.07 -1.26 -5.14 119.66 109.09 1uop s GLN 193 Ca 0.66 -0.92 -0.19 0.00 -1.82 0.00 0.00 55.36 53.10 1uop s GLN 193 Cb -0.51 -0.34 -0.04 0.00 -1.09 0.00 0.00 33.01 31.03 1uop s GLN 193 CO 0.54 0.05 1.20 -0.51 -1.32 0.00 0.00 175.29 175.25 1uop s ASP 194 N -1.94 5.31 0.00 12.60 1.01 -1.26 -4.83 116.67 127.57 1uop s ASP 194 Ca -0.04 2.37 0.00 0.00 0.71 0.00 0.00 52.55 55.59 1uop s ASP 194 Cb -0.07 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.27 1uop s ASP 194 CO -0.00 -1.51 0.00 0.61 0.21 0.00 0.00 175.17 174.48 1uop n GLY 195 N 0.47 -1.51 3.84 0.21 0.00 -1.26 -4.93 105.19 102.01 1uop n GLY 195 Ca 0.13 -1.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 1uop n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uop s LYS 196 N 0.00 4.04 -0.49 1.61 1.02 -1.26 -5.02 119.74 119.65 1uop s LYS 196 Ca 0.00 0.80 0.08 0.00 0.02 0.00 0.00 55.97 56.87 1uop s LYS 196 Cb 0.00 -2.33 0.32 0.00 -0.52 0.00 0.00 37.83 35.30 1uop s LYS 196 CO 0.00 0.05 0.79 0.43 -0.92 0.00 0.00 175.35 175.70 1uop n SER 197 N -0.64 2.53 0.00 2.83 7.64 -1.26 -4.68 113.62 120.04 1uop n SER 197 Ca 0.05 -3.29 0.00 0.00 1.01 0.00 0.00 58.87 56.64 1uop n SER 197 Cb 0.54 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 1uop n SER 197 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1uop n ASP 198 N 0.30 0.91 0.00 6.43 5.75 -1.26 -4.99 116.55 123.69 1uop n ASP 198 Ca 0.27 -1.30 0.00 0.00 -0.01 0.00 0.00 54.79 53.75 1uop n ASP 198 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1uop n ASP 198 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uop n GLY 199 N -0.15 0.63 0.02 6.12 0.00 -1.26 -4.76 105.19 105.80 1uop n GLY 199 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1uop n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uop n THR 200 N -1.69 0.11 -2.19 2.61 -2.24 -1.26 -3.70 114.28 105.93 1uop n THR 200 Ca 0.00 -0.13 -0.29 0.00 -2.27 0.00 0.00 64.05 61.37 1uop n THR 200 Cb 0.00 0.26 0.03 0.00 -2.10 0.00 0.00 70.33 68.52 1uop n THR 200 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1uop s GLU 201 N -3.09 3.15 0.00 -0.78 1.03 -1.26 -4.78 118.70 112.97 1uop s GLU 201 Ca 0.07 0.32 0.10 0.00 0.03 0.00 0.00 54.97 55.49 1uop s GLU 201 Cb 0.16 -2.18 0.09 0.00 -0.80 0.00 0.00 34.13 31.39 1uop s GLU 201 CO 0.76 -0.68 0.84 0.25 -1.33 0.00 0.00 175.26 175.09 1uop n THR 202 N -2.68 0.04 -1.65 1.83 -2.24 -1.26 -4.89 114.28 103.44 1uop n THR 202 Ca 0.05 -0.52 -0.46 0.00 -2.27 0.00 0.00 64.05 60.84 1uop n THR 202 Cb 0.56 1.18 -0.03 0.00 -2.10 0.00 0.00 70.33 69.94 1uop n THR 202 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1uop n SER 203 N 0.56 2.51 -4.77 3.42 7.64 -1.26 -0.96 113.62 120.76 1uop n SER 203 Ca 0.06 1.13 -0.39 0.00 1.01 0.00 0.00 58.87 60.68 1uop n SER 203 Cb 0.26 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.09 1uop n SER 203 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1uop s THR 204 N 0.15 2.49 -0.39 0.44 -1.32 -1.26 -2.60 115.64 113.16 1uop s THR 204 Ca 0.72 0.42 -0.11 0.00 -1.21 0.00 0.00 61.69 61.52 1uop s THR 204 Cb -0.71 -3.24 0.04 0.00 -1.51 0.00 0.00 72.50 67.08 1uop s THR 204 CO 0.47 0.05 0.22 0.20 -2.21 0.00 0.00 174.62 173.36 1uop s ASN 205 N -0.77 5.72 0.21 8.08 0.02 -0.10 -4.82 114.94 123.28 1uop s ASN 205 Ca 0.60 -1.12 0.04 0.00 -1.02 0.00 0.00 52.86 51.35 1uop s ASN 205 Cb -0.39 -2.02 -0.05 0.00 0.02 0.00 0.00 41.25 38.82 1uop s ASN 205 CO 0.49 -0.43 -0.02 -0.76 0.02 0.00 0.00 177.10 176.40 1uop s LEU 206 N 1.53 2.25 -1.16 0.60 1.43 -1.26 -4.87 118.68 117.19 1uop s LEU 206 Ca 0.02 -1.17 -0.07 0.00 -1.03 0.00 0.00 54.13 51.87 1uop s LEU 206 Cb -0.20 -0.27 0.01 0.00 0.03 0.00 0.00 46.19 45.76 1uop s LEU 206 CO 0.06 -0.48 0.98 1.41 0.23 0.00 0.00 176.35 178.55 1uop n HIS 207 N -0.36 -2.42 -1.76 0.29 8.25 0.31 -4.62 115.22 114.91 1uop n HIS 207 Ca -0.06 0.84 -0.42 0.00 -0.26 0.00 0.00 57.72 57.82 1uop n HIS 207 Cb 0.63 -4.41 -0.02 0.00 1.12 0.00 0.00 29.99 27.31 1uop n HIS 207 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1uop s GLN 208 N -6.09 4.12 0.26 -0.41 0.74 -1.26 -4.39 119.66 112.63 1uop s GLN 208 Ca 0.49 2.58 0.11 0.00 0.05 0.00 0.00 55.36 58.59 1uop s GLN 208 Cb -0.21 -3.05 -0.05 0.00 1.10 0.00 0.00 33.01 30.80 1uop s GLN 208 CO 0.60 -0.68 -0.11 0.15 -0.55 0.00 0.00 175.29 174.70 1uop s LYS 209 N 0.20 1.95 -0.24 1.67 1.02 -0.25 -4.65 119.74 119.45 1uop s LYS 209 Ca 0.68 -1.57 -0.08 0.00 0.02 0.00 0.00 55.97 55.02 1uop s LYS 209 Cb -0.48 -1.97 -0.03 0.00 -0.52 0.00 0.00 37.83 34.82 1uop s LYS 209 CO 0.41 0.36 0.09 -1.17 -0.92 0.00 0.00 175.35 174.12 1uop s LEU 210 N -3.46 3.61 0.31 3.17 2.96 -0.55 -2.05 118.68 122.66 1uop s LEU 210 Ca 0.30 -0.12 0.10 0.00 -0.22 0.00 0.00 54.13 54.18 1uop s LEU 210 Cb -0.06 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.61 1uop s LEU 210 CO 0.17 -0.00 -0.03 -0.31 -1.32 0.00 0.00 176.35 174.86 1uop s TYR 211 N 1.43 2.55 -0.17 5.38 2.02 0.33 -1.08 117.35 127.82 1uop s TYR 211 Ca 0.06 -0.35 0.01 0.00 -0.37 0.00 0.00 57.07 56.41 1uop s TYR 211 Cb -0.15 -1.32 0.03 0.00 -0.40 0.00 0.00 41.96 40.12 1uop s TYR 211 CO 0.05 0.56 -0.15 -0.47 -1.57 0.00 0.00 175.55 173.97 1uop s TYR 212 N -2.46 2.38 -0.27 2.71 5.04 0.28 -1.52 117.35 123.52 1uop s TYR 212 Ca 0.33 -1.40 -0.11 0.00 -2.44 0.00 0.00 57.07 53.44 1uop s TYR 212 Cb -0.03 -1.69 -0.05 0.00 0.35 0.00 0.00 41.96 40.54 1uop s TYR 212 CO 0.19 -0.72 0.20 -1.58 -1.34 0.00 0.00 175.55 172.30 1uop s HIS 213 N 1.42 3.24 -0.18 4.97 5.65 0.36 -1.37 115.29 129.37 1uop s HIS 213 Ca 0.04 0.17 -0.28 0.00 0.25 0.00 0.00 55.06 55.24 1uop s HIS 213 Cb -0.13 -2.38 -0.00 0.00 -1.18 0.00 0.00 32.58 28.89 1uop s HIS 213 CO -0.11 -0.12 0.98 0.08 -0.65 0.00 0.00 174.74 174.92 1uop s VAL 214 N 1.65 4.76 0.23 0.89 1.01 -1.26 -1.17 120.40 126.50 1uop s VAL 214 Ca 0.08 1.93 -0.32 0.00 0.00 0.00 0.00 61.98 63.67 1uop s VAL 214 Cb -0.15 -4.27 -0.12 0.00 0.00 0.00 0.00 36.38 31.83 1uop s VAL 214 CO 0.10 -0.08 1.61 -0.11 0.00 0.00 0.00 175.10 176.62 1uop n LEU 215 N 5.71 3.80 0.00 3.92 7.94 -0.57 -2.33 117.00 135.46 1uop n LEU 215 Ca 0.09 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 56.09 1uop n LEU 215 Cb 0.47 -1.53 0.00 0.00 0.53 0.00 0.00 43.42 42.89 1uop n LEU 215 CO 0.51 -0.02 0.00 0.61 -1.11 0.00 0.00 177.39 177.38 1uop n GLY 216 N 3.05 0.76 3.65 -3.96 0.00 -1.26 -4.98 105.19 102.45 1uop n GLY 216 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1uop n GLY 216 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uop s THR 217 N -2.12 1.93 0.37 2.61 -4.23 -0.99 -5.07 115.64 108.14 1uop s THR 217 Ca 0.00 -1.97 -0.24 0.00 -1.18 0.00 0.00 61.69 58.30 1uop s THR 217 Cb 0.00 -2.90 -0.10 0.00 1.34 0.00 0.00 72.50 70.84 1uop s THR 217 CO 0.00 0.00 0.97 -1.81 -0.54 0.00 0.00 174.62 173.24 1uop s ASP 218 N -3.75 7.11 0.48 3.99 1.01 -1.26 -4.82 116.67 119.42 1uop s ASP 218 Ca 0.32 1.84 0.21 0.00 0.71 0.00 0.00 52.55 55.64 1uop s ASP 218 Cb 0.08 -2.57 1.23 0.00 1.01 0.00 0.00 42.92 42.68 1uop s ASP 218 CO 0.17 -0.23 1.93 -0.61 0.21 0.00 0.00 175.17 176.63 1uop h GLN 219 N 2.71 0.21 0.00 8.23 4.15 -1.96 -0.91 115.11 127.54 1uop h GLN 219 Ca -0.48 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.93 1uop h GLN 219 Cb 1.19 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.84 1uop h GLN 219 CO 0.63 0.14 0.00 0.66 -1.93 0.00 0.00 178.83 178.33 1uop h SER 220 N 0.22 0.00 0.79 -0.69 4.64 -1.95 -1.07 113.55 115.48 1uop h SER 220 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1uop h SER 220 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1uop h SER 220 CO -0.07 0.00 -0.18 -0.62 -0.87 0.00 0.00 176.83 175.08 1uop n GLU 221 N -3.05 0.04 -1.69 4.77 1.02 -0.35 -4.96 120.64 116.42 1uop n GLU 221 Ca -0.02 -0.01 -0.40 0.00 -0.02 0.00 0.00 57.16 56.71 1uop n GLU 221 Cb 0.12 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.06 1uop n GLU 221 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1uop n ASP 222 N -1.47 2.33 -4.71 1.62 9.92 -0.41 -4.95 116.55 118.88 1uop n ASP 222 Ca 0.07 1.05 -0.40 0.00 -0.53 0.00 0.00 54.79 54.98 1uop n ASP 222 Cb 0.33 -1.49 -0.05 0.00 -0.64 0.00 0.00 41.12 39.27 1uop n ASP 222 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1uop s ILE 223 N -1.25 5.03 -0.28 0.53 -1.09 -0.47 -4.86 121.20 118.81 1uop s ILE 223 Ca 0.64 1.48 -0.28 0.00 -2.23 0.00 0.00 60.65 60.25 1uop s ILE 223 Cb -0.49 -4.06 0.01 0.00 -1.58 0.00 0.00 42.46 36.35 1uop s ILE 223 CO 0.55 0.23 1.03 -0.22 -1.23 0.00 0.00 174.94 175.30 1uop s LEU 224 N 0.93 4.02 -0.08 2.97 2.96 -1.26 -0.55 118.68 127.67 1uop s LEU 224 Ca 0.38 1.17 0.11 0.00 -0.22 0.00 0.00 54.13 55.57 1uop s LEU 224 Cb -0.18 -3.49 -0.16 0.00 0.50 0.00 0.00 46.19 42.86 1uop s LEU 224 CO 0.18 -0.75 0.13 0.00 -1.32 0.00 0.00 176.35 174.58 1uop s ALA 226 N -2.50 -1.33 0.07 0.00 0.00 -1.16 -2.52 121.76 114.32 1uop s ALA 226 Ca -0.05 1.46 -0.13 0.00 0.00 0.00 0.00 51.96 53.23 1uop s ALA 226 Cb 0.05 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.39 1uop s ALA 226 CO 0.49 -0.26 0.30 -1.83 0.00 0.00 0.00 175.76 174.46 1uop s GLU 227 N 0.14 0.88 -0.45 0.00 -1.05 -1.26 -1.49 118.70 115.48 1uop s GLU 227 Ca -0.01 -0.65 0.09 0.00 -0.15 0.00 0.00 54.97 54.25 1uop s GLU 227 Cb -0.04 0.38 0.31 0.00 -0.44 0.00 0.00 34.13 34.34 1uop s GLU 227 CO 0.01 -0.30 0.72 1.19 0.95 0.00 0.00 175.26 177.83 1uop n PHE 228 N 0.25 1.17 0.29 4.83 3.72 -1.26 -4.96 117.46 121.50 1uop n PHE 228 Ca -0.17 -3.83 0.15 0.00 -0.05 0.00 0.00 57.45 53.55 1uop n PHE 228 Cb 0.61 -0.43 0.90 0.00 -0.94 0.00 0.00 39.48 39.62 1uop n PHE 228 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1uop h PRO 229 N 3.39 0.00 -0.00 -1.08 0.13 -1.97 0.43 132.00 132.90 1uop h PRO 229 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1uop h PRO 229 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1uop h PRO 229 CO 0.59 0.02 -0.11 -0.25 -0.23 0.00 0.00 178.00 178.01 1uop n ASP 230 N -3.82 0.17 -3.32 1.44 8.00 -1.26 -4.35 116.55 113.41 1uop n ASP 230 Ca -0.03 0.10 -0.25 0.00 0.71 0.00 0.00 54.79 55.32 1uop n ASP 230 Cb 0.10 -0.26 -0.08 0.00 -0.02 0.00 0.00 41.12 40.86 1uop n ASP 230 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1uop n GLU 231 N -1.39 0.81 0.31 -1.24 -0.58 0.14 -5.01 120.64 113.69 1uop n GLU 231 Ca 0.09 -3.44 0.21 0.00 -0.42 0.00 0.00 57.16 53.60 1uop n GLU 231 Cb 0.32 -1.53 1.13 0.00 -0.57 0.00 0.00 31.44 30.79 1uop n GLU 231 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1uop h PRO 232 N 4.60 0.00 -0.00 3.49 0.11 -1.75 -1.10 132.00 137.34 1uop h PRO 232 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1uop h PRO 232 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1uop h PRO 232 CO 0.49 0.00 -0.47 1.63 -0.21 0.00 0.00 178.00 179.44 1uop n LYS 233 N -2.96 0.17 -2.20 1.05 5.02 -1.26 -0.53 118.16 117.45 1uop n LYS 233 Ca -0.03 -0.10 -0.39 0.00 -2.02 0.00 0.00 58.31 55.77 1uop n LYS 233 Cb 0.07 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.56 1uop n LYS 233 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1uop s TRP 234 N -2.90 3.03 -0.10 2.13 0.52 -0.42 -4.63 118.94 116.56 1uop s TRP 234 Ca 0.14 1.49 -0.01 0.00 0.02 0.00 0.00 56.10 57.74 1uop s TRP 234 Cb 0.18 -3.53 0.03 0.00 -1.15 0.00 0.00 33.47 28.99 1uop s TRP 234 CO 0.67 -1.61 -0.06 -1.64 0.02 0.00 0.00 176.95 174.33 1uop s MET 235 N -2.11 1.32 -0.35 4.98 -1.94 0.17 -4.42 119.30 116.96 1uop s MET 235 Ca 0.54 -0.18 -0.06 0.00 -1.71 0.00 0.00 55.69 54.29 1uop s MET 235 Cb -0.35 -1.45 0.05 0.00 2.01 0.00 0.00 34.83 35.10 1uop s MET 235 CO 0.45 -0.27 0.12 0.20 -0.01 0.00 0.00 175.02 175.51 1uop s GLY 236 N 1.74 1.86 -0.12 -0.03 0.00 -1.26 -0.57 107.32 108.94 1uop s GLY 236 Ca 0.05 -1.85 -0.11 0.00 0.00 0.00 0.00 44.72 42.81 1uop s GLY 236 CO -0.07 0.80 0.23 -0.32 0.00 0.00 0.00 173.10 173.74 1uop s GLY 237 N 1.50 2.22 0.01 0.20 0.00 -0.36 -4.70 107.32 106.18 1uop s GLY 237 Ca -0.01 -0.51 -0.01 0.00 0.00 0.00 0.00 44.72 44.19 1uop s GLY 237 CO 0.02 0.01 0.12 0.00 0.00 0.00 0.00 173.10 173.25 1uop s ALA 238 N -0.46 3.72 0.03 3.20 0.00 -1.26 -0.54 121.76 126.45 1uop s ALA 238 Ca 0.16 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.21 1uop s ALA 238 Cb -0.13 -1.67 -0.01 0.00 0.00 0.00 0.00 23.12 21.31 1uop s ALA 238 CO 0.05 0.73 0.09 -1.83 0.00 0.00 0.00 175.76 174.80 1uop s GLU 239 N -1.94 0.54 -0.02 0.00 -1.05 -0.53 -4.58 118.70 111.12 1uop s GLU 239 Ca 0.26 -0.67 -0.15 0.00 -0.15 0.00 0.00 54.97 54.26 1uop s GLU 239 Cb -0.12 0.21 -0.05 0.00 -0.44 0.00 0.00 34.13 33.73 1uop s GLU 239 CO 0.17 -0.13 0.40 -0.51 0.95 0.00 0.00 175.26 176.15 1uop s LEU 240 N -1.92 4.44 0.81 1.83 2.01 -1.26 -0.06 118.68 124.52 1uop s LEU 240 Ca -0.08 0.91 -0.14 0.00 0.01 0.00 0.00 54.13 54.83 1uop s LEU 240 Cb -0.03 -2.57 0.04 0.00 0.01 0.00 0.00 46.19 43.63 1uop s LEU 240 CO -0.03 0.28 0.85 -1.54 1.01 0.00 0.00 176.35 176.92 1uop n SER 241 N 2.12 -0.22 0.23 2.29 3.41 0.21 -4.86 113.62 116.79 1uop n SER 241 Ca -0.13 0.54 0.12 0.00 -0.26 0.00 0.00 58.87 59.14 1uop n SER 241 Cb 0.52 -1.36 0.72 0.00 -0.26 0.00 0.00 64.21 63.83 1uop n SER 241 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1uop h ASP 242 N -0.85 0.00 -0.07 4.04 3.32 -1.92 0.13 116.42 121.06 1uop h ASP 242 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1uop h ASP 242 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1uop h ASP 242 CO 0.43 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.05 1uop n ASP 243 N -4.30 1.46 0.00 6.45 5.68 -1.26 -4.95 116.55 119.63 1uop n ASP 243 Ca -0.01 -1.55 0.00 0.00 -0.50 0.00 0.00 54.79 52.73 1uop n ASP 243 Cb 0.17 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 1uop n ASP 243 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uop n GLY 244 N 1.14 0.58 0.17 6.12 0.00 0.45 -4.89 105.19 108.75 1uop n GLY 244 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 1uop n GLY 244 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1uop h ARG 245 N 1.68 0.52 -6.44 1.61 9.65 -1.93 -3.43 114.38 116.04 1uop h ARG 245 Ca 0.00 -0.59 -0.70 0.00 -1.10 0.00 0.00 59.98 57.60 1uop h ARG 245 Cb 0.07 0.17 -0.30 0.00 -1.39 0.00 0.00 29.97 28.52 1uop h ARG 245 CO 0.00 1.21 -0.88 0.71 2.80 0.00 0.00 179.97 183.81 1uop s TYR 246 N -3.22 2.38 -0.14 2.20 1.51 -1.26 -0.70 117.35 118.13 1uop s TYR 246 Ca -0.07 -0.49 -0.22 0.00 -1.01 0.00 0.00 57.07 55.27 1uop s TYR 246 Cb 0.08 -1.53 -0.03 0.00 -0.11 0.00 0.00 41.96 40.36 1uop s TYR 246 CO 0.89 -0.07 0.67 0.08 -1.11 0.00 0.00 175.55 176.01 1uop s VAL 247 N -0.50 5.03 -0.19 0.71 1.01 0.06 -0.62 120.40 125.89 1uop s VAL 247 Ca 0.07 1.32 -0.07 0.00 0.00 0.00 0.00 61.98 63.30 1uop s VAL 247 Cb -0.11 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1uop s VAL 247 CO 0.00 0.17 0.06 -0.76 0.00 0.00 0.00 175.10 174.57 1uop s LEU 248 N 1.42 3.71 -0.30 3.92 1.43 0.91 -0.97 118.68 128.80 1uop s LEU 248 Ca 0.33 0.01 -0.08 0.00 -1.03 0.00 0.00 54.13 53.36 1uop s LEU 248 Cb -0.16 -1.94 -0.00 0.00 0.03 0.00 0.00 46.19 44.11 1uop s LEU 248 CO 0.13 0.13 0.10 -0.22 0.23 0.00 0.00 176.35 176.73 1uop s LEU 249 N 0.61 3.90 -0.38 1.79 2.96 0.78 -1.45 118.68 126.88 1uop s LEU 249 Ca 0.03 -0.59 -0.13 0.00 -0.22 0.00 0.00 54.13 53.21 1uop s LEU 249 Cb -0.13 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.65 1uop s LEU 249 CO 0.01 -0.18 0.26 -0.44 -1.32 0.00 0.00 176.35 174.68 1uop s SER 250 N 1.55 5.96 -0.22 3.68 0.01 0.30 -1.39 113.70 123.59 1uop s SER 250 Ca 0.04 -0.83 -0.11 0.00 1.31 0.00 0.00 55.95 56.37 1uop s SER 250 Cb -0.17 -2.11 -0.05 0.00 0.21 0.00 0.00 66.02 63.90 1uop s SER 250 CO 0.04 -0.38 0.16 -0.63 0.41 0.00 0.00 173.24 172.83 1uop s ILE 251 N 1.65 5.38 0.17 1.44 1.01 -0.74 -1.23 121.20 128.87 1uop s ILE 251 Ca 0.04 0.21 0.11 0.00 0.00 0.00 0.00 60.65 61.01 1uop s ILE 251 Cb -0.19 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 1uop s ILE 251 CO 0.09 0.38 -0.24 -0.13 0.00 0.00 0.00 174.94 175.04 1uop s ARG 252 N 0.76 1.53 -0.22 2.79 0.52 0.27 -1.05 118.95 123.56 1uop s ARG 252 Ca 0.08 -1.43 -0.04 0.00 -0.52 0.00 0.00 55.73 53.82 1uop s ARG 252 Cb -0.12 -1.90 0.09 0.00 0.52 0.00 0.00 34.95 33.54 1uop s ARG 252 CO 0.02 0.42 0.21 -2.00 0.02 0.00 0.00 175.30 173.97 1uop s GLU 253 N -2.45 0.19 0.81 3.54 2.12 -1.26 -0.66 118.70 120.99 1uop s GLU 253 Ca 0.19 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.59 1uop s GLU 253 Cb -0.09 -1.22 0.00 0.00 0.26 0.00 0.00 34.13 33.08 1uop s GLU 253 CO 0.09 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.49 1uop n GLY 254 N 5.31 -1.82 0.38 -1.50 0.00 -1.26 -4.71 105.19 101.59 1uop n GLY 254 Ca -0.05 -1.66 0.04 0.00 0.00 0.00 0.00 46.02 44.35 1uop n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uop s ASP 256 N -0.79 5.55 -1.15 0.00 1.01 -1.26 -4.88 116.67 115.14 1uop s ASP 256 Ca 0.12 2.43 -0.18 0.00 0.71 0.00 0.00 52.55 55.63 1uop s ASP 256 Cb 0.08 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.35 1uop s ASP 256 CO 0.11 -1.35 2.08 -0.81 0.21 0.00 0.00 175.17 175.41 1uop n PRO 257 N -1.11 2.26 -3.91 8.23 -0.04 -1.26 -4.80 135.00 134.37 1uop n PRO 257 Ca 0.11 -2.29 -0.09 0.00 -0.04 0.00 0.00 63.50 61.18 1uop n PRO 257 Cb 0.48 -3.14 -0.09 0.00 -0.04 0.00 0.00 33.50 30.71 1uop n PRO 257 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1uop s VAL 258 N 4.15 0.14 -0.11 0.52 -7.23 -1.26 -3.09 120.40 113.52 1uop s VAL 258 Ca 0.52 -1.15 -0.30 0.00 -1.81 0.00 0.00 61.98 59.25 1uop s VAL 258 Cb 0.14 -1.09 0.08 0.00 0.56 0.00 0.00 36.38 36.06 1uop s VAL 258 CO 0.01 -0.63 0.73 0.54 -0.31 0.00 0.00 175.10 175.43 1uop s ASN 259 N -2.41 -0.64 0.64 4.85 4.22 -0.36 -4.75 114.94 116.49 1uop s ASN 259 Ca -0.01 0.84 -0.15 0.00 -2.14 0.00 0.00 52.86 51.40 1uop s ASN 259 Cb 0.02 0.71 -0.01 0.00 1.28 0.00 0.00 41.25 43.25 1uop s ASN 259 CO -0.07 -0.50 1.09 -0.13 -2.04 0.00 0.00 177.10 175.45 1uop s ARG 260 N -0.83 2.96 -0.18 3.55 0.52 -0.21 -4.57 118.95 120.19 1uop s ARG 260 Ca -0.08 1.29 -0.03 0.00 -0.52 0.00 0.00 55.73 56.39 1uop s ARG 260 Cb -0.01 -1.98 0.06 0.00 0.52 0.00 0.00 34.95 33.54 1uop s ARG 260 CO 0.07 -1.11 0.04 -1.17 0.02 0.00 0.00 175.30 173.15 1uop s LEU 261 N -4.84 0.96 0.18 2.53 1.98 -0.14 -1.79 118.68 117.56 1uop s LEU 261 Ca 0.65 -0.70 0.08 0.00 -2.89 0.00 0.00 54.13 51.28 1uop s LEU 261 Cb -0.18 -0.51 -0.04 0.00 0.66 0.00 0.00 46.19 46.11 1uop s LEU 261 CO 0.41 -0.30 -0.07 0.26 -1.89 0.00 0.00 176.35 174.76 1uop s TRP 262 N 1.92 2.68 0.17 5.38 0.51 -0.49 -0.90 118.94 128.21 1uop s TRP 262 Ca 0.00 -0.20 0.04 0.00 -2.12 0.00 0.00 56.10 53.83 1uop s TRP 262 Cb -0.16 -1.31 -0.05 0.00 -0.81 0.00 0.00 33.47 31.14 1uop s TRP 262 CO -0.08 0.51 -0.08 1.52 -0.51 0.00 0.00 176.95 178.31 1uop s TYR 263 N -1.70 1.34 -0.11 -1.98 -0.85 -0.37 -0.16 117.35 113.53 1uop s TYR 263 Ca 0.25 -0.79 -0.04 0.00 -0.52 0.00 0.00 57.07 55.97 1uop s TYR 263 Cb -0.09 -0.70 0.05 0.00 0.38 0.00 0.00 41.96 41.60 1uop s TYR 263 CO 0.16 0.06 0.08 0.00 -1.52 0.00 0.00 175.55 174.33 1uop s ASP 265 N 2.16 6.16 0.50 0.00 -1.08 -1.26 -0.76 116.67 122.40 1uop s ASP 265 Ca 0.04 0.96 0.18 0.00 -0.52 0.00 0.00 52.55 53.20 1uop s ASP 265 Cb -0.14 -2.54 1.26 0.00 -1.46 0.00 0.00 42.92 40.05 1uop s ASP 265 CO -0.06 -1.55 2.10 -0.07 0.52 0.00 0.00 175.17 176.11 1uop h LEU 266 N 12.79 0.00 -1.16 -1.34 3.38 -1.25 -0.34 115.31 127.39 1uop h LEU 266 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1uop h LEU 266 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1uop h LEU 266 CO 1.07 0.07 0.00 1.56 0.09 0.00 0.00 178.44 181.24 1uop h GLN 267 N 0.00 0.00 -0.01 1.13 1.08 -1.90 -2.44 115.11 112.97 1uop h GLN 267 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1uop h GLN 267 Cb 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1uop h GLN 267 CO 0.01 0.00 -0.11 1.04 -0.95 0.00 0.00 178.83 178.81 1uop n GLN 268 N -2.66 1.05 -2.20 1.46 1.13 -0.14 -4.87 117.38 111.15 1uop n GLN 268 Ca 0.01 -0.51 -0.40 0.00 -1.94 0.00 0.00 57.00 54.16 1uop n GLN 268 Cb 0.25 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.09 1uop n GLN 268 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1uop s GLU 269 N -2.30 4.29 0.33 -1.09 0.41 -0.92 -4.92 118.70 114.50 1uop s GLU 269 Ca 0.32 2.07 0.06 0.00 -0.41 0.00 0.00 54.97 57.00 1uop s GLU 269 Cb 0.20 -2.97 0.57 0.00 -1.78 0.00 0.00 34.13 30.15 1uop s GLU 269 CO 0.44 -0.19 1.81 0.77 -0.49 0.00 0.00 175.26 177.60 1uop h SER 270 N 3.22 0.37 -0.22 -0.19 0.02 -1.89 -3.36 113.55 111.50 1uop h SER 270 Ca -0.49 -0.10 -0.25 0.00 -0.84 0.00 0.00 61.79 60.12 1uop h SER 270 Cb 1.23 -0.10 -0.21 0.00 0.14 0.00 0.00 62.40 63.46 1uop h SER 270 CO 0.65 0.57 -0.54 -3.20 -1.14 0.00 0.00 176.83 173.17 1uop n ASN 271 N -4.19 -1.09 -0.15 3.07 5.15 -1.26 -5.14 115.26 111.64 1uop n ASN 271 Ca -0.00 -2.49 0.00 0.00 -0.60 0.00 0.00 54.58 51.49 1uop n ASN 271 Cb 0.34 0.63 0.00 0.00 -0.53 0.00 0.00 39.78 40.22 1uop n ASN 271 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1uop n GLY 272 N -0.56 -0.71 3.55 8.20 0.00 -1.26 -4.63 105.19 109.79 1uop n GLY 272 Ca -0.01 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 1uop n GLY 272 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uop s ILE 273 N 0.00 4.20 0.00 -0.61 1.01 -1.26 -4.78 121.20 119.76 1uop s ILE 273 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.24 1uop s ILE 273 Cb 0.00 -4.64 0.00 0.00 0.01 0.00 0.00 42.46 37.83 1uop s ILE 273 CO 0.00 -1.23 0.00 0.35 0.00 0.00 0.00 174.94 174.06 1uop n THR 274 N 6.43 0.00 -2.15 2.92 -2.24 -1.26 -5.00 114.28 112.99 1uop n THR 274 Ca 0.05 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1uop n THR 274 Cb 0.48 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 1uop n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uop n GLY 275 N 0.51 1.37 3.68 3.38 0.00 -1.26 -4.91 105.19 107.96 1uop n GLY 275 Ca 0.00 -0.41 -0.45 0.00 0.00 0.00 0.00 46.02 45.16 1uop n GLY 275 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1uop n ILE 276 N 0.00 0.37 -1.21 -0.61 2.08 -1.09 -4.38 119.36 114.51 1uop n ILE 276 Ca 0.00 -0.07 -0.31 0.00 0.56 0.00 0.00 62.75 62.93 1uop n ILE 276 Cb 0.00 -1.95 0.10 0.00 -0.75 0.00 0.00 39.64 37.04 1uop n ILE 276 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1uop s LEU 277 N 2.79 2.95 -1.34 1.39 1.43 -1.05 -4.89 118.68 119.96 1uop s LEU 277 Ca 0.84 1.82 -0.14 0.00 -1.03 0.00 0.00 54.13 55.62 1uop s LEU 277 Cb -0.57 -4.47 -0.02 0.00 0.03 0.00 0.00 46.19 41.16 1uop s LEU 277 CO 0.41 -2.16 2.29 0.29 0.23 0.00 0.00 176.35 177.41 1uop n LYS 278 N -3.60 2.72 -1.89 1.70 5.02 -1.26 -4.96 118.16 115.88 1uop n LYS 278 Ca 0.09 -2.35 -0.42 0.00 -2.02 0.00 0.00 58.31 53.61 1uop n LYS 278 Cb 0.53 -3.11 -0.02 0.00 -0.02 0.00 0.00 35.03 32.41 1uop n LYS 278 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1uop s TRP 279 N 3.36 2.91 -0.23 2.13 0.52 -1.26 -4.69 118.94 121.68 1uop s TRP 279 Ca 0.52 0.83 -0.06 0.00 0.02 0.00 0.00 56.10 57.42 1uop s TRP 279 Cb 0.15 -3.95 -0.02 0.00 -1.15 0.00 0.00 33.47 28.49 1uop s TRP 279 CO -0.05 -3.23 0.03 0.08 0.02 0.00 0.00 176.95 173.80 1uop s VAL 280 N 0.22 4.04 -1.18 4.03 1.01 0.30 -4.94 120.40 123.87 1uop s VAL 280 Ca 0.63 -0.27 -0.14 0.00 0.00 0.00 0.00 61.98 62.20 1uop s VAL 280 Cb -0.45 -2.86 0.17 0.00 0.00 0.00 0.00 36.38 33.24 1uop s VAL 280 CO 0.43 0.39 1.39 -0.54 0.00 0.00 0.00 175.10 176.77 1uop s LYS 281 N 1.36 4.05 0.06 2.72 1.02 -1.26 -1.23 119.74 126.46 1uop s LYS 281 Ca 0.05 -2.54 -0.27 0.00 0.02 0.00 0.00 55.97 53.22 1uop s LYS 281 Cb -0.15 -5.03 -0.17 0.00 -0.52 0.00 0.00 37.83 31.97 1uop s LYS 281 CO 0.02 -1.74 1.59 1.25 -0.92 0.00 0.00 175.35 175.55 1uop h LEU 282 N 9.63 -0.34 -7.85 3.17 5.85 -1.86 -3.39 115.31 120.52 1uop h LEU 282 Ca 0.30 -0.04 -0.66 0.00 0.84 0.00 0.00 57.88 58.31 1uop h LEU 282 Cb 0.89 0.09 -0.37 0.00 0.37 0.00 0.00 40.66 41.63 1uop h LEU 282 CO 1.22 -0.17 -0.80 -0.63 -0.34 0.00 0.00 178.44 177.71 1uop s ILE 283 N -5.79 2.03 -0.43 4.05 -1.09 -0.08 -4.99 121.20 114.89 1uop s ILE 283 Ca -0.15 -1.47 0.05 0.00 -2.23 0.00 0.00 60.65 56.85 1uop s ILE 283 Cb 0.04 -2.13 0.43 0.00 -1.58 0.00 0.00 42.46 39.22 1uop s ILE 283 CO 0.63 0.03 1.29 -0.67 -1.23 0.00 0.00 174.94 174.99 1uop n ASP 284 N 4.50 5.27 -3.34 3.58 2.03 -1.26 -0.97 116.55 126.36 1uop n ASP 284 Ca -0.14 -3.75 -0.12 0.00 0.52 0.00 0.00 54.79 51.29 1uop n ASP 284 Cb 0.43 -0.51 -0.03 0.00 -0.72 0.00 0.00 41.12 40.30 1uop n ASP 284 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1uop s ASN 285 N -3.22 0.53 -0.47 1.67 2.20 -1.26 -5.05 114.94 109.33 1uop s ASN 285 Ca 0.51 -1.30 0.03 0.00 -0.94 0.00 0.00 52.86 51.15 1uop s ASN 285 Cb 0.42 0.68 0.47 0.00 -2.00 0.00 0.00 41.25 40.82 1uop s ASN 285 CO -0.11 -1.34 1.63 0.49 -2.94 0.00 0.00 177.10 174.84 1uop n PHE 286 N -0.52 2.84 0.29 1.54 3.72 -1.26 -3.33 117.46 120.74 1uop n PHE 286 Ca -0.01 -2.53 0.12 0.00 -0.05 0.00 0.00 57.45 54.97 1uop n PHE 286 Cb 0.61 -0.89 0.10 0.00 -0.94 0.00 0.00 39.48 38.36 1uop n PHE 286 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1uop h GLU 287 N 1.95 0.00 -3.44 -1.08 4.39 -1.97 -3.44 114.58 110.99 1uop h GLU 287 Ca 0.48 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 60.13 1uop h GLU 287 Cb 1.26 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.79 1uop h GLU 287 CO 1.13 0.00 -0.08 0.20 -1.16 0.00 0.00 179.01 179.09 1uop s GLY 288 N -4.08 -0.13 0.11 -3.84 0.00 -1.26 -4.85 107.32 93.26 1uop s GLY 288 Ca 0.03 -0.21 -0.22 0.00 0.00 0.00 0.00 44.72 44.33 1uop s GLY 288 CO 0.74 -0.37 0.66 1.85 0.00 0.00 0.00 173.10 175.97 1uop s GLU 289 N -3.84 4.36 -0.27 2.90 2.12 -1.18 -1.22 118.70 121.56 1uop s GLU 289 Ca 0.06 0.91 -0.02 0.00 0.36 0.00 0.00 54.97 56.29 1uop s GLU 289 Cb 0.01 -3.25 0.09 0.00 0.26 0.00 0.00 34.13 31.24 1uop s GLU 289 CO -0.08 0.60 0.09 0.71 -0.54 0.00 0.00 175.26 176.04 1uop s TYR 290 N -1.09 1.23 -0.30 5.30 1.51 -1.26 -3.54 117.35 119.21 1uop s TYR 290 Ca 0.32 -1.31 -0.06 0.00 -1.01 0.00 0.00 57.07 55.01 1uop s TYR 290 Cb -0.21 -1.35 0.01 0.00 -0.11 0.00 0.00 41.96 40.31 1uop s TYR 290 CO 0.22 -0.79 0.07 0.34 -1.11 0.00 0.00 175.55 174.28 1uop s ASP 291 N 1.78 5.08 0.18 2.29 2.15 -0.11 -4.95 116.67 123.09 1uop s ASP 291 Ca 0.06 -0.77 -0.32 0.00 0.43 0.00 0.00 52.55 51.96 1uop s ASP 291 Cb -0.17 -1.86 -0.10 0.00 -0.30 0.00 0.00 42.92 40.49 1uop s ASP 291 CO -0.23 -0.20 1.59 -0.47 -0.17 0.00 0.00 175.17 175.70 1uop s TYR 292 N 1.47 3.03 -0.11 -5.34 5.04 -1.26 -0.47 117.35 119.70 1uop s TYR 292 Ca 0.02 0.59 -0.11 0.00 -2.44 0.00 0.00 57.07 55.13 1uop s TYR 292 Cb -0.17 -3.97 -0.05 0.00 0.35 0.00 0.00 41.96 38.12 1uop s TYR 292 CO 0.02 -3.56 -0.23 0.28 -1.34 0.00 0.00 175.55 170.72 1uop n VAL 293 N 3.87 1.27 -3.81 3.14 0.31 0.46 -4.86 118.33 118.71 1uop n VAL 293 Ca 0.14 0.08 -0.05 0.00 -0.01 0.00 0.00 64.34 64.50 1uop n VAL 293 Cb 0.38 -1.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 1uop n VAL 293 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1uop s THR 294 N -2.50 0.00 0.06 2.52 -1.32 -1.15 -4.38 115.64 108.86 1uop s THR 294 Ca -0.21 -0.73 -0.01 0.00 -1.21 0.00 0.00 61.69 59.54 1uop s THR 294 Cb 0.05 -2.38 -0.04 0.00 -1.51 0.00 0.00 72.50 68.62 1uop s THR 294 CO 0.29 0.00 -0.04 0.54 -2.21 0.00 0.00 174.62 173.20 1uop s ASN 295 N -3.09 0.57 -0.24 8.08 4.22 -1.26 -0.26 114.94 122.96 1uop s ASN 295 Ca 0.15 -0.98 -0.01 0.00 -2.14 0.00 0.00 52.86 49.88 1uop s ASN 295 Cb -0.03 0.18 0.07 0.00 1.28 0.00 0.00 41.25 42.76 1uop s ASN 295 CO 0.05 -0.57 0.04 -1.61 -2.04 0.00 0.00 177.10 172.97 1uop s GLU 296 N -3.80 0.89 5.98 3.55 0.41 -0.10 -4.91 118.70 120.71 1uop s GLU 296 Ca 0.07 -0.77 0.00 0.00 -0.41 0.00 0.00 54.97 53.85 1uop s GLU 296 Cb 0.07 -2.18 0.00 0.00 -1.78 0.00 0.00 34.13 30.24 1uop s GLU 296 CO -0.09 -0.75 0.00 0.41 -0.49 0.00 0.00 175.26 174.34 1uop n GLY 297 N 4.89 3.62 0.47 -1.39 0.00 -1.26 -1.60 105.19 109.92 1uop n GLY 297 Ca -0.07 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.17 1uop n GLY 297 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uop n THR 298 N 0.00 0.02 -3.10 2.61 -2.24 -1.26 -4.76 114.28 105.55 1uop n THR 298 Ca 0.00 -0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 61.10 1uop n THR 298 Cb 0.00 0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 68.61 1uop n THR 298 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1uop s VAL 299 N -1.98 4.82 -0.21 2.28 1.01 -0.63 -1.22 120.40 124.47 1uop s VAL 299 Ca 0.38 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.54 1uop s VAL 299 Cb 0.21 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 32.37 1uop s VAL 299 CO 0.33 -0.55 0.03 -0.36 0.00 0.00 0.00 175.10 174.55 1uop s PHE 300 N 2.84 3.08 -0.20 5.22 0.40 0.21 -0.92 117.98 128.61 1uop s PHE 300 Ca 0.24 -0.36 -0.18 0.00 -0.60 0.00 0.00 56.93 56.02 1uop s PHE 300 Cb -0.14 -2.13 -0.03 0.00 0.51 0.00 0.00 43.02 41.23 1uop s PHE 300 CO 0.18 -0.22 0.52 0.99 0.70 0.00 0.00 175.22 177.40 1uop s THR 301 N 1.10 5.11 -0.00 0.64 2.01 0.64 -0.36 115.64 124.78 1uop s THR 301 Ca 0.03 0.96 0.06 0.00 0.31 0.00 0.00 61.69 63.05 1uop s THR 301 Cb -0.14 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 1uop s THR 301 CO 0.02 0.18 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.59 1uop s PHE 302 N 1.60 1.66 0.02 4.92 0.08 -0.19 -0.40 117.98 125.68 1uop s PHE 302 Ca 0.24 -0.33 -0.30 0.00 0.12 0.00 0.00 56.93 56.67 1uop s PHE 302 Cb -0.15 -1.05 -0.04 0.00 -0.57 0.00 0.00 43.02 41.21 1uop s PHE 302 CO 0.10 -0.00 0.96 0.21 -0.10 0.00 0.00 175.22 176.38 1uop s LYS 303 N -0.61 4.58 0.06 0.44 2.20 0.38 -1.46 119.74 125.33 1uop s LYS 303 Ca 0.07 1.39 -0.00 0.00 -0.36 0.00 0.00 55.97 57.07 1uop s LYS 303 Cb -0.07 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.77 1uop s LYS 303 CO -0.00 0.01 -0.04 -0.08 -0.36 0.00 0.00 175.35 174.88 1uop s THR 304 N 0.80 0.34 -0.26 3.43 -1.32 0.06 -0.94 115.64 117.76 1uop s THR 304 Ca 0.50 -1.70 0.10 0.00 -1.21 0.00 0.00 61.69 59.38 1uop s THR 304 Cb -0.21 -1.37 0.22 0.00 -1.51 0.00 0.00 72.50 69.63 1uop s THR 304 CO 0.28 -0.88 1.16 -0.46 -2.21 0.00 0.00 174.62 172.50 1uop n ASN 305 N 0.32 2.57 -4.64 8.08 0.23 -1.23 -1.17 115.26 119.41 1uop n ASN 305 Ca -0.15 -2.43 -0.43 0.00 -0.53 0.00 0.00 54.58 51.05 1uop n ASN 305 Cb 0.60 -0.24 -0.03 0.00 -2.08 0.00 0.00 39.78 38.03 1uop n ASN 305 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1uop s ARG 306 N -1.74 3.81 -2.03 -3.83 6.06 -1.26 -1.48 118.95 118.47 1uop s ARG 306 Ca 0.19 2.08 0.00 0.00 -2.50 0.00 0.00 55.73 55.51 1uop s ARG 306 Cb 0.15 -4.13 0.00 0.00 0.06 0.00 0.00 34.95 31.02 1uop s ARG 306 CO 0.05 -1.30 0.00 0.72 -2.50 0.00 0.00 175.30 172.28 1uop n HIS 307 N 8.66 -0.16 -3.01 5.12 8.25 -1.26 -4.89 115.22 127.93 1uop n HIS 307 Ca 0.21 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.54 1uop n HIS 307 Cb 0.44 -3.36 -0.03 0.00 1.12 0.00 0.00 29.99 28.15 1uop n HIS 307 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1uop n SER 308 N -1.29 -2.23 0.21 0.41 3.41 -0.55 -5.01 113.62 108.57 1uop n SER 308 Ca -0.20 -2.73 0.17 0.00 -0.26 0.00 0.00 58.87 55.85 1uop n SER 308 Cb 0.64 0.83 0.83 0.00 -0.26 0.00 0.00 64.21 66.25 1uop n SER 308 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1uop h PRO 309 N 5.15 0.00 -0.21 4.33 0.13 -1.91 0.14 132.00 139.64 1uop h PRO 309 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1uop h PRO 309 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1uop h PRO 309 CO 0.17 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.03 1uop n ASN 310 N -3.83 2.08 -0.31 1.44 3.02 -1.26 -1.18 115.26 115.22 1uop n ASN 310 Ca 0.02 -1.78 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 1uop n ASN 310 Cb 0.32 -0.13 -0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1uop n ASN 310 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1uop n TYR 311 N 0.60 -0.84 -3.91 3.10 4.02 0.49 -1.39 117.16 119.23 1uop n TYR 311 Ca 0.17 0.46 -0.09 0.00 -0.01 0.00 0.00 57.90 58.42 1uop n TYR 311 Cb 0.40 -1.10 -0.01 0.00 -0.02 0.00 0.00 39.34 38.60 1uop n TYR 311 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 1uop s ARG 312 N -4.25 1.91 -0.16 -0.72 1.70 -0.32 -4.27 118.95 112.84 1uop s ARG 312 Ca 0.00 -1.31 -0.04 0.00 -0.47 0.00 0.00 55.73 53.91 1uop s ARG 312 Cb 0.00 0.56 -0.03 0.00 -0.57 0.00 0.00 34.95 34.92 1uop s ARG 312 CO 0.00 -0.86 -0.04 -0.51 -1.08 0.00 0.00 175.30 172.82 1uop s LEU 313 N -3.04 3.23 0.15 -1.89 1.43 -0.43 -0.76 118.68 117.38 1uop s LEU 313 Ca 0.18 -0.14 0.10 0.00 -1.03 0.00 0.00 54.13 53.23 1uop s LEU 313 Cb -0.04 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 1uop s LEU 313 CO 0.11 0.16 -0.22 0.27 0.23 0.00 0.00 176.35 176.90 1uop s ILE 314 N 0.42 2.02 -0.22 -0.59 -4.36 -0.53 -0.57 121.20 117.37 1uop s ILE 314 Ca -0.04 -1.83 -0.07 0.00 -0.26 0.00 0.00 60.65 58.45 1uop s ILE 314 Cb -0.14 -1.88 -0.03 0.00 1.25 0.00 0.00 42.46 41.65 1uop s ILE 314 CO 0.03 -0.13 0.06 0.20 0.24 0.00 0.00 174.94 175.34 1uop s ASN 315 N -2.38 5.25 -0.19 4.36 0.02 0.85 -1.02 114.94 121.83 1uop s ASN 315 Ca 0.15 -0.11 -0.03 0.00 -1.02 0.00 0.00 52.86 51.85 1uop s ASN 315 Cb -0.08 -1.92 -0.01 0.00 0.02 0.00 0.00 41.25 39.25 1uop s ASN 315 CO 0.07 0.05 -0.06 -0.63 0.02 0.00 0.00 177.10 176.55 1uop s ILE 316 N 1.10 3.42 -0.33 0.60 1.01 0.52 -1.75 121.20 125.76 1uop s ILE 316 Ca 0.04 -0.50 -0.19 0.00 0.00 0.00 0.00 60.65 60.00 1uop s ILE 316 Cb -0.14 -2.52 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 1uop s ILE 316 CO 0.03 0.45 0.58 -0.62 0.00 0.00 0.00 174.94 175.38 1uop s ASP 317 N 1.06 6.40 0.58 3.58 -1.08 -1.26 -0.62 116.67 125.33 1uop s ASP 317 Ca 0.01 0.19 0.28 0.00 -0.52 0.00 0.00 52.55 52.51 1uop s ASP 317 Cb -0.15 -2.30 1.59 0.00 -1.46 0.00 0.00 42.92 40.60 1uop s ASP 317 CO -0.00 -0.49 2.05 -0.26 0.52 0.00 0.00 175.17 176.98 1uop h PHE 318 N 8.35 0.00 0.00 -5.34 -1.00 -1.57 0.83 116.94 118.22 1uop h PHE 318 Ca -0.27 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.51 1uop h PHE 318 Cb 1.12 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.68 1uop h PHE 318 CO 0.74 0.00 -0.22 0.25 -1.61 0.00 0.00 178.31 177.48 1uop n THR 319 N -3.84 0.01 -3.09 -1.55 -2.24 -1.26 -4.16 114.28 98.15 1uop n THR 319 Ca 0.03 -0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.63 1uop n THR 319 Cb 0.41 -0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 1uop n THR 319 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1uop n ASP 320 N -1.51 -0.22 -0.01 3.42 2.03 0.24 -5.04 116.55 115.46 1uop n ASP 320 Ca 0.06 -3.01 0.14 0.00 0.52 0.00 0.00 54.79 52.51 1uop n ASP 320 Cb 0.34 -0.04 0.64 0.00 -0.72 0.00 0.00 41.12 41.34 1uop n ASP 320 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1uop n PRO 321 N 0.87 0.24 -1.96 -0.67 -0.04 -0.92 -4.42 135.00 128.10 1uop n PRO 321 Ca 0.19 -0.03 -0.39 0.00 -0.04 0.00 0.00 63.50 63.23 1uop n PRO 321 Cb 0.61 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.58 1uop n PRO 321 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1uop s GLU 322 N -2.78 3.68 0.28 0.54 2.02 -1.26 -4.91 118.70 116.28 1uop s GLU 322 Ca 0.21 2.19 0.01 0.00 0.02 0.00 0.00 54.97 57.40 1uop s GLU 322 Cb 0.19 -2.57 0.55 0.00 0.10 0.00 0.00 34.13 32.41 1uop s GLU 322 CO 0.51 -0.74 1.84 1.49 0.02 0.00 0.00 175.26 178.38 1uop h GLU 323 N 2.23 0.97 0.00 1.61 4.81 -1.99 0.09 114.58 122.31 1uop h GLU 323 Ca -0.50 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1uop h GLU 323 Cb 1.26 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.42 1uop h GLU 323 CO 0.61 0.64 0.01 0.66 -0.73 0.00 0.00 179.01 180.20 1uop h SER 324 N 1.00 0.00 0.37 1.04 4.64 -1.96 -1.89 113.55 116.75 1uop h SER 324 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 1uop h SER 324 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1uop h SER 324 CO -0.26 0.00 -0.99 0.29 -0.87 0.00 0.00 176.83 174.99 1uop n LYS 325 N -3.00 0.23 -1.80 4.77 4.76 0.02 -4.97 118.16 118.17 1uop n LYS 325 Ca -0.03 -0.01 -0.39 0.00 -2.87 0.00 0.00 58.31 55.02 1uop n LYS 325 Cb 0.07 -1.57 0.03 0.00 -1.84 0.00 0.00 35.03 31.72 1uop n LYS 325 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1uop s TRP 326 N -3.16 2.35 -0.13 2.13 0.51 -0.71 -4.94 118.94 114.99 1uop s TRP 326 Ca 0.05 1.34 -0.06 0.00 -2.12 0.00 0.00 56.10 55.31 1uop s TRP 326 Cb 0.15 -3.83 -0.04 0.00 -0.81 0.00 0.00 33.47 28.94 1uop s TRP 326 CO 0.80 -2.88 0.07 0.15 -0.51 0.00 0.00 176.95 174.58 1uop s LYS 327 N -2.76 3.49 -0.44 4.98 -0.14 -0.71 -4.95 119.74 119.21 1uop s LYS 327 Ca 0.68 -0.28 -0.23 0.00 -1.36 0.00 0.00 55.97 54.78 1uop s LYS 327 Cb -0.41 -3.08 0.02 0.00 -1.68 0.00 0.00 37.83 32.68 1uop s LYS 327 CO 0.50 0.59 0.77 0.08 -0.76 0.00 0.00 175.35 176.53 1uop s VAL 328 N -0.52 4.67 -0.14 3.17 1.01 -1.26 -0.11 120.40 127.22 1uop s VAL 328 Ca 0.11 0.47 -0.25 0.00 0.00 0.00 0.00 61.98 62.30 1uop s VAL 328 Cb -0.12 -4.30 -0.25 0.00 0.00 0.00 0.00 36.38 31.72 1uop s VAL 328 CO 0.02 -0.67 0.63 0.25 0.00 0.00 0.00 175.10 175.33 1uop h LEU 329 N 10.05 0.08 -7.34 3.92 5.85 -1.16 -3.43 115.31 123.27 1uop h LEU 329 Ca -0.25 -0.86 -0.60 0.00 0.84 0.00 0.00 57.88 57.01 1uop h LEU 329 Cb 1.09 -0.03 -0.40 0.00 0.37 0.00 0.00 40.66 41.69 1uop h LEU 329 CO 0.95 1.21 -0.75 -0.69 -0.34 0.00 0.00 178.44 178.82 1uop s VAL 330 N -2.30 1.27 0.87 1.05 1.01 -0.99 -4.26 120.40 117.05 1uop s VAL 330 Ca -0.21 -1.56 -0.11 0.00 0.00 0.00 0.00 61.98 60.10 1uop s VAL 330 Cb 0.00 -1.89 0.12 0.00 0.00 0.00 0.00 36.38 34.61 1uop s VAL 330 CO 0.69 -0.56 1.17 -2.84 0.00 0.00 0.00 175.10 173.55 1uop s PRO 331 N 1.43 1.24 0.34 2.72 0.02 -1.26 -1.32 135.00 138.17 1uop s PRO 331 Ca 0.08 1.63 -0.29 0.00 0.02 0.00 0.00 61.00 62.44 1uop s PRO 331 Cb -0.18 -1.74 -0.11 0.00 0.02 0.00 0.00 34.50 32.49 1uop s PRO 331 CO -0.18 -2.48 1.47 -2.00 -0.33 0.00 0.00 177.00 173.48 1uop s GLU 332 N -4.46 4.17 0.43 5.54 2.12 -1.26 -4.81 118.70 120.43 1uop s GLU 332 Ca 0.69 2.48 -0.22 0.00 0.36 0.00 0.00 54.97 58.29 1uop s GLU 332 Cb -0.25 -3.01 -0.10 0.00 0.26 0.00 0.00 34.13 31.02 1uop s GLU 332 CO 0.55 -0.48 0.97 -1.58 -0.54 0.00 0.00 175.26 174.19 1uop s HIS 333 N -0.76 3.28 0.35 5.30 5.65 -1.26 -4.98 115.29 122.87 1uop s HIS 333 Ca 0.55 1.62 0.02 0.00 0.25 0.00 0.00 55.06 57.51 1uop s HIS 333 Cb -0.45 -2.92 0.65 0.00 -1.18 0.00 0.00 32.58 28.68 1uop s HIS 333 CO 0.56 -0.26 2.01 1.49 -0.65 0.00 0.00 174.74 177.89 1uop h GLU 334 N 2.00 0.82 0.00 2.88 4.81 -1.99 -3.39 114.58 119.71 1uop h GLU 334 Ca -0.49 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1uop h GLU 334 Cb 1.19 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.39 1uop h GLU 334 CO 0.61 0.54 -0.35 1.17 -0.73 0.00 0.00 179.01 180.26 1uop n LYS 335 N -4.44 0.66 -2.72 1.92 4.81 -1.26 -5.03 118.16 112.10 1uop n LYS 335 Ca 0.07 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.09 1uop n LYS 335 Cb 0.05 -0.67 -0.04 0.00 0.02 0.00 0.00 35.03 34.39 1uop n LYS 335 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1uop s ASP 336 N -2.55 7.45 -0.10 3.14 1.01 -1.26 -4.85 116.67 119.50 1uop s ASP 336 Ca 0.00 1.75 -0.25 0.00 0.71 0.00 0.00 52.55 54.76 1uop s ASP 336 Cb 0.00 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 1uop s ASP 336 CO 0.00 -0.14 0.80 -0.69 0.21 0.00 0.00 175.17 175.35 1uop s VAL 337 N 0.37 4.95 -0.66 -1.27 1.01 -0.80 -4.41 120.40 119.58 1uop s VAL 337 Ca 0.49 1.62 -0.27 0.00 0.00 0.00 0.00 61.98 63.81 1uop s VAL 337 Cb -0.23 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.06 1uop s VAL 337 CO 0.29 0.14 1.30 -0.22 0.00 0.00 0.00 175.10 176.61 1uop s LEU 338 N 1.40 3.29 -0.05 3.92 2.96 -0.49 0.19 118.68 129.90 1uop s LEU 338 Ca 0.40 -0.14 -0.26 0.00 -0.22 0.00 0.00 54.13 53.91 1uop s LEU 338 Cb -0.18 -2.81 -0.21 0.00 0.50 0.00 0.00 46.19 43.49 1uop s LEU 338 CO 0.17 -1.73 1.08 -0.33 -1.32 0.00 0.00 176.35 174.22 1uop h GLU 339 N 10.23 -0.05 -3.16 1.98 5.08 -0.92 -3.45 114.58 124.29 1uop h GLU 339 Ca -0.27 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1uop h GLU 339 Cb 1.06 0.01 -0.11 0.00 0.50 0.00 0.00 28.75 30.21 1uop h GLU 339 CO 1.23 0.54 0.10 1.67 -1.00 0.00 0.00 179.01 181.56 1uop s TRP 340 N -3.64 -0.34 -0.00 4.33 1.48 -1.17 -5.03 118.94 114.56 1uop s TRP 340 Ca -0.16 0.05 0.00 0.00 -1.06 0.00 0.00 56.10 54.94 1uop s TRP 340 Cb 0.00 0.46 0.00 0.00 -1.16 0.00 0.00 33.47 32.78 1uop s TRP 340 CO 0.64 -0.86 -0.01 0.08 -4.06 0.00 0.00 176.95 172.74 1uop s VAL 341 N -3.80 0.08 0.08 -0.66 1.01 -1.26 -1.63 120.40 114.22 1uop s VAL 341 Ca 0.04 -0.02 0.06 0.00 0.00 0.00 0.00 61.98 62.07 1uop s VAL 341 Cb -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.25 1uop s VAL 341 CO -0.09 0.04 -0.17 0.00 0.00 0.00 0.00 175.10 174.88 1uop s ALA 342 N 0.14 1.42 -0.15 5.51 0.00 -0.31 -4.90 121.76 123.47 1uop s ALA 342 Ca -0.01 -1.06 -0.06 0.00 0.00 0.00 0.00 51.96 50.83 1uop s ALA 342 Cb -0.02 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 1uop s ALA 342 CO -0.00 0.25 0.06 0.00 0.00 0.00 0.00 175.76 176.07 1uop s VAL 344 N -0.12 0.12 -1.53 0.00 0.11 -0.44 -2.07 120.40 116.48 1uop s VAL 344 Ca 0.07 -1.02 -0.08 0.00 -2.93 0.00 0.00 61.98 58.02 1uop s VAL 344 Cb -0.12 -0.89 0.06 0.00 -1.53 0.00 0.00 36.38 33.90 1uop s VAL 344 CO 0.01 -0.56 0.58 -1.14 -3.33 0.00 0.00 175.10 170.66 1uop n ARG 345 N 0.76 -3.34 0.00 1.54 0.63 0.09 -1.69 116.66 114.64 1uop n ARG 345 Ca -0.19 0.40 0.00 0.00 -0.92 0.00 0.00 57.85 57.14 1uop n ARG 345 Cb 0.59 -4.78 0.00 0.00 0.45 0.00 0.00 32.46 28.71 1uop n ARG 345 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1uop n SER 346 N -2.85 0.00 -0.41 6.15 7.64 -0.14 -4.09 113.62 119.92 1uop n SER 346 Ca -0.14 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.80 1uop n SER 346 Cb 0.60 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.90 1uop n SER 346 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1uop n ASN 347 N 2.37 1.47 -4.74 6.43 6.94 -1.24 -5.00 115.26 121.49 1uop n ASN 347 Ca 0.00 -2.82 -0.32 0.00 -0.02 0.00 0.00 54.58 51.43 1uop n ASN 347 Cb 0.00 -0.37 -0.07 0.00 -2.36 0.00 0.00 39.78 36.98 1uop n ASN 347 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1uop s PHE 348 N -1.86 3.17 -0.09 -2.53 0.08 -0.68 -1.05 117.98 115.01 1uop s PHE 348 Ca 0.24 0.11 0.04 0.00 0.12 0.00 0.00 56.93 57.44 1uop s PHE 348 Cb 0.23 -1.67 -0.01 0.00 -0.57 0.00 0.00 43.02 41.00 1uop s PHE 348 CO -0.01 0.51 -0.21 -0.51 -0.10 0.00 0.00 175.22 174.89 1uop s LEU 349 N -1.92 2.27 -0.30 -0.37 1.43 0.44 -1.32 118.68 118.91 1uop s LEU 349 Ca 0.24 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 1uop s LEU 349 Cb -0.12 -1.45 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 1uop s LEU 349 CO 0.16 0.20 0.23 -0.69 0.23 0.00 0.00 176.35 176.48 1uop s VAL 350 N 0.09 5.28 -0.14 -1.59 1.01 0.13 0.09 120.40 125.28 1uop s VAL 350 Ca -0.10 0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.00 1uop s VAL 350 Cb -0.16 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 1uop s VAL 350 CO 0.06 0.17 -0.13 -0.76 0.00 0.00 0.00 175.10 174.44 1uop s LEU 351 N 1.80 2.68 -0.23 3.92 1.02 -0.00 -1.16 118.68 126.71 1uop s LEU 351 Ca 0.08 -0.36 -0.03 0.00 0.02 0.00 0.00 54.13 53.84 1uop s LEU 351 Cb -0.16 -1.61 0.00 0.00 0.02 0.00 0.00 46.19 44.44 1uop s LEU 351 CO 0.11 0.14 -0.04 0.00 0.02 0.00 0.00 176.35 176.57 1uop s TYR 353 N 1.44 3.13 -0.31 0.00 2.02 -0.87 -0.21 117.35 122.55 1uop s TYR 353 Ca 0.04 0.00 -0.07 0.00 -0.37 0.00 0.00 57.07 56.68 1uop s TYR 353 Cb -0.15 -1.54 0.02 0.00 -0.40 0.00 0.00 41.96 39.89 1uop s TYR 353 CO -0.03 0.52 0.09 -1.17 -1.57 0.00 0.00 175.55 173.39 1uop s LEU 354 N -2.84 4.00 -0.30 -1.29 2.96 0.13 -1.23 118.68 120.11 1uop s LEU 354 Ca 0.30 -0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 53.38 1uop s LEU 354 Cb -0.11 -1.89 0.04 0.00 0.50 0.00 0.00 46.19 44.74 1uop s LEU 354 CO 0.22 -0.23 0.01 -2.28 -1.32 0.00 0.00 176.35 172.76 1uop s HIS 355 N 1.49 3.23 -1.44 5.38 5.65 0.64 -1.91 115.29 128.33 1uop s HIS 355 Ca 0.02 -1.71 -0.06 0.00 0.25 0.00 0.00 55.06 53.56 1uop s HIS 355 Cb -0.18 -2.14 0.01 0.00 -1.18 0.00 0.00 32.58 29.09 1uop s HIS 355 CO 0.03 -0.77 0.26 -0.25 -0.65 0.00 0.00 174.74 173.36 1uop n ASP 356 N 4.67 -0.42 -1.34 9.88 8.00 -1.26 -1.73 116.55 134.35 1uop n ASP 356 Ca -0.14 -1.18 -0.14 0.00 0.71 0.00 0.00 54.79 54.05 1uop n ASP 356 Cb 0.44 -2.17 -0.03 0.00 -0.02 0.00 0.00 41.12 39.35 1uop n ASP 356 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1uop n VAL 357 N -4.57 -0.38 -4.33 2.53 0.31 -1.26 -5.01 118.33 105.62 1uop n VAL 357 Ca -0.28 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 63.86 1uop n VAL 357 Cb 0.67 -1.85 -0.13 0.00 -0.91 0.00 0.00 33.84 31.62 1uop n VAL 357 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1uop s LYS 358 N -4.04 0.86 0.25 5.55 1.02 -0.71 -4.45 119.74 118.22 1uop s LYS 358 Ca 0.00 -0.67 -0.17 0.00 0.02 0.00 0.00 55.97 55.15 1uop s LYS 358 Cb 0.00 -0.84 -0.08 0.00 -0.52 0.00 0.00 37.83 36.39 1uop s LYS 358 CO 0.00 0.21 0.70 -0.80 -0.92 0.00 0.00 175.35 174.54 1uop s ASN 359 N -1.00 6.90 0.25 2.83 0.02 -0.28 -0.26 114.94 123.40 1uop s ASN 359 Ca 0.01 1.30 0.09 0.00 -1.02 0.00 0.00 52.86 53.24 1uop s ASN 359 Cb -0.07 -2.38 -0.05 0.00 0.02 0.00 0.00 41.25 38.77 1uop s ASN 359 CO 0.01 -0.06 -0.15 0.42 0.02 0.00 0.00 177.10 177.34 1uop s THR 360 N -1.71 2.00 -0.02 1.60 -4.23 -0.36 -4.78 115.64 108.13 1uop s THR 360 Ca 0.47 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 1uop s THR 360 Cb -0.14 -2.23 0.03 0.00 1.34 0.00 0.00 72.50 71.50 1uop s THR 360 CO 0.19 -0.46 0.02 -0.22 -0.54 0.00 0.00 174.62 173.61 1uop s LEU 361 N -3.42 1.07 0.05 4.79 2.96 -1.26 -2.06 118.68 120.81 1uop s LEU 361 Ca 0.27 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 1uop s LEU 361 Cb -0.01 -0.12 -0.03 0.00 0.50 0.00 0.00 46.19 46.53 1uop s LEU 361 CO 0.11 -0.12 -0.06 -1.10 -1.32 0.00 0.00 176.35 173.86 1uop s GLN 362 N 1.10 0.53 -0.18 1.98 -0.21 -0.20 -1.34 119.66 121.34 1uop s GLN 362 Ca -0.09 -0.85 -0.05 0.00 0.02 0.00 0.00 55.36 54.39 1uop s GLN 362 Cb -0.13 -0.12 -0.03 0.00 1.00 0.00 0.00 33.01 33.73 1uop s GLN 362 CO -0.03 -0.00 -0.01 -1.17 -2.12 0.00 0.00 175.29 171.96 1uop s LEU 363 N -1.91 3.33 0.26 2.90 2.96 0.81 -0.82 118.68 126.21 1uop s LEU 363 Ca -0.07 -0.13 0.11 0.00 -0.22 0.00 0.00 54.13 53.83 1uop s LEU 363 Cb -0.06 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 1uop s LEU 363 CO -0.02 0.13 -0.20 -1.00 -1.32 0.00 0.00 176.35 173.94 1uop s HIS 364 N 0.62 2.23 0.14 5.38 3.76 0.11 0.00 115.29 127.54 1uop s HIS 364 Ca -0.01 -0.36 -0.30 0.00 -0.15 0.00 0.00 55.06 54.24 1uop s HIS 364 Cb -0.14 -1.00 -0.07 0.00 1.11 0.00 0.00 32.58 32.48 1uop s HIS 364 CO 0.02 0.64 1.00 0.34 -0.85 0.00 0.00 174.74 175.89 1uop s ASP 365 N -3.32 7.44 0.18 1.40 2.15 0.13 -0.42 116.67 124.23 1uop s ASP 365 Ca 0.27 1.89 -0.07 0.00 0.43 0.00 0.00 52.55 55.08 1uop s ASP 365 Cb -0.05 -2.59 0.07 0.00 -0.30 0.00 0.00 42.92 40.04 1uop s ASP 365 CO 0.13 -0.09 1.52 0.25 -0.17 0.00 0.00 175.17 176.81 1uop h LEU 366 N 5.34 0.81 -0.64 -1.34 5.85 -1.41 0.19 115.31 124.12 1uop h LEU 366 Ca -0.43 -0.38 -0.12 0.00 0.84 0.00 0.00 57.88 57.79 1uop h LEU 366 Cb 1.21 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1uop h LEU 366 CO 0.72 1.12 -0.23 0.00 -0.34 0.00 0.00 178.44 179.71 1uop h ALA 367 N 0.91 0.82 0.00 1.25 0.00 -1.94 -3.35 119.26 116.96 1uop h ALA 367 Ca 0.05 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1uop h ALA 367 Cb 0.97 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1uop h ALA 367 CO 0.09 0.64 -1.27 0.25 0.00 0.00 0.00 179.25 178.97 1uop n THR 368 N -4.11 0.03 -0.72 0.00 -2.24 -1.24 -5.01 114.28 100.99 1uop n THR 368 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1uop n THR 368 Cb 0.44 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1uop n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uop n GLY 369 N 2.21 0.91 3.75 3.38 0.00 0.65 -4.82 105.19 111.28 1uop n GLY 369 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1uop n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uop s ALA 370 N -3.47 3.55 0.25 4.61 0.00 -1.25 -4.57 121.76 120.88 1uop s ALA 370 Ca 0.00 1.24 -0.30 0.00 0.00 0.00 0.00 51.96 52.89 1uop s ALA 370 Cb 0.00 -3.50 -0.11 0.00 0.00 0.00 0.00 23.12 19.51 1uop s ALA 370 CO 0.00 -0.64 1.56 -1.17 0.00 0.00 0.00 175.76 175.51 1uop s LEU 371 N -0.87 4.36 -0.05 0.00 2.96 -1.26 -0.69 118.68 123.13 1uop s LEU 371 Ca 0.54 2.80 0.02 0.00 -0.22 0.00 0.00 54.13 57.27 1uop s LEU 371 Cb -0.39 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.64 1uop s LEU 371 CO 0.46 -0.84 -0.02 0.18 -1.32 0.00 0.00 176.35 174.80 1uop n LEU 372 N 2.73 1.92 -3.67 -0.68 4.77 0.10 -4.89 117.00 117.28 1uop n LEU 372 Ca 0.10 -0.02 -0.11 0.00 -0.03 0.00 0.00 56.01 55.95 1uop n LEU 372 Cb 0.38 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.31 1uop n LEU 372 CO 0.62 0.41 0.23 -0.75 -1.33 0.00 0.00 177.39 176.57 1uop s LYS 373 N -2.10 0.60 -0.24 3.23 2.47 -0.95 -4.99 119.74 117.77 1uop s LYS 373 Ca -0.05 0.91 -0.10 0.00 -1.56 0.00 0.00 55.97 55.17 1uop s LYS 373 Cb 0.02 0.18 -0.05 0.00 -1.46 0.00 0.00 37.83 36.52 1uop s LYS 373 CO 0.13 -0.12 0.15 0.42 0.16 0.00 0.00 175.35 176.09 1uop s ILE 374 N 0.95 5.18 -0.33 5.43 1.01 -1.26 -0.13 121.20 132.05 1uop s ILE 374 Ca -0.05 0.12 -0.24 0.00 0.00 0.00 0.00 60.65 60.48 1uop s ILE 374 Cb -0.05 -3.42 0.01 0.00 0.01 0.00 0.00 42.46 39.00 1uop s ILE 374 CO -0.08 0.34 0.81 -0.36 0.00 0.00 0.00 174.94 175.65 1uop s PHE 375 N 1.16 3.16 0.13 3.97 0.08 -0.45 -5.02 117.98 121.02 1uop s PHE 375 Ca 0.07 0.74 -0.31 0.00 0.12 0.00 0.00 56.93 57.55 1uop s PHE 375 Cb -0.14 -3.34 -0.07 0.00 -0.57 0.00 0.00 43.02 38.90 1uop s PHE 375 CO 0.05 -0.65 1.29 -1.25 -0.10 0.00 0.00 175.22 174.56 1uop s PRO 376 N 3.08 4.39 0.07 0.24 0.04 -1.26 -4.28 135.00 137.28 1uop s PRO 376 Ca 0.33 1.95 0.04 0.00 0.04 0.00 0.00 61.00 63.36 1uop s PRO 376 Cb -0.14 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.11 1uop s PRO 376 CO 0.15 -0.29 -0.12 -0.51 0.04 0.00 0.00 177.00 176.27 1uop s LEU 377 N 0.62 2.28 0.00 -3.56 1.43 -1.26 -5.08 118.68 113.12 1uop s LEU 377 Ca 0.59 -0.62 -0.19 0.00 -1.03 0.00 0.00 54.13 52.88 1uop s LEU 377 Cb -0.34 -0.40 0.28 0.00 0.03 0.00 0.00 46.19 45.76 1uop s LEU 377 CO 0.33 -0.13 1.19 -0.62 0.23 0.00 0.00 176.35 177.34 1uop n GLU 378 N 1.25 -2.54 -2.28 1.70 -0.58 -1.26 -4.97 120.64 111.97 1uop n GLU 378 Ca -0.21 -1.87 -0.43 0.00 -0.42 0.00 0.00 57.16 54.23 1uop n GLU 378 Cb 0.55 -1.56 -0.02 0.00 -0.57 0.00 0.00 31.44 29.83 1uop n GLU 378 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1uop s VAL 379 N -3.32 4.00 -2.35 2.62 -7.23 -1.26 -4.83 120.40 108.03 1uop s VAL 379 Ca 0.73 1.19 0.00 0.00 -1.81 0.00 0.00 61.98 62.09 1uop s VAL 379 Cb -0.05 -3.85 0.00 0.00 0.56 0.00 0.00 36.38 33.04 1uop s VAL 379 CO 0.54 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.74 1uop n GLY 380 N 4.02 -0.65 3.23 2.32 0.00 -1.26 -4.75 105.19 108.10 1uop n GLY 380 Ca 0.16 -0.49 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 1uop n GLY 380 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uop s SER 381 N -4.00 2.26 -0.25 1.61 0.01 -0.10 -1.13 113.70 112.11 1uop s SER 381 Ca 0.00 -0.54 -0.19 0.00 1.31 0.00 0.00 55.95 56.53 1uop s SER 381 Cb 0.00 -0.16 -0.02 0.00 0.21 0.00 0.00 66.02 66.04 1uop s SER 381 CO 0.00 0.10 0.56 -0.69 0.41 0.00 0.00 173.24 173.62 1uop s VAL 382 N -0.89 5.04 -0.08 3.43 1.01 -1.26 -1.31 120.40 126.34 1uop s VAL 382 Ca 0.06 0.98 0.01 0.00 0.00 0.00 0.00 61.98 63.03 1uop s VAL 382 Cb -0.09 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.43 1uop s VAL 382 CO 0.02 0.08 0.52 1.33 0.00 0.00 0.00 175.10 177.05 1uop n VAL 383 N 5.08 0.00 -3.65 2.92 0.24 0.25 -5.01 118.33 118.16 1uop n VAL 383 Ca -0.03 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.34 61.62 1uop n VAL 383 Cb 0.50 1.01 -0.07 0.00 -1.47 0.00 0.00 33.84 33.81 1uop n VAL 383 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1uop s GLY 384 N -0.06 -0.35 -0.19 7.63 0.00 -1.20 -4.94 107.32 108.21 1uop s GLY 384 Ca 0.01 0.78 -0.27 0.00 0.00 0.00 0.00 44.72 45.24 1uop s GLY 384 CO 0.01 0.50 0.72 -0.47 0.00 0.00 0.00 173.10 173.86 1uop s TYR 385 N -1.28 -0.73 0.03 1.90 5.04 -1.26 -0.83 117.35 120.21 1uop s TYR 385 Ca -0.12 1.63 0.01 0.00 -2.44 0.00 0.00 57.07 56.14 1uop s TYR 385 Cb -0.03 0.32 -0.02 0.00 0.35 0.00 0.00 41.96 42.58 1uop s TYR 385 CO 0.07 -0.45 -0.05 -1.54 -1.34 0.00 0.00 175.55 172.24 1uop s SER 386 N -0.17 0.48 0.00 4.32 1.04 -0.29 -4.98 113.70 114.10 1uop s SER 386 Ca -0.04 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 55.87 1uop s SER 386 Cb -0.03 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1uop s SER 386 CO 0.04 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.60 1uop n GLY 387 N 1.54 1.40 4.02 7.32 0.00 -1.26 -2.08 105.19 116.14 1uop n GLY 387 Ca -0.24 0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 1uop n GLY 387 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1uop s GLN 388 N 0.00 2.06 0.30 1.61 -2.07 -1.26 -4.45 119.66 115.84 1uop s GLN 388 Ca 0.00 -1.51 0.03 0.00 -1.82 0.00 0.00 55.36 52.06 1uop s GLN 388 Cb 0.00 -2.54 0.62 0.00 -1.09 0.00 0.00 33.01 29.99 1uop s GLN 388 CO 0.00 -1.09 1.84 -0.22 -1.32 0.00 0.00 175.29 174.50 1uop h LYS 389 N -0.08 0.90 0.00 9.60 3.64 -1.77 -0.98 116.57 127.88 1uop h LYS 389 Ca -0.31 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1uop h LYS 389 Cb 1.28 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1uop h LYS 389 CO 0.40 0.60 -0.17 0.36 -2.27 0.00 0.00 179.45 178.37 1uop n LYS 390 N -4.61 0.24 -1.94 1.90 2.85 -1.26 -0.96 118.16 114.37 1uop n LYS 390 Ca 0.19 0.16 -0.33 0.00 -1.05 0.00 0.00 58.31 57.28 1uop n LYS 390 Cb 0.38 -1.74 0.02 0.00 -0.65 0.00 0.00 35.03 33.05 1uop n LYS 390 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1uop s ASP 391 N -4.27 5.53 -0.10 -5.58 1.01 -0.37 -4.80 116.67 108.09 1uop s ASP 391 Ca 0.10 1.89 0.14 0.00 0.71 0.00 0.00 52.55 55.39 1uop s ASP 391 Cb 0.13 -2.54 0.25 0.00 1.01 0.00 0.00 42.92 41.77 1uop s ASP 391 CO 0.62 -1.34 1.15 0.35 0.21 0.00 0.00 175.17 176.16 1uop n THR 392 N -2.15 1.68 -3.71 -1.27 -2.24 -1.26 -0.73 114.28 104.59 1uop n THR 392 Ca 0.09 -1.86 -0.10 0.00 -2.27 0.00 0.00 64.05 59.91 1uop n THR 392 Cb 0.52 -0.03 -0.06 0.00 -2.10 0.00 0.00 70.33 68.67 1uop n THR 392 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1uop s GLU 393 N -2.33 0.97 0.15 -0.78 -1.05 -1.26 -0.28 118.70 114.12 1uop s GLU 393 Ca 0.25 -0.74 0.10 0.00 -0.15 0.00 0.00 54.97 54.43 1uop s GLU 393 Cb 0.21 0.42 -0.04 0.00 -0.44 0.00 0.00 34.13 34.28 1uop s GLU 393 CO 0.03 -0.35 -0.22 0.96 0.95 0.00 0.00 175.26 176.63 1uop s ILE 394 N -3.62 2.02 0.10 1.83 -4.36 -0.31 -4.46 121.20 112.41 1uop s ILE 394 Ca 0.02 -1.81 0.10 0.00 -0.26 0.00 0.00 60.65 58.71 1uop s ILE 394 Cb 0.02 -1.87 -0.04 0.00 1.25 0.00 0.00 42.46 41.83 1uop s ILE 394 CO -0.10 -0.11 -0.26 -0.36 0.24 0.00 0.00 174.94 174.35 1uop s PHE 395 N -1.49 2.34 -0.04 1.37 0.40 -0.88 -1.06 117.98 118.63 1uop s PHE 395 Ca 0.14 -0.37 -0.12 0.00 -0.60 0.00 0.00 56.93 55.98 1uop s PHE 395 Cb -0.08 -1.30 0.02 0.00 0.51 0.00 0.00 43.02 42.16 1uop s PHE 395 CO 0.07 0.29 0.26 1.52 0.70 0.00 0.00 175.22 178.05 1uop s TYR 396 N -1.00 -0.16 -0.15 0.36 1.13 -0.45 -1.14 117.35 115.94 1uop s TYR 396 Ca 0.14 0.31 -0.01 0.00 -1.41 0.00 0.00 57.07 56.10 1uop s TYR 396 Cb -0.10 0.06 -0.01 0.00 -1.10 0.00 0.00 41.96 40.81 1uop s TYR 396 CO 0.05 -0.30 -0.12 -1.14 -2.51 0.00 0.00 175.55 171.54 1uop s GLN 397 N -0.92 3.36 -0.02 -3.49 0.74 -0.01 -0.42 119.66 118.91 1uop s GLN 397 Ca -0.10 -0.68 0.03 0.00 0.05 0.00 0.00 55.36 54.66 1uop s GLN 397 Cb -0.05 -2.69 -0.03 0.00 1.10 0.00 0.00 33.01 31.34 1uop s GLN 397 CO 0.03 0.12 -0.09 0.12 -0.55 0.00 0.00 175.29 174.92 1uop s PHE 398 N 0.60 2.85 0.13 1.67 5.36 0.11 -0.59 117.98 128.11 1uop s PHE 398 Ca -0.07 -0.05 -0.03 0.00 -0.96 0.00 0.00 56.93 55.81 1uop s PHE 398 Cb -0.15 -1.63 -0.03 0.00 -0.34 0.00 0.00 43.02 40.86 1uop s PHE 398 CO 0.03 0.33 0.10 -0.08 -1.46 0.00 0.00 175.22 174.14 1uop s THR 399 N -0.90 0.11 0.37 0.12 -1.32 -0.43 -1.35 115.64 112.24 1uop s THR 399 Ca 0.15 -1.76 -0.07 0.00 -1.21 0.00 0.00 61.69 58.80 1uop s THR 399 Cb -0.11 -1.93 0.02 0.00 -1.51 0.00 0.00 72.50 68.98 1uop s THR 399 CO 0.05 -0.48 0.60 -0.94 -2.21 0.00 0.00 174.62 171.64 1uop s SER 400 N -3.01 0.62 0.40 8.08 1.04 -1.22 -0.92 113.70 118.69 1uop s SER 400 Ca 0.20 -1.38 0.08 0.00 0.48 0.00 0.00 55.95 55.33 1uop s SER 400 Cb 0.06 0.74 0.84 0.00 0.10 0.00 0.00 66.02 67.77 1uop s SER 400 CO -0.00 -1.47 1.99 -0.26 0.98 0.00 0.00 173.24 174.48 1uop h PHE 401 N 2.05 0.37 0.00 5.02 0.04 -1.86 -2.28 116.94 120.28 1uop h PHE 401 Ca -0.30 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.46 1uop h PHE 401 Cb 1.24 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 39.28 1uop h PHE 401 CO 1.51 0.34 -0.72 1.28 -0.60 0.00 0.00 178.31 180.12 1uop n LEU 402 N -4.38 0.62 -3.81 1.54 4.77 -1.26 -4.42 117.00 110.06 1uop n LEU 402 Ca 0.01 -0.47 -0.12 0.00 -0.03 0.00 0.00 56.01 55.40 1uop n LEU 402 Cb 0.17 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.15 1uop n LEU 402 CO 0.37 0.15 -0.10 -0.55 -1.33 0.00 0.00 177.39 175.93 1uop s SER 403 N -2.41 -0.15 0.50 -1.43 0.15 -1.25 -4.52 113.70 104.59 1uop s SER 403 Ca 0.05 0.18 0.23 0.00 0.70 0.00 0.00 55.95 57.11 1uop s SER 403 Cb 0.10 0.36 1.30 0.00 -1.71 0.00 0.00 66.02 66.08 1uop s SER 403 CO 0.58 -0.25 1.96 -0.65 1.20 0.00 0.00 173.24 176.08 1uop h PRO 404 N 4.90 0.12 0.00 5.44 0.11 -1.86 -3.22 132.00 137.50 1uop h PRO 404 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1uop h PRO 404 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1uop h PRO 404 CO 0.38 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.66 1uop n GLY 405 N -1.61 -1.85 3.02 -0.55 0.00 -1.26 -4.61 105.19 98.33 1uop n GLY 405 Ca 0.12 -2.15 -0.18 0.00 0.00 0.00 0.00 46.02 43.82 1uop n GLY 405 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uop s ILE 406 N -0.39 0.66 -0.21 -0.61 1.01 -0.45 -3.69 121.20 117.51 1uop s ILE 406 Ca 0.00 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.09 1uop s ILE 406 Cb 0.00 -0.57 -0.05 0.00 0.01 0.00 0.00 42.46 41.85 1uop s ILE 406 CO 0.00 0.12 0.20 -0.63 0.00 0.00 0.00 174.94 174.63 1uop s ILE 407 N -0.33 5.35 0.14 2.92 1.01 0.53 -0.71 121.20 130.11 1uop s ILE 407 Ca 0.02 0.30 0.04 0.00 0.00 0.00 0.00 60.65 61.00 1uop s ILE 407 Cb -0.04 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 1uop s ILE 407 CO -0.00 0.37 0.15 -0.31 0.00 0.00 0.00 174.94 175.14 1uop s TYR 408 N 0.82 3.23 0.03 3.97 2.02 0.44 0.09 117.35 127.95 1uop s TYR 408 Ca 0.10 0.04 0.06 0.00 -0.37 0.00 0.00 57.07 56.90 1uop s TYR 408 Cb -0.13 -1.58 -0.02 0.00 -0.40 0.00 0.00 41.96 39.83 1uop s TYR 408 CO 0.03 0.52 -0.17 -1.58 -1.57 0.00 0.00 175.55 172.78 1uop s HIS 409 N -1.65 1.54 -0.07 2.71 5.65 -0.19 -1.35 115.29 121.92 1uop s HIS 409 Ca 0.31 -0.34 -0.03 0.00 0.25 0.00 0.00 55.06 55.25 1uop s HIS 409 Cb -0.11 -0.93 0.04 0.00 -1.18 0.00 0.00 32.58 30.40 1uop s HIS 409 CO 0.24 0.04 0.13 0.00 -0.65 0.00 0.00 174.74 174.51 1uop s ASP 411 N 2.26 6.62 0.00 0.00 -1.08 -1.26 -1.16 116.67 122.05 1uop s ASP 411 Ca 0.04 0.57 0.23 0.00 -0.52 0.00 0.00 52.55 52.86 1uop s ASP 411 Cb -0.12 -2.55 1.07 0.00 -1.46 0.00 0.00 42.92 39.86 1uop s ASP 411 CO -0.05 -1.24 1.72 0.18 0.52 0.00 0.00 175.17 176.30 1uop n LEU 412 N 7.88 0.91 0.08 -1.34 4.77 0.62 -3.05 117.00 126.87 1uop n LEU 412 Ca 0.13 -0.36 0.12 0.00 -0.03 0.00 0.00 56.01 55.87 1uop n LEU 412 Cb 0.49 -0.04 0.29 0.00 -2.33 0.00 0.00 43.42 41.82 1uop n LEU 412 CO 0.71 0.18 0.60 0.35 -1.33 0.00 0.00 177.39 177.90 1uop n THR 413 N -0.21 0.44 -2.66 -5.08 -2.24 -1.22 -4.89 114.28 98.43 1uop n THR 413 Ca 0.17 -0.26 -0.36 0.00 -2.27 0.00 0.00 64.05 61.33 1uop n THR 413 Cb 0.23 -0.33 -0.05 0.00 -2.10 0.00 0.00 70.33 68.08 1uop n THR 413 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1uop s LYS 414 N -3.13 4.27 0.17 -0.78 -0.14 -1.17 -4.97 119.74 113.98 1uop s LYS 414 Ca 0.08 1.38 -0.10 0.00 -1.36 0.00 0.00 55.97 55.98 1uop s LYS 414 Cb 0.13 -2.52 0.04 0.00 -1.68 0.00 0.00 37.83 33.80 1uop s LYS 414 CO 0.66 -0.03 1.60 1.49 -0.76 0.00 0.00 175.35 178.32 1uop h GLU 415 N 2.52 1.05 -5.08 1.68 4.57 -1.90 -3.39 114.58 114.02 1uop h GLU 415 Ca -0.48 -0.37 -0.63 0.00 -1.18 0.00 0.00 59.36 56.69 1uop h GLU 415 Cb 1.20 -0.07 -0.19 0.00 -0.16 0.00 0.00 28.75 29.53 1uop h GLU 415 CO 0.63 1.07 -0.58 -1.21 -1.18 0.00 0.00 179.01 177.74 1uop s GLU 416 N -4.90 3.85 -1.14 1.92 0.41 -1.26 -5.04 118.70 112.54 1uop s GLU 416 Ca -0.12 -0.39 -0.09 0.00 -0.41 0.00 0.00 54.97 53.97 1uop s GLU 416 Cb 0.13 -3.35 0.26 0.00 -1.78 0.00 0.00 34.13 29.39 1uop s GLU 416 CO 0.86 0.00 1.32 1.28 -0.49 0.00 0.00 175.26 178.24 1uop n LEU 417 N 4.38 5.78 -4.49 1.80 4.77 -1.26 -4.99 117.00 123.00 1uop n LEU 417 Ca -0.16 -4.95 -0.39 0.00 -0.03 0.00 0.00 56.01 50.48 1uop n LEU 417 Cb 0.52 -1.45 -0.11 0.00 -2.33 0.00 0.00 43.42 40.04 1uop n LEU 417 CO 0.33 1.33 -0.17 -1.61 -1.33 0.00 0.00 177.39 175.93 1uop s GLU 418 N -1.03 3.45 0.58 3.23 2.02 -1.26 -5.03 118.70 120.68 1uop s GLU 418 Ca 0.34 -0.65 -0.18 0.00 0.02 0.00 0.00 54.97 54.49 1uop s GLU 418 Cb -0.04 -3.66 -0.04 0.00 0.10 0.00 0.00 34.13 30.50 1uop s GLU 418 CO -0.01 -0.40 1.13 -1.25 0.02 0.00 0.00 175.26 174.75 1uop s PRO 419 N 1.67 3.13 0.05 0.39 0.04 -1.26 -4.71 135.00 134.31 1uop s PRO 419 Ca 0.05 1.58 0.04 0.00 0.04 0.00 0.00 61.00 62.71 1uop s PRO 419 Cb -0.17 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 1uop s PRO 419 CO 0.08 -1.02 -0.11 1.03 0.04 0.00 0.00 177.00 177.02 1uop s ARG 420 N -3.53 0.69 0.09 4.56 0.52 -0.03 -4.97 118.95 116.28 1uop s ARG 420 Ca 0.72 -0.78 -0.31 0.00 -0.52 0.00 0.00 55.73 54.84 1uop s ARG 420 Cb -0.24 -0.60 -0.09 0.00 0.52 0.00 0.00 34.95 34.55 1uop s ARG 420 CO 0.32 0.13 1.73 0.08 0.02 0.00 0.00 175.30 177.58 1uop s VAL 421 N -1.15 2.86 -0.22 3.52 1.01 -1.26 -1.02 120.40 124.14 1uop s VAL 421 Ca -0.04 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.26 1uop s VAL 421 Cb -0.09 -3.20 -0.14 0.00 0.00 0.00 0.00 36.38 32.95 1uop s VAL 421 CO 0.01 -0.00 -0.20 0.33 0.00 0.00 0.00 175.10 175.24 1uop n PHE 422 N 5.73 0.00 -3.76 5.22 7.35 0.11 -4.85 117.46 127.26 1uop n PHE 422 Ca 0.17 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.73 1uop n PHE 422 Cb 0.40 -0.85 -0.12 0.00 0.35 0.00 0.00 39.48 39.26 1uop n PHE 422 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1uop s ARG 423 N -2.44 0.26 -0.08 -4.13 6.06 -0.87 -4.99 118.95 112.75 1uop s ARG 423 Ca -0.30 0.45 -0.05 0.00 -2.50 0.00 0.00 55.73 53.33 1uop s ARG 423 Cb 0.08 0.01 0.03 0.00 0.06 0.00 0.00 34.95 35.14 1uop s ARG 423 CO 0.50 -0.10 0.19 -2.00 -2.50 0.00 0.00 175.30 171.39 1uop s GLU 424 N 0.70 0.17 -0.03 5.12 2.12 -1.26 -0.34 118.70 125.17 1uop s GLU 424 Ca -0.05 0.37 0.04 0.00 0.36 0.00 0.00 54.97 55.70 1uop s GLU 424 Cb -0.06 -0.06 -0.00 0.00 0.26 0.00 0.00 34.13 34.27 1uop s GLU 424 CO -0.04 -0.11 -0.16 0.14 -0.54 0.00 0.00 175.26 174.55 1uop s VAL 425 N 0.80 1.29 0.11 3.70 -7.23 -1.24 -5.08 120.40 112.74 1uop s VAL 425 Ca -0.06 -0.65 0.09 0.00 -1.81 0.00 0.00 61.98 59.55 1uop s VAL 425 Cb -0.07 -1.11 -0.04 0.00 0.56 0.00 0.00 36.38 35.72 1uop s VAL 425 CO -0.04 0.37 -0.19 0.42 -0.31 0.00 0.00 175.10 175.35 1uop s THR 426 N -0.02 2.76 -0.43 5.32 -4.23 -1.26 -4.32 115.64 113.45 1uop s THR 426 Ca -0.02 -1.51 -0.15 0.00 -1.18 0.00 0.00 61.69 58.84 1uop s THR 426 Cb -0.10 -2.25 0.04 0.00 1.34 0.00 0.00 72.50 71.53 1uop s THR 426 CO 0.01 0.12 0.33 -0.69 -0.54 0.00 0.00 174.62 173.86 1uop s VAL 427 N -1.11 5.25 0.20 2.29 1.01 -1.26 -5.02 120.40 121.76 1uop s VAL 427 Ca 0.17 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 1uop s VAL 427 Cb -0.10 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.19 1uop s VAL 427 CO 0.09 -0.40 1.38 -0.54 0.00 0.00 0.00 175.10 175.63 1uop s LYS 428 N 1.69 4.33 0.00 2.72 -0.14 -1.26 -2.86 119.74 124.22 1uop s LYS 428 Ca 0.05 2.16 0.00 0.00 -1.36 0.00 0.00 55.97 56.82 1uop s LYS 428 Cb -0.21 -3.17 0.00 0.00 -1.68 0.00 0.00 37.83 32.77 1uop s LYS 428 CO 0.09 -0.36 0.00 0.41 -0.76 0.00 0.00 175.35 174.74 1uop n GLY 429 N 2.56 2.16 2.94 -3.33 0.00 -1.26 -4.93 105.19 103.34 1uop n GLY 429 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 1uop n GLY 429 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uop s ILE 430 N -2.16 2.29 -0.41 -0.61 -1.09 -1.14 -5.08 121.20 113.00 1uop s ILE 430 Ca 0.00 -2.83 -0.29 0.00 -2.23 0.00 0.00 60.65 55.31 1uop s ILE 430 Cb 0.00 -2.63 0.01 0.00 -1.58 0.00 0.00 42.46 38.26 1uop s ILE 430 CO 0.00 -0.73 1.37 -0.62 -1.23 0.00 0.00 174.94 173.72 1uop s ASP 431 N 0.27 6.40 0.42 3.58 -1.08 -1.26 -4.76 116.67 120.24 1uop s ASP 431 Ca 0.15 0.83 0.14 0.00 -0.52 0.00 0.00 52.55 53.14 1uop s ASP 431 Cb -0.23 -2.54 1.01 0.00 -1.46 0.00 0.00 42.92 39.70 1uop s ASP 431 CO -0.04 -1.38 1.94 0.00 0.52 0.00 0.00 175.17 176.21 1uop h ALA 432 N 10.39 2.04 0.00 3.66 0.00 -1.93 -1.89 119.26 131.52 1uop h ALA 432 Ca -0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1uop h ALA 432 Cb 1.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1uop h ALA 432 CO 1.09 -0.21 0.00 0.77 0.00 0.00 0.00 179.25 180.89 1uop h SER 433 N 0.46 0.00 1.36 0.00 0.02 -1.93 -2.15 113.55 111.30 1uop h SER 433 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1uop h SER 433 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1uop h SER 433 CO -0.11 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.05 1uop n ASP 434 N -3.07 0.79 -4.44 3.07 8.00 -0.71 -4.88 116.55 115.30 1uop n ASP 434 Ca -0.03 0.59 -0.22 0.00 0.71 0.00 0.00 54.79 55.84 1uop n ASP 434 Cb 0.09 -0.79 -0.10 0.00 -0.02 0.00 0.00 41.12 40.29 1uop n ASP 434 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1uop s TYR 435 N -3.13 2.10 0.06 1.24 2.02 -0.81 -1.24 117.35 117.59 1uop s TYR 435 Ca 0.10 -0.44 0.03 0.00 -0.37 0.00 0.00 57.07 56.39 1uop s TYR 435 Cb 0.12 -0.97 -0.03 0.00 -0.40 0.00 0.00 41.96 40.68 1uop s TYR 435 CO 0.57 0.57 -0.09 1.14 -1.57 0.00 0.00 175.55 176.16 1uop s GLN 436 N -3.57 0.66 -0.15 -0.62 -2.07 -0.09 -4.80 119.66 109.02 1uop s GLN 436 Ca 0.28 -0.90 -0.02 0.00 -1.82 0.00 0.00 55.36 52.90 1uop s GLN 436 Cb -0.03 -0.43 -0.02 0.00 -1.09 0.00 0.00 33.01 31.45 1uop s GLN 436 CO 0.12 0.08 -0.09 0.99 -1.32 0.00 0.00 175.29 175.07 1uop s THR 437 N -1.68 3.32 0.15 3.63 2.01 -1.26 -1.88 115.64 119.92 1uop s THR 437 Ca -0.04 -0.56 0.10 0.00 0.31 0.00 0.00 61.69 61.50 1uop s THR 437 Cb -0.08 -2.43 -0.04 0.00 0.01 0.00 0.00 72.50 69.97 1uop s THR 437 CO 0.00 0.50 -0.23 0.68 -0.69 0.00 0.00 174.62 174.89 1uop s VAL 438 N 0.48 2.48 -0.12 3.82 -7.23 0.01 -4.97 120.40 114.87 1uop s VAL 438 Ca -0.07 -1.77 0.02 0.00 -1.81 0.00 0.00 61.98 58.35 1uop s VAL 438 Cb -0.15 -2.14 -0.00 0.00 0.56 0.00 0.00 36.38 34.64 1uop s VAL 438 CO 0.04 0.03 -0.19 -1.58 -0.31 0.00 0.00 175.10 173.08 1uop s GLN 439 N -2.29 3.18 0.31 4.82 0.74 -1.26 -0.52 119.66 124.64 1uop s GLN 439 Ca 0.17 -0.80 0.06 0.00 0.05 0.00 0.00 55.36 54.84 1uop s GLN 439 Cb -0.10 -2.45 -0.06 0.00 1.10 0.00 0.00 33.01 31.50 1uop s GLN 439 CO 0.09 0.16 -0.02 0.96 -0.55 0.00 0.00 175.29 175.93 1uop s ILE 440 N 0.43 1.56 -0.15 -2.34 -5.25 -0.41 -4.98 121.20 110.05 1uop s ILE 440 Ca -0.14 -2.08 -0.00 0.00 -0.99 0.00 0.00 60.65 57.44 1uop s ILE 440 Cb -0.17 -2.60 0.03 0.00 2.95 0.00 0.00 42.46 42.67 1uop s ILE 440 CO 0.06 -0.19 -0.08 -0.36 -1.79 0.00 0.00 174.94 172.59 1uop s PHE 441 N -3.06 1.78 -0.03 1.37 0.40 -1.26 -0.87 117.98 116.32 1uop s PHE 441 Ca 0.32 -1.06 0.02 0.00 -0.60 0.00 0.00 56.93 55.62 1uop s PHE 441 Cb 0.06 -1.37 -0.03 0.00 0.51 0.00 0.00 43.02 42.19 1uop s PHE 441 CO 0.13 -0.61 -0.08 1.52 0.70 0.00 0.00 175.22 176.89 1uop s TYR 442 N 1.61 2.88 0.10 0.36 -0.85 -0.14 -4.80 117.35 116.51 1uop s TYR 442 Ca 0.02 -0.03 -0.30 0.00 -0.52 0.00 0.00 57.07 56.24 1uop s TYR 442 Cb -0.14 -1.65 -0.07 0.00 0.38 0.00 0.00 41.96 40.49 1uop s TYR 442 CO -0.08 0.33 1.21 -1.25 -1.52 0.00 0.00 175.55 174.24 1uop s PRO 443 N -1.11 4.44 0.93 -3.49 0.04 -1.26 -0.03 135.00 134.53 1uop s PRO 443 Ca 0.15 1.82 -0.13 0.00 0.04 0.00 0.00 61.00 62.88 1uop s PRO 443 Cb -0.11 -3.31 0.20 0.00 0.04 0.00 0.00 34.50 31.33 1uop s PRO 443 CO 0.04 -0.22 1.28 0.45 0.04 0.00 0.00 177.00 178.59 1uop s SER 444 N 0.78 3.16 0.28 6.66 0.15 0.87 -4.87 113.70 120.74 1uop s SER 444 Ca 0.57 0.02 0.01 0.00 0.70 0.00 0.00 55.95 57.25 1uop s SER 444 Cb -0.31 -0.05 0.63 0.00 -1.71 0.00 0.00 66.02 64.58 1uop s SER 444 CO 0.31 -2.68 1.71 0.50 1.20 0.00 0.00 173.24 174.28 1uop h LYS 445 N -1.49 0.42 -0.22 5.44 3.64 -1.88 0.91 116.57 123.39 1uop h LYS 445 Ca -0.42 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1uop h LYS 445 Cb 1.23 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1uop h LYS 445 CO 0.34 0.28 0.00 -0.40 -2.27 0.00 0.00 179.45 177.39 1uop n ASP 446 N -5.02 1.62 0.00 4.20 5.68 -1.26 -4.91 116.55 116.86 1uop n ASP 446 Ca 0.19 -1.81 0.00 0.00 -0.50 0.00 0.00 54.79 52.67 1uop n ASP 446 Cb 0.57 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1uop n ASP 446 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uop n GLY 447 N 1.07 1.02 3.71 6.12 0.00 0.31 -5.03 105.19 112.39 1uop n GLY 447 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1uop n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uop s THR 448 N -2.40 2.31 -0.13 2.61 2.01 -1.26 -4.47 115.64 114.31 1uop s THR 448 Ca 0.00 0.17 -0.29 0.00 0.31 0.00 0.00 61.69 61.87 1uop s THR 448 Cb 0.00 -3.11 -0.01 0.00 0.01 0.00 0.00 72.50 69.40 1uop s THR 448 CO 0.00 0.01 1.02 -0.54 -0.69 0.00 0.00 174.62 174.42 1uop s LYS 449 N 1.45 4.38 -0.13 4.92 -0.14 -1.26 -0.09 119.74 128.87 1uop s LYS 449 Ca 0.74 1.40 -0.01 0.00 -1.36 0.00 0.00 55.97 56.74 1uop s LYS 449 Cb -0.47 -3.57 -0.02 0.00 -1.68 0.00 0.00 37.83 32.09 1uop s LYS 449 CO 0.32 -0.40 -0.08 0.42 -0.76 0.00 0.00 175.35 174.86 1uop s ILE 450 N 2.30 3.56 0.43 2.17 -1.09 0.95 -4.86 121.20 124.66 1uop s ILE 450 Ca 0.48 -0.49 -0.24 0.00 -2.23 0.00 0.00 60.65 58.17 1uop s ILE 450 Cb -0.18 -2.51 -0.08 0.00 -1.58 0.00 0.00 42.46 38.11 1uop s ILE 450 CO 0.15 0.53 1.14 -2.84 -1.23 0.00 0.00 174.94 172.69 1uop s PRO 451 N 0.09 3.95 -0.08 2.79 0.02 -1.26 -0.97 135.00 139.54 1uop s PRO 451 Ca -0.03 1.73 -0.05 0.00 0.02 0.00 0.00 61.00 62.67 1uop s PRO 451 Cb -0.14 -2.52 0.04 0.00 0.02 0.00 0.00 34.50 31.90 1uop s PRO 451 CO 0.03 -0.38 0.20 1.41 -0.33 0.00 0.00 177.00 177.93 1uop s MET 452 N -2.53 0.17 0.03 5.54 1.75 -0.05 -0.76 119.30 123.45 1uop s MET 452 Ca 0.60 0.41 -0.19 0.00 -1.25 0.00 0.00 55.69 55.26 1uop s MET 452 Cb -0.27 -0.09 -0.06 0.00 2.84 0.00 0.00 34.83 37.25 1uop s MET 452 CO 0.34 -0.13 0.56 -0.06 -0.65 0.00 0.00 175.02 175.07 1uop s PHE 453 N 0.96 3.74 -0.08 4.11 0.08 -0.30 -1.29 117.98 125.20 1uop s PHE 453 Ca -0.07 1.20 0.02 0.00 0.12 0.00 0.00 56.93 58.20 1uop s PHE 453 Cb -0.09 -2.52 0.01 0.00 -0.57 0.00 0.00 43.02 39.86 1uop s PHE 453 CO -0.06 0.50 -0.15 0.42 -0.10 0.00 0.00 175.22 175.83 1uop s ILE 454 N -0.72 1.36 -0.11 0.64 1.01 0.33 -1.28 121.20 122.43 1uop s ILE 454 Ca 0.29 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1uop s ILE 454 Cb -0.19 -1.23 -0.00 0.00 0.01 0.00 0.00 42.46 41.05 1uop s ILE 454 CO 0.17 0.41 -0.21 -0.69 0.00 0.00 0.00 174.94 174.62 1uop s VAL 455 N 0.74 2.34 0.21 2.92 1.01 0.25 -0.81 120.40 127.06 1uop s VAL 455 Ca -0.12 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 60.74 1uop s VAL 455 Cb -0.16 -1.92 0.04 0.00 0.00 0.00 0.00 36.38 34.34 1uop s VAL 455 CO 0.03 0.55 0.61 -1.38 0.00 0.00 0.00 175.10 174.91 1uop s HIS 456 N 0.37 -0.28 0.31 5.22 -3.43 -0.79 -1.01 115.29 115.68 1uop s HIS 456 Ca -0.16 -0.06 -0.29 0.00 -0.80 0.00 0.00 55.06 53.75 1uop s HIS 456 Cb -0.17 0.55 -0.11 0.00 -1.43 0.00 0.00 32.58 31.42 1uop s HIS 456 CO 0.07 -0.99 1.44 0.21 -2.00 0.00 0.00 174.74 173.47 1uop s LYS 457 N -3.85 4.23 0.42 -0.38 2.20 -1.26 -0.92 119.74 120.19 1uop s LYS 457 Ca 0.07 2.38 -0.26 0.00 -0.36 0.00 0.00 55.97 57.80 1uop s LYS 457 Cb -0.03 -3.05 -0.09 0.00 -1.51 0.00 0.00 37.83 33.15 1uop s LYS 457 CO -0.03 -0.41 1.39 0.15 -0.36 0.00 0.00 175.35 176.09 1uop s LYS 458 N -1.17 3.86 0.00 4.03 1.02 -0.37 -3.46 119.74 123.65 1uop s LYS 458 Ca 0.56 2.36 0.00 0.00 0.02 0.00 0.00 55.97 58.90 1uop s LYS 458 Cb -0.43 -2.75 0.00 0.00 -0.52 0.00 0.00 37.83 34.13 1uop s LYS 458 CO 0.51 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.70 1uop n GLY 459 N 0.60 0.75 3.76 -3.33 0.00 -1.26 -5.02 105.19 100.68 1uop n GLY 459 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1uop n GLY 459 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1uop s ILE 460 N -2.77 2.64 0.01 -0.61 -4.36 -1.22 -4.99 121.20 109.90 1uop s ILE 460 Ca 0.00 0.53 -0.26 0.00 -0.26 0.00 0.00 60.65 60.66 1uop s ILE 460 Cb 0.00 -3.30 -0.04 0.00 1.25 0.00 0.00 42.46 40.37 1uop s ILE 460 CO 0.00 0.05 0.83 -0.54 0.24 0.00 0.00 174.94 175.51 1uop s LYS 461 N -2.46 4.52 -1.37 0.37 1.02 -1.26 -4.97 119.74 115.59 1uop s LYS 461 Ca 0.61 1.16 -0.12 0.00 0.02 0.00 0.00 55.97 57.64 1uop s LYS 461 Cb -0.36 -3.41 0.10 0.00 -0.52 0.00 0.00 37.83 33.64 1uop s LYS 461 CO 0.45 0.13 2.07 1.28 -0.92 0.00 0.00 175.35 178.36 1uop n LEU 462 N 3.35 6.81 -0.79 3.17 4.77 -1.26 -4.59 117.00 128.44 1uop n LEU 462 Ca 0.01 -4.40 0.07 0.00 -0.03 0.00 0.00 56.01 51.65 1uop n LEU 462 Cb 0.51 -1.56 0.20 0.00 -2.33 0.00 0.00 43.42 40.23 1uop n LEU 462 CO 0.49 1.27 0.67 -0.90 -1.33 0.00 0.00 177.39 177.58 1uop n ASP 463 N 4.90 3.28 0.00 -1.43 5.68 -1.00 -4.44 116.55 123.52 1uop n ASP 463 Ca 0.46 -2.19 0.00 0.00 -0.50 0.00 0.00 54.79 52.56 1uop n ASP 463 Cb 0.37 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 1uop n ASP 463 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uop n GLY 464 N 0.47 0.47 0.01 6.12 0.00 0.69 -4.91 105.19 108.04 1uop n GLY 464 Ca 0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.30 1uop n GLY 464 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uop n SER 465 N -0.17 0.40 -4.83 1.61 3.41 -1.26 -3.15 113.62 109.63 1uop n SER 465 Ca 0.00 0.01 -0.38 0.00 -0.26 0.00 0.00 58.87 58.25 1uop n SER 465 Cb 0.09 0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 1uop n SER 465 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1uop s HIS 466 N -3.02 3.74 0.37 7.33 3.76 -1.24 -4.98 115.29 121.24 1uop s HIS 466 Ca 0.11 1.14 -0.27 0.00 -0.15 0.00 0.00 55.06 55.89 1uop s HIS 466 Cb 0.17 -2.40 -0.09 0.00 1.11 0.00 0.00 32.58 31.37 1uop s HIS 466 CO 0.65 0.58 1.27 -2.14 -0.85 0.00 0.00 174.74 174.26 1uop s PRO 467 N -1.26 4.17 0.08 8.40 0.02 -1.26 -4.32 135.00 140.82 1uop s PRO 467 Ca 0.29 2.12 0.06 0.00 0.02 0.00 0.00 61.00 63.48 1uop s PRO 467 Cb -0.18 -2.89 -0.03 0.00 0.02 0.00 0.00 34.50 31.42 1uop s PRO 467 CO 0.17 -0.31 -0.15 0.00 -0.33 0.00 0.00 177.00 176.38 1uop s ALA 468 N -1.23 1.29 -0.25 -1.55 0.00 -0.75 -0.66 121.76 118.62 1uop s ALA 468 Ca 0.53 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 51.43 1uop s ALA 468 Cb -0.37 -0.11 0.07 0.00 0.00 0.00 0.00 23.12 22.70 1uop s ALA 468 CO 0.49 0.18 -0.01 0.12 0.00 0.00 0.00 175.76 176.53 1uop s PHE 469 N -1.36 2.26 -0.22 0.00 2.19 0.75 -0.71 117.98 120.88 1uop s PHE 469 Ca 0.00 -1.75 -0.05 0.00 0.33 0.00 0.00 56.93 55.47 1uop s PHE 469 Cb -0.09 -1.64 -0.01 0.00 -1.31 0.00 0.00 43.02 39.96 1uop s PHE 469 CO 0.03 -0.78 -0.02 -1.17 1.83 0.00 0.00 175.22 175.10 1uop s LEU 470 N 1.44 3.01 -0.02 6.12 2.96 0.12 -0.80 118.68 131.50 1uop s LEU 470 Ca -0.02 -0.35 0.03 0.00 -0.22 0.00 0.00 54.13 53.57 1uop s LEU 470 Cb -0.18 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 1uop s LEU 470 CO -0.09 -0.02 -0.08 -0.47 -1.32 0.00 0.00 176.35 174.38 1uop s TYR 471 N 1.48 2.88 0.16 5.38 5.04 0.42 -1.75 117.35 130.96 1uop s TYR 471 Ca 0.06 -0.03 -0.15 0.00 -2.44 0.00 0.00 57.07 54.51 1uop s TYR 471 Cb -0.14 -1.64 0.02 0.00 0.35 0.00 0.00 41.96 40.55 1uop s TYR 471 CO -0.02 0.34 0.41 0.20 -1.34 0.00 0.00 175.55 175.15 1uop s GLY 472 N -1.16 -0.02 0.00 8.97 0.00 -1.09 -1.63 107.32 112.39 1uop s GLY 472 Ca 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.53 1uop s GLY 472 CO 0.05 -0.44 0.00 2.98 0.00 0.00 0.00 173.10 175.69 1uop n TYR 473 N -0.26 0.00 -1.67 1.90 9.36 -1.26 -4.41 117.16 120.82 1uop n TYR 473 Ca -0.12 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.10 1uop n TYR 473 Cb 0.63 0.07 0.00 0.00 -0.63 0.00 0.00 39.34 39.41 1uop n TYR 473 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1uop n GLY 474 N 2.88 0.01 0.00 2.98 0.00 -1.26 -4.21 105.19 105.58 1uop n GLY 474 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1uop n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uop n GLY 475 N -1.22 0.97 2.44 -0.02 0.00 -1.14 -4.57 105.19 101.64 1uop n GLY 475 Ca -0.00 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.91 1uop n GLY 475 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1uop n PHE 476 N -0.36 -0.67 -1.44 1.61 3.72 -1.10 -1.70 117.46 117.52 1uop n PHE 476 Ca 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 1uop n PHE 476 Cb 0.00 -3.56 -0.07 0.00 -0.94 0.00 0.00 39.48 34.92 1uop n PHE 476 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1uop n ASN 477 N -1.65 -5.33 -4.69 4.37 5.15 -0.94 -4.92 115.26 107.26 1uop n ASN 477 Ca -0.21 0.38 -0.41 0.00 -0.60 0.00 0.00 54.58 53.73 1uop n ASN 477 Cb 0.66 -4.17 -0.04 0.00 -0.53 0.00 0.00 39.78 35.70 1uop n ASN 477 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1uop s ILE 478 N -2.40 4.93 -0.15 -1.44 -1.09 -0.69 -3.10 121.20 117.26 1uop s ILE 478 Ca 0.00 1.63 -0.15 0.00 -2.23 0.00 0.00 60.65 59.90 1uop s ILE 478 Cb 0.00 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.71 1uop s ILE 478 CO 0.00 0.12 0.36 -0.44 -1.23 0.00 0.00 174.94 173.75 1uop s SER 479 N 1.02 6.52 -0.64 3.58 0.01 -1.26 -2.24 113.70 120.68 1uop s SER 479 Ca 0.40 0.61 -0.18 0.00 1.31 0.00 0.00 55.95 58.09 1uop s SER 479 Cb -0.18 -2.22 0.12 0.00 0.21 0.00 0.00 66.02 63.95 1uop s SER 479 CO 0.16 0.05 0.73 -0.63 0.41 0.00 0.00 173.24 173.96 1uop s ILE 480 N 0.62 4.94 0.31 1.44 -1.09 -1.26 -4.97 121.20 121.19 1uop s ILE 480 Ca 0.20 -1.27 0.08 0.00 -2.23 0.00 0.00 60.65 57.43 1uop s ILE 480 Cb -0.14 -4.50 -0.03 0.00 -1.58 0.00 0.00 42.46 36.21 1uop s ILE 480 CO 0.06 -1.12 0.21 0.42 -1.23 0.00 0.00 174.94 173.28 1uop s THR 481 N 2.29 3.62 0.25 2.92 -4.23 -1.26 -4.93 115.64 114.30 1uop s THR 481 Ca 0.13 -1.51 -0.31 0.00 -1.18 0.00 0.00 61.69 58.83 1uop s THR 481 Cb -0.22 -3.15 -0.14 0.00 1.34 0.00 0.00 72.50 70.34 1uop s THR 481 CO 0.03 -0.24 1.32 -2.65 -0.54 0.00 0.00 174.62 172.54 1uop n PRO 482 N -1.23 1.87 -3.82 3.99 -0.02 -1.26 -5.00 135.00 129.53 1uop n PRO 482 Ca -0.04 0.66 -0.11 0.00 -2.02 0.00 0.00 63.50 61.99 1uop n PRO 482 Cb 0.60 -2.26 -0.09 0.00 -0.02 0.00 0.00 33.50 31.73 1uop n PRO 482 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1uop s ASN 483 N 0.06 -0.03 -0.30 2.55 2.47 -1.26 -4.10 114.94 114.33 1uop s ASN 483 Ca 0.66 -0.24 -0.27 0.00 0.42 0.00 0.00 52.86 53.43 1uop s ASN 483 Cb -0.67 0.29 0.01 0.00 -1.45 0.00 0.00 41.25 39.43 1uop s ASN 483 CO 0.53 -0.51 0.95 -0.47 -3.72 0.00 0.00 177.10 173.88 1uop s TYR 484 N -2.13 3.20 -0.29 0.43 5.04 -0.86 -4.01 117.35 118.74 1uop s TYR 484 Ca -0.08 1.07 0.02 0.00 -2.44 0.00 0.00 57.07 55.64 1uop s TYR 484 Cb -0.03 -3.43 0.08 0.00 0.35 0.00 0.00 41.96 38.93 1uop s TYR 484 CO -0.01 -0.64 0.01 0.45 -1.34 0.00 0.00 175.55 174.01 1uop s SER 485 N 1.58 4.24 0.24 4.32 0.15 -1.26 -4.98 113.70 117.99 1uop s SER 485 Ca 0.40 -1.61 -0.06 0.00 0.70 0.00 0.00 55.95 55.37 1uop s SER 485 Cb -0.13 -1.30 0.27 0.00 -1.71 0.00 0.00 66.02 63.15 1uop s SER 485 CO 0.13 -0.32 1.90 0.58 1.20 0.00 0.00 173.24 176.73 1uop h VAL 486 N 6.62 1.19 -0.88 4.45 2.07 -1.95 -1.85 116.25 125.90 1uop h VAL 486 Ca -0.13 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1uop h VAL 486 Cb 1.04 -0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.65 1uop h VAL 486 CO 0.46 0.22 0.49 0.77 0.02 0.00 0.00 177.57 179.53 1uop h SER 487 N 1.20 1.10 0.31 0.57 4.64 -1.96 -0.78 113.55 118.62 1uop h SER 487 Ca 0.36 -0.10 -0.19 0.00 -0.47 0.00 0.00 61.79 61.39 1uop h SER 487 Cb -0.05 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 61.75 1uop h SER 487 CO -0.10 0.88 -0.77 0.03 -0.87 0.00 0.00 176.83 175.99 1uop h ARG 488 N 1.23 0.37 0.00 4.77 -0.00 -1.94 -2.99 114.38 115.83 1uop h ARG 488 Ca 0.31 -0.33 -0.08 0.00 -0.50 0.00 0.00 59.98 59.39 1uop h ARG 488 Cb 0.02 0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.05 1uop h ARG 488 CO -0.05 0.98 -0.36 -0.07 0.00 0.00 0.00 179.97 180.47 1uop h LEU 489 N 0.24 0.00 -0.59 3.04 3.38 -0.79 -2.07 115.31 118.52 1uop h LEU 489 Ca -0.04 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 1uop h LEU 489 Cb 1.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 1uop h LEU 489 CO 0.13 0.36 -0.00 0.40 0.09 0.00 0.00 178.44 179.42 1uop h ILE 490 N 0.00 1.27 -0.58 1.22 2.04 -1.06 0.87 117.51 121.26 1uop h ILE 490 Ca -0.00 -1.15 0.09 0.00 1.00 0.00 0.00 64.86 64.80 1uop h ILE 490 Cb 0.68 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.51 1uop h ILE 490 CO 0.05 0.41 0.19 0.15 0.00 0.00 0.00 178.15 178.96 1uop h PHE 491 N 0.94 0.33 0.50 1.37 3.57 -1.28 0.58 116.94 122.96 1uop h PHE 491 Ca 0.17 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.67 1uop h PHE 491 Cb 0.56 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1uop h PHE 491 CO 0.04 0.07 -0.24 0.28 -2.23 0.00 0.00 178.31 176.23 1uop h VAL 492 N 0.36 0.46 -0.10 1.41 2.07 -1.01 -0.76 116.25 118.68 1uop h VAL 492 Ca 0.29 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.48 1uop h VAL 492 Cb 0.37 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1uop h VAL 492 CO -0.31 0.05 -0.12 -0.09 0.02 0.00 0.00 177.57 177.12 1uop h ARG 493 N -0.85 0.26 -0.01 1.57 9.65 -0.63 -2.43 114.38 121.94 1uop h ARG 493 Ca -0.07 -0.14 0.00 0.00 -1.10 0.00 0.00 59.98 58.67 1uop h ARG 493 Cb 0.59 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.17 1uop h ARG 493 CO 0.11 0.69 -0.41 0.72 2.80 0.00 0.00 179.97 183.88 1uop n HIS 494 N -4.63 0.00 -0.35 2.20 8.25 0.20 -4.23 115.22 116.67 1uop n HIS 494 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1uop n HIS 494 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 1uop n HIS 494 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1uop n MET 495 N -0.20 1.18 -2.08 -0.41 2.81 -0.80 -0.09 117.12 117.53 1uop n MET 495 Ca 0.07 -0.91 -0.14 0.00 -1.81 0.00 0.00 57.70 54.92 1uop n MET 495 Cb 0.37 -0.83 -0.02 0.00 -0.71 0.00 0.00 33.22 32.03 1uop n MET 495 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1uop n GLY 496 N -0.23 0.14 3.92 3.03 0.00 -0.94 -4.80 105.19 106.31 1uop n GLY 496 Ca 0.00 -0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.43 1uop n GLY 496 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uop s GLY 497 N -2.48 1.53 -0.11 -0.02 0.00 -0.36 -4.26 107.32 101.62 1uop s GLY 497 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1uop s GLY 497 CO 0.00 -0.45 -0.12 0.14 0.00 0.00 0.00 173.10 172.67 1uop s VAL 498 N -2.79 3.22 -0.03 1.40 1.01 0.17 -4.31 120.40 119.08 1uop s VAL 498 Ca 0.49 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.83 1uop s VAL 498 Cb -0.10 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 1uop s VAL 498 CO 0.44 0.54 0.13 -0.76 0.00 0.00 0.00 175.10 175.45 1uop s LEU 499 N 0.02 4.18 -0.04 3.92 1.43 -0.18 -0.18 118.68 127.83 1uop s LEU 499 Ca -0.03 0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 53.31 1uop s LEU 499 Cb -0.14 -2.37 0.01 0.00 0.03 0.00 0.00 46.19 43.72 1uop s LEU 499 CO 0.04 0.30 0.13 0.00 0.23 0.00 0.00 176.35 177.05 1uop s ALA 500 N -1.21 -0.32 -0.13 4.21 0.00 0.02 -0.58 121.76 123.74 1uop s ALA 500 Ca 0.23 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.42 1uop s ALA 500 Cb -0.12 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 22.89 1uop s ALA 500 CO 0.14 -0.10 -0.07 0.08 0.00 0.00 0.00 175.76 175.81 1uop s VAL 501 N -0.29 1.06 -0.26 0.00 1.01 -0.40 -0.44 120.40 121.08 1uop s VAL 501 Ca -0.04 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.41 1uop s VAL 501 Cb -0.03 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 1uop s VAL 501 CO 0.00 0.28 0.17 0.00 0.00 0.00 0.00 175.10 175.55 1uop s ALA 502 N 1.68 3.57 -1.43 5.51 0.00 -0.65 -1.15 121.76 129.30 1uop s ALA 502 Ca 0.03 -0.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.94 1uop s ALA 502 Cb -0.14 -2.39 0.05 0.00 0.00 0.00 0.00 23.12 20.64 1uop s ALA 502 CO -0.08 -0.35 2.50 0.09 0.00 0.00 0.00 175.76 177.92 1uop n ASN 503 N 4.63 7.61 -4.72 0.00 4.13 0.06 -4.60 115.26 122.38 1uop n ASN 503 Ca -0.15 -2.93 -0.30 0.00 1.68 0.00 0.00 54.58 52.88 1uop n ASN 503 Cb 0.52 -1.46 0.13 0.00 -1.54 0.00 0.00 39.78 37.43 1uop n ASN 503 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1uop s ILE 504 N 0.43 2.77 0.91 2.41 -4.36 -1.26 -4.46 121.20 117.64 1uop s ILE 504 Ca 0.57 0.25 -0.11 0.00 -0.26 0.00 0.00 60.65 61.10 1uop s ILE 504 Cb 0.17 -2.70 0.14 0.00 1.25 0.00 0.00 42.46 41.32 1uop s ILE 504 CO -0.07 -0.33 1.10 -0.13 0.24 0.00 0.00 174.94 175.75 1uop s ARG 505 N -4.90 1.13 0.00 0.37 0.52 -1.26 -3.19 118.95 111.62 1uop s ARG 505 Ca 0.63 1.15 0.00 0.00 -0.52 0.00 0.00 55.73 56.99 1uop s ARG 505 Cb -0.18 -1.77 0.00 0.00 0.52 0.00 0.00 34.95 33.52 1uop s ARG 505 CO 0.57 -2.43 0.00 0.41 0.02 0.00 0.00 175.30 173.87 1uop n GLY 506 N -0.45 2.85 2.62 -3.53 0.00 0.12 -4.27 105.19 102.53 1uop n GLY 506 Ca 0.09 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 1uop n GLY 506 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uop n GLY 507 N 0.00 -2.50 1.20 -0.02 0.00 -1.19 -2.20 105.19 100.47 1uop n GLY 507 Ca 0.00 -1.51 0.11 0.00 0.00 0.00 0.00 46.02 44.61 1uop n GLY 507 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uop n GLY 508 N -2.64 2.37 0.35 -0.02 0.00 -0.95 -2.06 105.19 102.23 1uop n GLY 508 Ca 0.11 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1uop n GLY 508 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1uop h GLU 509 N 3.95 1.03 -0.94 1.61 3.07 -1.87 -1.49 114.58 119.94 1uop h GLU 509 Ca 0.00 -0.06 -0.57 0.00 -0.50 0.00 0.00 59.36 58.23 1uop h GLU 509 Cb 0.94 -0.23 -0.42 0.00 -0.84 0.00 0.00 28.75 28.20 1uop h GLU 509 CO 0.00 0.68 -0.70 0.66 -1.40 0.00 0.00 179.01 178.25 1uop n TYR 510 N -4.42 2.91 -4.16 4.33 4.01 -1.26 -4.70 117.16 113.87 1uop n TYR 510 Ca 0.09 -2.45 0.00 0.00 -0.16 0.00 0.00 57.90 55.38 1uop n TYR 510 Cb 0.03 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 38.72 1uop n TYR 510 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1uop n GLY 511 N -0.67 -1.43 0.21 2.72 0.00 -0.56 -3.33 105.19 102.13 1uop n GLY 511 Ca 0.44 -1.28 0.06 0.00 0.00 0.00 0.00 46.02 45.24 1uop n GLY 511 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1uop h GLU 512 N 0.00 0.00 -0.21 1.61 4.57 -1.46 -1.40 114.58 117.69 1uop h GLU 512 Ca 0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 1uop h GLU 512 Cb 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1uop h GLU 512 CO 0.00 0.28 -0.27 1.79 -1.18 0.00 0.00 179.01 179.63 1uop h THR 513 N 0.00 1.26 -0.47 0.32 1.35 -1.83 0.12 112.91 113.67 1uop h THR 513 Ca -0.00 -1.26 -0.07 0.00 -0.55 0.00 0.00 66.41 64.52 1uop h THR 513 Cb 0.55 1.40 -0.02 0.00 -1.73 0.00 0.00 68.15 68.35 1uop h THR 513 CO 0.04 0.39 0.00 -0.25 -0.25 0.00 0.00 175.52 175.45 1uop h TRP 514 N 0.36 0.90 0.04 4.73 2.91 -1.28 -1.65 115.95 121.97 1uop h TRP 514 Ca 0.05 -0.16 -0.00 0.00 1.13 0.00 0.00 58.89 59.91 1uop h TRP 514 Cb 0.66 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 29.08 1uop h TRP 514 CO 0.02 0.86 -0.02 1.25 -1.03 0.00 0.00 178.44 179.52 1uop h HIS 515 N 0.68 -0.05 0.00 2.65 2.76 -0.81 0.45 115.15 120.83 1uop h HIS 515 Ca 0.13 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1uop h HIS 515 Cb 0.50 0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.48 1uop h HIS 515 CO 0.04 0.14 -0.03 0.87 -1.30 0.00 0.00 177.93 177.65 1uop h LYS 516 N -0.23 0.00 0.00 5.26 1.57 -0.76 -1.53 116.57 120.88 1uop h LYS 516 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1uop h LYS 516 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1uop h LYS 516 CO 0.01 0.03 0.00 0.41 -0.57 0.00 0.00 179.45 179.33 1uop n GLY 517 N -0.91 -0.99 1.94 3.86 0.00 -0.62 -3.64 105.19 104.82 1uop n GLY 517 Ca -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 1uop n GLY 517 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uop n GLY 518 N 0.25 2.36 3.22 -0.02 0.00 -0.58 -4.56 105.19 105.86 1uop n GLY 518 Ca 0.06 -1.18 -0.13 0.00 0.00 0.00 0.00 46.02 44.78 1uop n GLY 518 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1uop s ILE 519 N -2.27 0.52 0.00 -0.61 -4.36 -1.23 -4.40 121.20 108.85 1uop s ILE 519 Ca 0.34 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.77 1uop s ILE 519 Cb 0.36 -2.11 0.00 0.00 1.25 0.00 0.00 42.46 41.97 1uop s ILE 519 CO -0.09 -0.47 0.00 0.18 0.24 0.00 0.00 174.94 174.80 1uop n LEU 520 N -0.21 0.00 0.33 0.37 4.77 0.11 -0.55 117.00 121.81 1uop n LEU 520 Ca -0.06 0.00 0.21 0.00 -0.03 0.00 0.00 56.01 56.13 1uop n LEU 520 Cb 0.63 0.00 1.14 0.00 -2.33 0.00 0.00 43.42 42.86 1uop n LEU 520 CO 0.33 0.00 1.17 0.00 -1.33 0.00 0.00 177.39 177.56 1uop h ALA 521 N -0.94 1.14 -0.52 -1.18 0.00 -1.90 -2.55 119.26 113.30 1uop h ALA 521 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1uop h ALA 521 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1uop h ALA 521 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 1uop n ASN 522 N -3.29 4.60 -0.00 0.00 3.02 0.28 -4.50 115.26 115.38 1uop n ASN 522 Ca -0.03 -2.61 0.06 0.00 -0.03 0.00 0.00 54.58 51.97 1uop n ASN 522 Cb 0.08 -0.56 0.46 0.00 -0.61 0.00 0.00 39.78 39.15 1uop n ASN 522 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1uop h LYS 523 N 3.39 0.47 -0.38 3.52 1.63 -1.34 -0.83 116.57 123.03 1uop h LYS 523 Ca 0.00 -0.03 0.11 0.00 -0.85 0.00 0.00 60.65 59.88 1uop h LYS 523 Cb 1.48 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 32.99 1uop h LYS 523 CO 0.26 0.31 0.30 0.37 -3.45 0.00 0.00 179.45 177.24 1uop h GLN 524 N 0.48 0.00 -0.94 1.90 5.75 -1.85 -0.47 115.11 119.98 1uop h GLN 524 Ca 0.17 0.00 0.17 0.00 -0.15 0.00 0.00 58.65 58.84 1uop h GLN 524 Cb 0.09 0.00 -0.10 0.00 1.07 0.00 0.00 27.48 28.53 1uop h GLN 524 CO -0.04 0.00 0.54 -0.91 -2.65 0.00 0.00 178.83 175.77 1uop h ASN 525 N 0.00 0.68 -0.34 -0.69 2.35 -1.40 -0.81 115.58 115.35 1uop h ASN 525 Ca 0.18 0.10 0.01 0.00 -0.55 0.00 0.00 56.30 56.03 1uop h ASN 525 Cb 0.79 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 39.11 1uop h ASN 525 CO -0.00 0.25 0.21 0.00 -1.65 0.00 0.00 177.43 176.24 1uop h PHE 527 N 0.43 1.14 -0.40 0.00 0.04 -1.47 -1.16 116.94 115.52 1uop h PHE 527 Ca 0.13 -0.31 -0.02 0.00 2.80 0.00 0.00 57.97 60.57 1uop h PHE 527 Cb -0.02 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 37.86 1uop h PHE 527 CO -0.07 1.14 0.17 -0.44 -0.60 0.00 0.00 178.31 178.52 1uop h ASP 528 N 0.81 0.54 -0.56 2.17 3.32 -1.01 -0.70 116.42 121.00 1uop h ASP 528 Ca 0.09 -0.15 0.03 0.00 0.02 0.00 0.00 57.03 57.01 1uop h ASP 528 Cb 0.89 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.26 1uop h ASP 528 CO 0.08 0.55 0.33 0.44 -1.72 0.00 0.00 179.24 178.91 1uop h ASP 529 N 0.51 0.52 -0.40 6.45 3.32 -0.54 -0.95 116.42 125.34 1uop h ASP 529 Ca 0.14 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 1uop h ASP 529 Cb 0.16 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1uop h ASP 529 CO -0.01 0.37 -0.19 0.15 -1.72 0.00 0.00 179.24 177.84 1uop h PHE 530 N 0.65 0.96 -0.75 4.55 3.57 -1.03 -1.19 116.94 123.70 1uop h PHE 530 Ca 0.23 -0.23 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 1uop h PHE 530 Cb 0.05 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 1uop h PHE 530 CO -0.07 1.00 0.32 1.96 -2.23 0.00 0.00 178.31 179.29 1uop h GLN 531 N 0.64 1.10 -0.15 1.11 4.20 -1.02 -2.11 115.11 118.88 1uop h GLN 531 Ca 0.09 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 1uop h GLN 531 Cb 0.74 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1uop h GLN 531 CO 0.06 0.88 -0.28 0.00 -0.67 0.00 0.00 178.83 178.81 1uop h ALA 533 N 1.46 0.15 -0.43 0.00 0.00 -0.75 0.25 119.26 119.94 1uop h ALA 533 Ca 0.04 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1uop h ALA 533 Cb 0.64 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1uop h ALA 533 CO 0.05 -0.35 0.17 0.00 0.00 0.00 0.00 179.25 179.11 1uop h ALA 534 N 1.02 0.52 -0.64 0.00 0.00 -1.10 -1.53 119.26 117.53 1uop h ALA 534 Ca 0.04 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1uop h ALA 534 Cb 0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1uop h ALA 534 CO -0.01 -0.22 0.33 0.93 0.00 0.00 0.00 179.25 180.29 1uop h GLU 535 N 0.34 0.89 0.15 0.00 5.08 -0.98 -1.53 114.58 118.52 1uop h GLU 535 Ca 0.20 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1uop h GLU 535 Cb 0.17 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1uop h GLU 535 CO -0.19 0.66 -0.07 -0.92 -1.00 0.00 0.00 179.01 177.49 1uop h TYR 536 N 0.89 -0.18 -0.86 4.33 5.03 -0.39 0.20 116.97 125.99 1uop h TYR 536 Ca 0.23 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.59 1uop h TYR 536 Cb 0.05 0.06 -0.06 0.00 1.55 0.00 0.00 36.73 38.33 1uop h TYR 536 CO 0.01 -0.04 0.56 -0.07 -1.32 0.00 0.00 178.16 177.30 1uop h LEU 537 N -0.28 0.85 0.05 2.82 3.38 -0.90 -0.67 115.31 120.57 1uop h LEU 537 Ca -0.02 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1uop h LEU 537 Cb 0.22 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1uop h LEU 537 CO 0.03 0.55 -0.03 0.40 0.09 0.00 0.00 178.44 179.48 1uop h ILE 538 N 0.96 1.27 -0.98 1.22 2.04 -1.11 -0.20 117.51 120.71 1uop h ILE 538 Ca 0.37 -1.19 0.02 0.00 1.00 0.00 0.00 64.86 65.06 1uop h ILE 538 Cb 0.21 2.04 -0.05 0.00 -0.74 0.00 0.00 36.82 38.27 1uop h ILE 538 CO -0.13 0.29 0.65 0.50 0.00 0.00 0.00 178.15 179.46 1uop h LYS 539 N -0.62 1.25 -0.00 2.37 3.64 -0.26 -2.23 116.57 120.72 1uop h LYS 539 Ca -0.01 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1uop h LYS 539 Cb 0.54 -0.28 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1uop h LYS 539 CO 0.01 0.83 -0.11 0.39 -2.27 0.00 0.00 179.45 178.30 1uop n GLU 540 N -4.41 0.72 -0.44 1.90 -0.58 -0.29 -4.93 120.64 112.61 1uop n GLU 540 Ca 0.12 -0.25 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 1uop n GLU 540 Cb 0.05 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.43 1uop n GLU 540 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uop n GLY 541 N 1.27 0.76 0.18 0.62 0.00 -0.84 -4.86 105.19 102.33 1uop n GLY 541 Ca 0.15 -0.17 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 1uop n GLY 541 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1uop h TYR 542 N 0.00 0.23 -2.28 1.61 0.05 -1.27 0.21 116.97 115.52 1uop h TYR 542 Ca 0.00 -0.07 -0.00 0.00 0.05 0.00 0.00 58.73 58.71 1uop h TYR 542 Cb 0.00 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.69 1uop h TYR 542 CO 0.00 0.64 0.11 -2.37 -1.05 0.00 0.00 178.16 175.49 1uop n THR 543 N -3.97 0.00 -4.03 -2.88 5.66 -1.15 -3.71 114.28 104.20 1uop n THR 543 Ca -0.02 -0.32 -0.08 0.00 -3.05 0.00 0.00 64.05 60.59 1uop n THR 543 Cb 0.52 0.33 -0.10 0.00 -1.55 0.00 0.00 70.33 69.54 1uop n THR 543 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1uop s SER 544 N -1.73 0.38 0.21 1.09 0.01 -1.19 -4.33 113.70 108.13 1uop s SER 544 Ca 0.06 -0.82 -0.12 0.00 1.31 0.00 0.00 55.95 56.38 1uop s SER 544 Cb -0.02 0.19 0.26 0.00 0.21 0.00 0.00 66.02 66.67 1uop s SER 544 CO 0.04 -0.53 1.66 -0.65 0.41 0.00 0.00 173.24 174.17 1uop h PRO 545 N 3.51 0.09 0.00 12.44 0.11 -1.89 -0.25 132.00 146.01 1uop h PRO 545 Ca -0.33 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1uop h PRO 545 Cb 1.16 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1uop h PRO 545 CO 0.58 0.06 0.00 1.57 -0.21 0.00 0.00 178.00 180.00 1uop h LYS 546 N 0.09 0.00 -0.25 1.05 2.10 -1.87 -0.23 116.57 117.47 1uop h LYS 546 Ca 0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.95 1uop h LYS 546 Cb 0.48 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 1uop h LYS 546 CO -0.53 0.00 0.00 0.54 -2.00 0.00 0.00 179.45 177.46 1uop n ARG 547 N -2.76 1.98 -3.61 0.07 1.74 -0.16 -4.49 116.66 109.45 1uop n ARG 547 Ca -0.01 -1.86 -0.37 0.00 -0.77 0.00 0.00 57.85 54.85 1uop n ARG 547 Cb 0.16 -1.35 -0.09 0.00 -1.02 0.00 0.00 32.46 30.16 1uop n ARG 547 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1uop s LEU 548 N -1.18 4.15 -0.12 0.55 2.96 -0.81 -1.81 118.68 122.42 1uop s LEU 548 Ca 0.26 0.24 -0.03 0.00 -0.22 0.00 0.00 54.13 54.37 1uop s LEU 548 Cb 0.15 -2.20 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1uop s LEU 548 CO 0.21 0.06 -0.00 -0.89 -1.32 0.00 0.00 176.35 174.41 1uop s THR 549 N 0.95 4.25 0.08 3.68 2.01 0.12 -0.62 115.64 126.11 1uop s THR 549 Ca 0.10 -0.25 0.07 0.00 0.31 0.00 0.00 61.69 61.93 1uop s THR 549 Cb -0.13 -2.83 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 1uop s THR 549 CO 0.04 0.55 -0.15 0.27 -0.69 0.00 0.00 174.62 174.64 1uop s ILE 550 N -0.34 3.02 -0.05 1.82 -4.36 -0.36 -0.70 121.20 120.22 1uop s ILE 550 Ca 0.07 -1.28 -0.06 0.00 -0.26 0.00 0.00 60.65 59.11 1uop s ILE 550 Cb -0.12 -2.35 0.01 0.00 1.25 0.00 0.00 42.46 41.25 1uop s ILE 550 CO 0.02 0.21 0.17 0.21 0.24 0.00 0.00 174.94 175.78 1uop s ASN 551 N -1.86 -0.14 0.05 4.36 3.04 -0.72 -0.96 114.94 118.71 1uop s ASN 551 Ca 0.18 0.24 -0.27 0.00 0.04 0.00 0.00 52.86 53.05 1uop s ASN 551 Cb -0.11 0.32 0.09 0.00 -1.54 0.00 0.00 41.25 40.02 1uop s ASN 551 CO 0.09 -0.12 0.76 -0.83 -3.04 0.00 0.00 177.10 173.96 1uop s GLY 552 N -0.21 -0.53 -0.02 1.21 0.00 -1.16 -2.68 107.32 103.94 1uop s GLY 552 Ca -0.03 0.88 0.06 0.00 0.00 0.00 0.00 44.72 45.63 1uop s GLY 552 CO 0.01 0.34 -0.20 -0.32 0.00 0.00 0.00 173.10 172.93 1uop s GLY 553 N -2.43 0.96 0.00 0.20 0.00 -1.25 -1.36 107.32 103.43 1uop s GLY 553 Ca 0.02 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1uop s GLY 553 CO -0.09 -0.70 0.00 0.00 0.00 0.00 0.00 173.10 172.31 1uop n ALA 554 N 2.60 0.00 0.12 3.20 0.00 0.50 0.25 120.51 127.18 1uop n ALA 554 Ca -0.15 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.43 1uop n ALA 554 Cb 0.53 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.63 1uop n ALA 554 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1uop h ASN 555 N 0.00 0.03 0.82 0.00 -1.24 -1.90 -0.01 115.58 113.28 1uop h ASN 555 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.90 1uop h ASN 555 Cb 0.00 -0.01 -0.02 0.00 0.73 0.00 0.00 38.32 39.03 1uop h ASN 555 CO 0.00 0.02 -0.52 1.23 -1.29 0.00 0.00 177.43 176.87 1uop h GLY 556 N 0.04 0.00 1.09 1.57 0.00 -0.37 -2.00 103.07 103.40 1uop h GLY 556 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 1uop h GLY 556 CO -0.01 0.00 -0.17 -1.33 0.00 0.00 0.00 176.54 175.03 1uop h GLY 557 N 2.16 1.08 0.86 4.60 0.00 -1.00 -2.11 103.07 108.66 1uop h GLY 557 Ca -0.01 -0.93 0.03 0.00 0.00 0.00 0.00 47.33 46.43 1uop h GLY 557 CO 0.07 0.85 0.45 -2.00 0.00 0.00 0.00 176.54 175.90 1uop h LEU 558 N 0.86 0.74 0.17 3.11 5.85 -1.14 -1.86 115.31 123.03 1uop h LEU 558 Ca 0.12 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1uop h LEU 558 Cb 0.75 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1uop h LEU 558 CO 0.06 0.51 -0.24 0.25 -0.34 0.00 0.00 178.44 178.68 1uop h LEU 559 N 0.88 -0.66 -0.60 2.25 5.85 -1.02 -0.94 115.31 121.07 1uop h LEU 559 Ca 0.29 0.07 -0.15 0.00 0.84 0.00 0.00 57.88 58.93 1uop h LEU 559 Cb 0.03 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1uop h LEU 559 CO -0.11 -0.34 -0.65 -0.37 -0.34 0.00 0.00 178.44 176.63 1uop h VAL 560 N -0.47 1.41 -0.33 1.05 -1.51 -1.33 -1.93 116.25 113.14 1uop h VAL 560 Ca 0.01 -2.09 -0.06 0.00 -1.23 0.00 0.00 66.70 63.33 1uop h VAL 560 Cb 0.47 2.08 -0.01 0.00 -2.13 0.00 0.00 31.29 31.70 1uop h VAL 560 CO -0.10 0.62 -0.03 0.00 -1.23 0.00 0.00 177.57 176.83 1uop h ALA 561 N 1.17 0.45 -0.56 5.19 0.00 -1.21 -0.78 119.26 123.53 1uop h ALA 561 Ca -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1uop h ALA 561 Cb 1.17 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1uop h ALA 561 CO 0.10 0.23 0.29 1.15 0.00 0.00 0.00 179.25 181.03 1uop h THR 562 N 0.40 1.19 -0.35 0.00 2.02 -1.14 -2.29 112.91 112.74 1uop h THR 562 Ca 0.09 -0.50 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1uop h THR 562 Cb 0.49 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1uop h THR 562 CO 0.02 0.21 0.06 0.00 0.37 0.00 0.00 175.52 176.18 1uop h ALA 564 N 1.56 0.72 -0.43 0.00 0.00 -0.83 0.88 119.26 121.16 1uop h ALA 564 Ca 0.12 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1uop h ALA 564 Cb 0.24 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1uop h ALA 564 CO 0.00 0.23 0.07 -0.91 0.00 0.00 0.00 179.25 178.64 1uop h ASN 565 N 0.76 0.68 0.39 0.00 2.35 -0.82 -2.70 115.58 116.24 1uop h ASN 565 Ca 0.20 -0.26 -0.32 0.00 -0.55 0.00 0.00 56.30 55.37 1uop h ASN 565 Cb 0.04 -0.18 0.03 0.00 0.05 0.00 0.00 38.32 38.25 1uop h ASN 565 CO -0.03 0.77 -1.41 1.56 -1.65 0.00 0.00 177.43 176.66 1uop h GLN 566 N 0.57 0.45 -2.05 0.81 4.20 -0.87 -3.40 115.11 114.82 1uop h GLN 566 Ca 0.13 -0.77 -0.54 0.00 0.06 0.00 0.00 58.65 57.53 1uop h GLN 566 Cb 0.38 0.29 -0.40 0.00 0.30 0.00 0.00 27.48 28.04 1uop h GLN 566 CO 0.01 1.36 -1.04 0.54 -0.67 0.00 0.00 178.83 179.03 1uop n ARG 567 N -3.65 1.22 0.29 1.46 5.12 0.29 -4.94 116.66 116.45 1uop n ARG 567 Ca -0.14 -3.58 0.14 0.00 -1.93 0.00 0.00 57.85 52.33 1uop n ARG 567 Cb 1.08 -1.59 0.86 0.00 -1.16 0.00 0.00 32.46 31.65 1uop n ARG 567 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1uop h PRO 568 N 3.60 0.00 0.00 5.56 0.13 -1.61 -1.65 132.00 138.03 1uop h PRO 568 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1uop h PRO 568 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1uop h PRO 568 CO 0.55 0.01 0.00 0.38 -0.23 0.00 0.00 178.00 178.71 1uop h ASP 569 N 0.00 0.00 1.24 1.44 2.03 -1.88 -3.23 116.42 116.02 1uop h ASP 569 Ca -0.00 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 56.27 1uop h ASP 569 Cb 0.03 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.52 1uop h ASP 569 CO 0.00 0.00 -0.77 0.25 -1.03 0.00 0.00 179.24 177.69 1uop h LEU 570 N 0.00 0.00 -8.47 0.15 5.85 -1.66 -3.46 115.31 107.72 1uop h LEU 570 Ca 0.00 0.00 -0.54 0.00 0.84 0.00 0.00 57.88 58.18 1uop h LEU 570 Cb 0.41 0.00 -0.26 0.00 0.37 0.00 0.00 40.66 41.18 1uop h LEU 570 CO 0.00 0.12 -0.83 -0.36 -0.34 0.00 0.00 178.44 177.03 1uop s PHE 571 N -3.24 1.64 -0.07 1.25 0.08 -1.22 -4.42 117.98 112.01 1uop s PHE 571 Ca 0.01 -0.36 0.07 0.00 0.12 0.00 0.00 56.93 56.78 1uop s PHE 571 Cb 0.08 -0.98 -0.24 0.00 -0.57 0.00 0.00 43.02 41.31 1uop s PHE 571 CO 0.76 0.06 0.57 0.41 -0.10 0.00 0.00 175.22 176.93 1uop n GLY 572 N 1.95 -0.87 3.16 4.36 0.00 0.21 -4.39 105.19 109.60 1uop n GLY 572 Ca -0.17 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1uop n GLY 572 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uop s VAL 574 N 0.21 0.92 -0.28 0.00 1.01 0.39 -1.22 120.40 121.44 1uop s VAL 574 Ca -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1uop s VAL 574 Cb -0.02 -0.90 0.06 0.00 0.00 0.00 0.00 36.38 35.51 1uop s VAL 574 CO -0.00 0.33 -0.07 -0.63 0.00 0.00 0.00 175.10 174.73 1uop s ILE 575 N 1.16 2.44 -0.29 2.22 1.01 -0.13 -0.78 121.20 126.83 1uop s ILE 575 Ca -0.06 -1.59 -0.08 0.00 0.00 0.00 0.00 60.65 58.93 1uop s ILE 575 Cb -0.14 -2.44 -0.00 0.00 0.01 0.00 0.00 42.46 39.89 1uop s ILE 575 CO -0.02 -0.08 0.10 0.00 0.00 0.00 0.00 174.94 174.94 1uop s ALA 576 N 1.14 3.14 -0.19 9.38 0.00 -0.41 -2.98 121.76 131.85 1uop s ALA 576 Ca -0.07 -1.39 -0.10 0.00 0.00 0.00 0.00 51.96 50.40 1uop s ALA 576 Cb -0.20 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.66 1uop s ALA 576 CO -0.04 -0.86 0.14 -0.65 0.00 0.00 0.00 175.76 174.35 1uop s GLN 577 N 1.55 4.12 -1.63 0.00 -0.21 -0.46 -1.41 119.66 121.62 1uop s GLN 577 Ca 0.04 -0.20 -0.11 0.00 0.02 0.00 0.00 55.36 55.11 1uop s GLN 577 Cb -0.17 -3.40 0.10 0.00 1.00 0.00 0.00 33.01 30.54 1uop s GLN 577 CO 0.04 0.35 0.50 1.33 -2.12 0.00 0.00 175.29 175.38 1uop n VAL 578 N 3.36 -1.37 -3.02 1.09 0.24 0.14 -0.37 118.33 118.41 1uop n VAL 578 Ca -0.16 -0.23 -0.33 0.00 -2.04 0.00 0.00 64.34 61.57 1uop n VAL 578 Cb 0.52 -1.59 -0.06 0.00 -1.47 0.00 0.00 33.84 31.24 1uop n VAL 578 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1uop s GLY 579 N -3.79 2.40 -0.57 7.63 0.00 -1.26 -2.99 107.32 108.74 1uop s GLY 579 Ca 0.42 0.19 -0.25 0.00 0.00 0.00 0.00 44.72 45.07 1uop s GLY 579 CO 0.95 0.45 1.04 0.14 0.00 0.00 0.00 173.10 175.67 1uop s VAL 580 N -1.98 4.24 -0.14 1.40 1.01 -1.10 -4.44 120.40 119.39 1uop s VAL 580 Ca 0.55 0.45 0.09 0.00 0.00 0.00 0.00 61.98 63.07 1uop s VAL 580 Cb -0.11 -4.62 -0.15 0.00 0.00 0.00 0.00 36.38 31.50 1uop s VAL 580 CO 0.17 -1.24 -0.00 0.23 0.00 0.00 0.00 175.10 174.26 1uop n MET 581 N 7.87 1.56 -3.26 2.72 2.81 -1.26 -4.17 117.12 123.38 1uop n MET 581 Ca 0.04 0.02 -0.46 0.00 -1.81 0.00 0.00 57.70 55.48 1uop n MET 581 Cb 0.48 -1.33 -0.02 0.00 -0.71 0.00 0.00 33.22 31.64 1uop n MET 581 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1uop s ASP 582 N -4.81 6.67 0.00 7.83 -1.08 -1.26 -1.42 116.67 122.59 1uop s ASP 582 Ca -0.10 -2.46 0.22 0.00 -0.52 0.00 0.00 52.55 49.68 1uop s ASP 582 Cb 0.04 -2.24 0.98 0.00 -1.46 0.00 0.00 42.92 40.24 1uop s ASP 582 CO 0.49 -0.69 1.69 0.23 0.52 0.00 0.00 175.17 177.41 1uop n MET 583 N 4.56 0.10 0.06 4.34 2.81 -1.26 -1.92 117.12 125.80 1uop n MET 583 Ca 0.12 0.11 0.01 0.00 -1.81 0.00 0.00 57.70 56.13 1uop n MET 583 Cb 0.46 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.41 1uop n MET 583 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1uop h LEU 584 N 0.00 0.00 -0.96 4.03 3.38 -1.92 -3.40 115.31 116.43 1uop h LEU 584 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1uop h LEU 584 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1uop h LEU 584 CO 0.00 0.56 -0.00 0.29 0.09 0.00 0.00 178.44 179.38 1uop n LYS 585 N -2.96 -0.58 -0.20 1.13 5.02 -1.12 -4.57 118.16 114.87 1uop n LYS 585 Ca -0.07 -0.49 0.13 0.00 -2.02 0.00 0.00 58.31 55.86 1uop n LYS 585 Cb 0.81 -0.98 0.44 0.00 -0.02 0.00 0.00 35.03 35.28 1uop n LYS 585 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1uop h PHE 586 N 0.05 0.65 0.00 2.13 -5.15 -1.60 -1.35 116.94 111.67 1uop h PHE 586 Ca 0.00 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 1uop h PHE 586 Cb 0.01 -0.21 0.00 0.00 0.22 0.00 0.00 35.95 35.98 1uop h PHE 586 CO 0.00 0.26 0.00 -2.39 -2.00 0.00 0.00 178.31 174.18 1uop n HIS 587 N -4.51 0.64 0.31 6.09 1.44 -1.26 -3.19 115.22 114.75 1uop n HIS 587 Ca 0.15 0.26 0.13 0.00 -2.01 0.00 0.00 57.72 56.24 1uop n HIS 587 Cb 0.46 -0.92 0.28 0.00 0.12 0.00 0.00 29.99 29.93 1uop n HIS 587 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 1uop h LYS 588 N 0.00 0.00 -6.54 -1.40 1.57 -1.57 -3.16 116.57 105.47 1uop h LYS 588 Ca 0.00 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 1uop h LYS 588 Cb 0.31 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.42 1uop h LYS 588 CO 0.00 0.00 -0.78 0.71 -0.57 0.00 0.00 179.45 178.81 1uop s TYR 589 N -3.24 2.62 0.00 -1.35 2.02 -1.19 -4.13 117.35 112.07 1uop s TYR 589 Ca 0.07 -0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.55 1uop s TYR 589 Cb 0.07 -1.47 0.00 0.00 -0.40 0.00 0.00 41.96 40.16 1uop s TYR 589 CO 0.63 0.30 0.00 0.25 -1.57 0.00 0.00 175.55 175.16 1uop n THR 590 N 1.42 0.00 0.11 -0.71 -2.24 -0.14 -0.28 114.28 112.44 1uop n THR 590 Ca -0.16 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.72 1uop n THR 590 Cb 0.52 0.00 0.20 0.00 -2.10 0.00 0.00 70.33 68.95 1uop n THR 590 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uop n ILE 591 N 0.00 0.63 0.21 2.28 0.13 -1.26 -0.92 119.36 120.43 1uop n ILE 591 Ca 0.00 -0.82 0.18 0.00 -1.10 0.00 0.00 62.75 61.01 1uop n ILE 591 Cb 0.00 0.84 0.85 0.00 -0.84 0.00 0.00 39.64 40.48 1uop n ILE 591 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1uop h GLY 592 N 3.67 0.00 1.87 4.50 0.00 -0.83 -0.22 103.07 112.07 1uop h GLY 592 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.34 1uop h GLY 592 CO 0.00 0.00 0.05 1.12 0.00 0.00 0.00 176.54 177.71 1uop h HIS 593 N 0.00 0.00 0.00 5.60 2.07 -1.73 -1.17 115.15 119.92 1uop h HIS 593 Ca 0.09 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.59 1uop h HIS 593 Cb 0.56 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.54 1uop h HIS 593 CO 0.00 0.00 -0.10 0.00 -3.07 0.00 0.00 177.93 174.76 1uop h ALA 594 N 1.93 1.01 -0.01 6.11 0.00 -1.37 -3.23 119.26 123.70 1uop h ALA 594 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1uop h ALA 594 Cb 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1uop h ALA 594 CO -0.00 0.12 -0.08 0.91 0.00 0.00 0.00 179.25 180.21 1uop n TRP 595 N -3.23 0.00 0.29 0.00 8.01 -0.44 -2.38 117.44 119.68 1uop n TRP 595 Ca 0.00 0.00 0.17 0.00 -1.31 0.00 0.00 57.50 56.36 1uop n TRP 595 Cb 0.37 -0.08 0.81 0.00 -2.01 0.00 0.00 31.31 30.41 1uop n TRP 595 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.69 178.47 1uop h THR 596 N 1.22 0.00 0.00 -0.99 1.35 -1.71 -1.76 112.91 111.02 1uop h THR 596 Ca 0.00 -0.16 -0.05 0.00 -0.55 0.00 0.00 66.41 65.64 1uop h THR 596 Cb 0.37 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 67.77 1uop h THR 596 CO 0.00 0.00 -0.25 0.71 -0.25 0.00 0.00 175.52 175.73 1uop h THR 597 N 0.00 0.78 0.07 6.82 1.35 -1.86 0.19 112.91 120.26 1uop h THR 597 Ca 0.00 -1.05 -0.36 0.00 -0.55 0.00 0.00 66.41 64.45 1uop h THR 597 Cb 0.19 1.64 -0.04 0.00 -1.73 0.00 0.00 68.15 68.21 1uop h THR 597 CO 0.00 0.25 -2.11 0.47 -0.25 0.00 0.00 175.52 173.88 1uop n ASP 598 N -3.65 1.79 -0.08 5.36 9.92 -0.72 -4.71 116.55 124.45 1uop n ASP 598 Ca -0.01 0.13 -0.07 0.00 -0.53 0.00 0.00 54.79 54.32 1uop n ASP 598 Cb 0.38 -0.52 -0.15 0.00 -0.64 0.00 0.00 41.12 40.18 1uop n ASP 598 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1uop n TYR 599 N -3.32 0.00 -0.47 1.24 4.01 -0.83 0.04 117.16 117.83 1uop n TYR 599 Ca -0.34 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 1uop n TYR 599 Cb 1.04 -0.87 0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1uop n TYR 599 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1uop n GLY 600 N 1.75 -2.81 2.89 2.72 0.00 0.68 -4.51 105.19 105.90 1uop n GLY 600 Ca -0.27 -1.72 -0.17 0.00 0.00 0.00 0.00 46.02 43.86 1uop n GLY 600 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uop n SER 602 N 3.73 0.18 0.26 0.00 3.41 -1.26 -1.37 113.62 118.57 1uop n SER 602 Ca -0.22 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.09 1uop n SER 602 Cb 0.53 -0.60 0.73 0.00 -0.26 0.00 0.00 64.21 64.60 1uop n SER 602 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1uop h ASP 603 N 0.00 0.00 -3.31 4.04 3.32 -1.96 -3.41 116.42 115.10 1uop h ASP 603 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1uop h ASP 603 Cb 0.06 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.52 1uop h ASP 603 CO 0.00 0.12 -0.20 -0.55 -1.72 0.00 0.00 179.24 176.89 1uop s SER 604 N -6.14 6.60 0.17 6.45 0.15 -0.47 -5.00 113.70 115.47 1uop s SER 604 Ca -0.03 0.72 -0.14 0.00 0.70 0.00 0.00 55.95 57.20 1uop s SER 604 Cb 0.13 -2.25 0.12 0.00 -1.71 0.00 0.00 66.02 62.30 1uop s SER 604 CO 0.58 0.04 1.76 0.50 1.20 0.00 0.00 173.24 177.32 1uop h LYS 605 N 6.69 0.37 -0.55 5.44 3.64 -1.86 0.61 116.57 130.90 1uop h LYS 605 Ca -0.41 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1uop h LYS 605 Cb 1.17 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.87 1uop h LYS 605 CO 0.75 0.24 0.31 0.37 -2.27 0.00 0.00 179.45 178.86 1uop h GLN 606 N 0.38 0.58 -0.26 1.90 4.15 -1.94 -2.42 115.11 117.51 1uop h GLN 606 Ca 0.20 -0.04 -0.15 0.00 0.77 0.00 0.00 58.65 59.44 1uop h GLN 606 Cb 0.16 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.72 1uop h GLN 606 CO -0.18 0.39 -0.44 0.45 -1.93 0.00 0.00 178.83 177.12 1uop h HIS 607 N 0.60 0.93 -0.84 3.99 3.86 -1.71 -2.85 115.15 119.14 1uop h HIS 607 Ca 0.23 -0.33 0.16 0.00 -1.16 0.00 0.00 60.37 59.28 1uop h HIS 607 Cb 0.09 -0.18 -0.10 0.00 1.06 0.00 0.00 27.41 28.28 1uop h HIS 607 CO -0.08 1.11 0.40 0.35 0.86 0.00 0.00 177.93 180.58 1uop h PHE 608 N 0.49 0.70 0.00 2.45 3.57 -0.73 -0.57 116.94 122.84 1uop h PHE 608 Ca 0.02 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.51 1uop h PHE 608 Cb 1.04 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 1uop h PHE 608 CO 0.08 0.12 -0.22 0.93 -2.23 0.00 0.00 178.31 176.98 1uop h GLU 609 N 0.55 0.00 -0.08 1.11 4.39 -1.20 -0.37 114.58 118.98 1uop h GLU 609 Ca 0.47 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 60.05 1uop h GLU 609 Cb 0.72 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.38 1uop h GLU 609 CO -0.40 0.22 -0.41 -1.49 -1.16 0.00 0.00 179.01 175.77 1uop h TRP 610 N 0.00 0.56 -0.22 4.33 6.55 -1.12 -3.37 115.95 122.69 1uop h TRP 610 Ca -0.00 -0.25 -0.12 0.00 0.95 0.00 0.00 58.89 59.47 1uop h TRP 610 Cb 0.41 -0.09 -0.00 0.00 -0.86 0.00 0.00 29.16 28.63 1uop h TRP 610 CO 0.00 1.01 -0.31 -0.07 -1.05 0.00 0.00 178.44 178.01 1uop h LEU 611 N -0.04 0.65 -2.35 -4.49 3.38 -0.47 -2.92 115.31 109.07 1uop h LEU 611 Ca -0.03 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.43 1uop h LEU 611 Cb 1.06 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 1uop h LEU 611 CO 0.08 1.04 0.01 -0.29 0.09 0.00 0.00 178.44 179.38 1uop h ILE 612 N 0.28 0.63 0.00 1.22 6.09 -1.27 0.17 117.51 124.64 1uop h ILE 612 Ca 0.02 0.00 -0.08 0.00 -1.37 0.00 0.00 64.86 63.43 1uop h ILE 612 Cb 0.90 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 39.16 1uop h ILE 612 CO 0.07 0.00 -0.38 0.11 -3.07 0.00 0.00 178.15 174.88 1uop h LYS 613 N 0.00 0.00 0.00 2.19 1.57 -1.67 -3.37 116.57 115.29 1uop h LYS 613 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1uop h LYS 613 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1uop h LYS 613 CO -0.00 0.38 -0.22 2.48 -0.57 0.00 0.00 179.45 181.52 1uop n TYR 614 N -3.55 0.00 -1.58 -1.35 0.18 -0.85 -4.97 117.16 105.03 1uop n TYR 614 Ca -0.00 0.00 -0.59 0.00 1.88 0.00 0.00 57.90 59.19 1uop n TYR 614 Cb 0.51 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 39.39 1uop n TYR 614 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1uop n SER 615 N -0.78 1.81 -0.28 9.48 2.88 -0.01 -4.75 113.62 121.97 1uop n SER 615 Ca 0.00 0.89 0.04 0.00 -1.33 0.00 0.00 58.87 58.47 1uop n SER 615 Cb 0.00 -1.07 0.19 0.00 -0.75 0.00 0.00 64.21 62.58 1uop n SER 615 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1uop h PRO 616 N 8.20 0.63 0.00 -1.46 0.11 -1.86 -0.96 132.00 136.66 1uop h PRO 616 Ca -0.35 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.71 1uop h PRO 616 Cb 1.35 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1uop h PRO 616 CO 1.00 0.42 -0.05 1.25 -0.21 0.00 0.00 178.00 180.41 1uop h LEU 617 N 0.65 0.00 -2.30 2.35 5.85 -1.56 -2.87 115.31 117.42 1uop h LEU 617 Ca 0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.14 1uop h LEU 617 Cb 0.51 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.54 1uop h LEU 617 CO -0.31 0.05 0.00 1.41 -0.34 0.00 0.00 178.44 179.25 1uop n HIS 618 N -3.92 0.37 -1.71 1.25 8.25 -0.41 -4.47 115.22 114.59 1uop n HIS 618 Ca -0.03 -0.28 0.05 0.00 -0.26 0.00 0.00 57.72 57.20 1uop n HIS 618 Cb 0.14 -0.01 0.10 0.00 1.12 0.00 0.00 29.99 31.34 1uop n HIS 618 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1uop n ASN 619 N 0.90 1.33 -4.66 0.41 3.02 -0.94 -4.97 115.26 110.35 1uop n ASN 619 Ca 0.13 -2.79 -0.43 0.00 -0.03 0.00 0.00 54.58 51.47 1uop n ASN 619 Cb 0.45 -0.37 -0.02 0.00 -0.61 0.00 0.00 39.78 39.23 1uop n ASN 619 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1uop s VAL 620 N -1.66 4.27 -0.20 2.41 1.01 -1.24 -4.83 120.40 120.16 1uop s VAL 620 Ca 0.25 1.54 -0.12 0.00 0.00 0.00 0.00 61.98 63.65 1uop s VAL 620 Cb 0.25 -4.00 0.06 0.00 0.00 0.00 0.00 36.38 32.69 1uop s VAL 620 CO -0.04 -0.13 0.49 -0.75 0.00 0.00 0.00 175.10 174.68 1uop s LYS 621 N 3.41 0.50 0.19 2.72 2.20 -1.26 -5.03 119.74 122.47 1uop s LYS 621 Ca 0.55 0.87 -0.33 0.00 -0.36 0.00 0.00 55.97 56.70 1uop s LYS 621 Cb -0.22 0.07 -0.14 0.00 -1.51 0.00 0.00 37.83 36.04 1uop s LYS 621 CO 0.15 -0.14 1.50 1.28 -0.36 0.00 0.00 175.35 177.79 1uop n LEU 622 N 3.99 3.06 -4.77 5.43 4.77 -1.26 -4.92 117.00 123.30 1uop n LEU 622 Ca -0.21 1.11 -0.41 0.00 -0.03 0.00 0.00 56.01 56.47 1uop n LEU 622 Cb 0.56 -1.42 -0.00 0.00 -2.33 0.00 0.00 43.42 40.23 1uop n LEU 622 CO 0.06 -0.39 1.18 -2.84 -1.33 0.00 0.00 177.39 174.08 1uop s PRO 623 N 0.38 4.10 0.13 3.23 0.02 -1.26 -4.91 135.00 136.69 1uop s PRO 623 Ca 0.75 2.60 -0.16 0.00 0.02 0.00 0.00 61.00 64.21 1uop s PRO 623 Cb -0.68 -2.98 -0.01 0.00 0.02 0.00 0.00 34.50 30.86 1uop s PRO 623 CO 0.43 -0.58 1.68 1.49 -0.33 0.00 0.00 177.00 179.69 1uop h GLU 624 N 3.52 0.57 -6.71 5.54 4.81 -1.91 -3.44 114.58 116.96 1uop h GLU 624 Ca -0.50 -0.10 -0.52 0.00 -0.13 0.00 0.00 59.36 58.11 1uop h GLU 624 Cb 1.23 -0.10 0.03 0.00 0.63 0.00 0.00 28.75 30.54 1uop h GLU 624 CO 0.69 0.54 0.56 0.00 -0.73 0.00 0.00 179.01 180.07 1uop s ALA 625 N -5.58 3.45 0.45 2.92 0.00 -1.26 -4.94 121.76 116.80 1uop s ALA 625 Ca -0.13 1.00 0.13 0.00 0.00 0.00 0.00 51.96 52.96 1uop s ALA 625 Cb 0.10 -3.41 1.05 0.00 0.00 0.00 0.00 23.12 20.85 1uop s ALA 625 CO 0.75 -0.38 2.02 -0.44 0.00 0.00 0.00 175.76 177.71 1uop h ASP 626 N 4.81 0.32 -0.10 0.00 5.19 -2.03 -2.40 116.42 122.20 1uop h ASP 626 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1uop h ASP 626 Cb 1.21 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.66 1uop h ASP 626 CO 0.73 0.20 0.00 -0.90 -3.12 0.00 0.00 179.24 176.15 1uop n ASP 627 N -4.47 1.38 -4.26 6.45 5.75 -1.26 -4.81 116.55 115.33 1uop n ASP 627 Ca 0.07 -1.60 -0.33 0.00 -0.01 0.00 0.00 54.79 52.92 1uop n ASP 627 Cb 0.28 -0.06 -0.16 0.00 -1.03 0.00 0.00 41.12 40.15 1uop n ASP 627 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1uop s ILE 628 N -1.87 2.49 0.50 2.12 1.01 -0.90 -5.12 121.20 119.42 1uop s ILE 628 Ca 0.34 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 60.16 1uop s ILE 628 Cb 0.18 -2.02 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 1uop s ILE 628 CO 0.28 0.53 0.02 0.00 0.00 0.00 0.00 174.94 175.77 1uop s GLN 629 N 0.64 2.16 0.44 2.79 -2.07 -1.26 -4.57 119.66 117.79 1uop s GLN 629 Ca -0.09 -2.37 -0.23 0.00 -1.82 0.00 0.00 55.36 50.85 1uop s GLN 629 Cb -0.16 -1.40 -0.08 0.00 -1.09 0.00 0.00 33.01 30.27 1uop s GLN 629 CO 0.02 -0.38 1.07 0.71 -1.32 0.00 0.00 175.29 175.40 1uop s TYR 630 N -2.92 3.09 0.99 9.60 1.51 -1.26 -4.57 117.35 123.79 1uop s TYR 630 Ca 0.08 1.60 -0.11 0.00 -1.01 0.00 0.00 57.07 57.63 1uop s TYR 630 Cb 0.02 -3.16 0.19 0.00 -0.11 0.00 0.00 41.96 38.89 1uop s TYR 630 CO 0.05 -0.89 1.11 -1.25 -1.11 0.00 0.00 175.55 173.46 1uop s PRO 631 N -2.78 0.40 0.29 -1.71 0.04 -1.26 -4.65 135.00 125.33 1uop s PRO 631 Ca 0.62 1.35 -0.30 0.00 0.04 0.00 0.00 61.00 62.72 1uop s PRO 631 Cb -0.22 -1.67 -0.11 0.00 0.04 0.00 0.00 34.50 32.54 1uop s PRO 631 CO 0.27 -2.99 1.55 -1.12 0.04 0.00 0.00 177.00 174.74 1uop s SER 632 N -2.60 6.44 -0.04 6.66 0.01 -0.68 -4.81 113.70 118.68 1uop s SER 632 Ca 0.67 2.89 0.03 0.00 1.31 0.00 0.00 55.95 60.85 1uop s SER 632 Cb -0.24 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.36 1uop s SER 632 CO 0.60 -0.86 -0.11 -0.04 0.41 0.00 0.00 173.24 173.24 1uop s MET 633 N -0.58 1.24 -0.12 12.44 -1.94 -0.16 -0.46 119.30 129.71 1uop s MET 633 Ca 0.62 -0.38 0.01 0.00 -1.71 0.00 0.00 55.69 54.22 1uop s MET 633 Cb -0.46 -1.11 0.02 0.00 2.01 0.00 0.00 34.83 35.28 1uop s MET 633 CO 0.48 0.12 -0.12 -1.17 -0.01 0.00 0.00 175.02 174.32 1uop s LEU 634 N 0.26 1.54 -0.18 -0.03 2.96 0.04 -0.72 118.68 122.55 1uop s LEU 634 Ca -0.05 -0.40 -0.09 0.00 -0.22 0.00 0.00 54.13 53.37 1uop s LEU 634 Cb -0.11 -1.03 -0.05 0.00 0.50 0.00 0.00 46.19 45.51 1uop s LEU 634 CO 0.01 -0.05 0.10 -0.76 -1.32 0.00 0.00 176.35 174.33 1uop s LEU 635 N 1.39 4.06 -0.15 -0.68 1.43 0.31 -1.28 118.68 123.75 1uop s LEU 635 Ca 0.01 0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 53.29 1uop s LEU 635 Cb -0.13 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.04 1uop s LEU 635 CO -0.07 0.20 -0.13 -0.76 0.23 0.00 0.00 176.35 175.82 1uop s LEU 636 N 0.23 2.65 0.00 1.79 1.43 -0.50 -0.83 118.68 123.45 1uop s LEU 636 Ca 0.07 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1uop s LEU 636 Cb -0.12 -1.61 -0.00 0.00 0.03 0.00 0.00 46.19 44.49 1uop s LEU 636 CO -0.01 0.11 0.25 1.07 0.23 0.00 0.00 176.35 178.01 1uop n THR 637 N 3.87 0.00 -3.75 5.49 5.66 -0.64 0.28 114.28 125.19 1uop n THR 637 Ca -0.18 -1.16 -0.12 0.00 -3.05 0.00 0.00 64.05 59.54 1uop n THR 637 Cb 0.52 0.66 -0.08 0.00 -1.55 0.00 0.00 70.33 69.89 1uop n THR 637 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uop s ALA 638 N -2.43 -0.74 -0.77 1.79 0.00 -1.26 -1.13 121.76 117.22 1uop s ALA 638 Ca 0.19 0.12 0.23 0.00 0.00 0.00 0.00 51.96 52.50 1uop s ALA 638 Cb -0.00 0.25 0.90 0.00 0.00 0.00 0.00 23.12 24.27 1uop s ALA 638 CO 0.13 -0.37 1.70 -0.40 0.00 0.00 0.00 175.76 176.83 1uop n ASP 639 N 0.77 0.41 -1.08 0.00 5.68 -0.51 -2.11 116.55 119.71 1uop n ASP 639 Ca -0.19 0.57 0.04 0.00 -0.50 0.00 0.00 54.79 54.71 1uop n ASP 639 Cb 0.58 -0.67 0.25 0.00 -1.14 0.00 0.00 41.12 40.15 1uop n ASP 639 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1uop n HIS 640 N -1.92 1.16 -2.35 2.11 8.25 -0.22 -4.29 115.22 117.96 1uop n HIS 640 Ca 0.04 -1.08 -0.36 0.00 -0.26 0.00 0.00 57.72 56.07 1uop n HIS 640 Cb 0.28 -0.40 -0.03 0.00 1.12 0.00 0.00 29.99 30.96 1uop n HIS 640 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1uop s ASP 641 N -1.97 5.98 0.00 0.41 -1.08 -0.90 -4.02 116.67 115.09 1uop s ASP 641 Ca 0.44 -1.47 0.21 0.00 -0.52 0.00 0.00 52.55 51.21 1uop s ASP 641 Cb 0.37 -2.57 0.75 0.00 -1.46 0.00 0.00 42.92 40.01 1uop s ASP 641 CO 0.07 -2.01 1.55 -0.90 0.52 0.00 0.00 175.17 174.40 1uop n ASP 642 N 11.00 1.64 -0.05 -0.34 5.75 -1.24 -3.24 116.55 130.07 1uop n ASP 642 Ca 0.40 -1.70 -0.00 0.00 -0.01 0.00 0.00 54.79 53.47 1uop n ASP 642 Cb 0.48 -0.10 -0.00 0.00 -1.03 0.00 0.00 41.12 40.47 1uop n ASP 642 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1uop h ARG 643 N 2.18 0.00 -4.50 0.11 9.65 -1.92 -3.41 114.38 116.49 1uop h ARG 643 Ca 0.00 0.00 -0.69 0.00 -1.10 0.00 0.00 59.98 58.19 1uop h ARG 643 Cb 0.48 0.00 -0.35 0.00 -1.39 0.00 0.00 29.97 28.71 1uop h ARG 643 CO 0.00 0.01 -0.56 0.08 2.80 0.00 0.00 179.97 182.30 1uop s VAL 644 N -1.60 3.21 0.29 0.20 1.01 -1.25 -4.61 120.40 117.64 1uop s VAL 644 Ca -0.01 -2.09 -0.30 0.00 0.00 0.00 0.00 61.98 59.58 1uop s VAL 644 Cb 0.00 -3.21 -0.12 0.00 0.00 0.00 0.00 36.38 33.05 1uop s VAL 644 CO 0.02 -0.69 1.53 1.33 0.00 0.00 0.00 175.10 177.30 1uop n VAL 645 N 4.56 1.09 0.31 2.92 0.24 -1.20 -4.80 118.33 121.45 1uop n VAL 645 Ca -0.02 -0.27 0.21 0.00 -2.04 0.00 0.00 64.34 62.22 1uop n VAL 645 Cb 0.41 -1.83 1.09 0.00 -1.47 0.00 0.00 33.84 32.04 1uop n VAL 645 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1uop h PRO 646 N 4.47 0.00 -1.09 7.34 0.13 -1.82 -2.41 132.00 138.61 1uop h PRO 646 Ca -0.47 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 64.97 1uop h PRO 646 Cb 1.24 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.32 1uop h PRO 646 CO 0.77 0.00 0.77 1.37 -0.23 0.00 0.00 178.00 180.68 1uop h LEU 647 N 0.00 0.07 -0.00 1.56 8.10 -1.88 -0.38 115.31 122.77 1uop h LEU 647 Ca 0.00 0.01 0.03 0.00 0.11 0.00 0.00 57.88 58.03 1uop h LEU 647 Cb 0.03 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 40.20 1uop h LEU 647 CO 0.00 0.01 -0.24 0.45 -4.11 0.00 0.00 178.44 174.55 1uop h HIS 648 N 0.06 -0.64 -0.07 0.17 3.86 -1.74 -0.20 115.15 116.59 1uop h HIS 648 Ca 0.53 0.02 -0.18 0.00 -1.16 0.00 0.00 60.37 59.58 1uop h HIS 648 Cb 2.01 0.29 -0.01 0.00 1.06 0.00 0.00 27.41 30.76 1uop h HIS 648 CO -0.00 -0.33 -0.74 0.77 0.86 0.00 0.00 177.93 178.48 1uop h SER 649 N -0.37 0.45 0.25 2.45 0.02 -1.34 -2.23 113.55 112.78 1uop h SER 649 Ca 0.06 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 1uop h SER 649 Cb 0.46 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1uop h SER 649 CO -0.22 1.04 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.32 1uop h LEU 650 N 0.25 -0.28 -0.69 5.07 3.38 -1.05 0.09 115.31 122.09 1uop h LEU 650 Ca -0.03 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1uop h LEU 650 Cb 1.32 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.11 1uop h LEU 650 CO 0.13 -0.16 0.30 0.11 0.09 0.00 0.00 178.44 178.91 1uop h LYS 651 N -0.39 1.00 -0.54 1.13 1.57 -1.10 -2.09 116.57 116.16 1uop h LYS 651 Ca -0.03 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 1uop h LYS 651 Cb 0.30 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1uop h LYS 651 CO 0.06 0.81 0.29 0.35 -0.57 0.00 0.00 179.45 180.39 1uop h PHE 652 N 0.96 0.75 -0.19 -1.35 3.57 -1.28 -2.11 116.94 117.28 1uop h PHE 652 Ca 0.23 -0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.58 1uop h PHE 652 Cb 0.16 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1uop h PHE 652 CO 0.01 0.55 -0.45 0.97 -2.23 0.00 0.00 178.31 177.16 1uop h ILE 653 N 0.72 1.31 -0.88 1.41 6.09 -0.78 -0.68 117.51 124.70 1uop h ILE 653 Ca 0.19 -1.64 -0.01 0.00 -1.37 0.00 0.00 64.86 62.03 1uop h ILE 653 Cb 0.06 1.65 -0.04 0.00 0.47 0.00 0.00 36.82 38.96 1uop h ILE 653 CO -0.03 0.51 0.52 0.00 -3.07 0.00 0.00 178.15 176.07 1uop h ALA 654 N 1.13 1.25 -0.07 0.18 0.00 -1.22 -0.09 119.26 120.43 1uop h ALA 654 Ca 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1uop h ALA 654 Cb 0.94 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1uop h ALA 654 CO 0.08 0.63 -0.07 1.15 0.00 0.00 0.00 179.25 181.05 1uop h THR 655 N 1.22 1.37 -0.24 0.00 2.02 -1.07 -1.33 112.91 114.87 1uop h THR 655 Ca 0.31 -1.21 0.04 0.00 0.77 0.00 0.00 66.41 66.32 1uop h THR 655 Cb -0.03 2.02 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 1uop h THR 655 CO -0.06 0.34 0.01 -0.07 0.37 0.00 0.00 175.52 176.11 1uop h LEU 656 N -0.26 -0.08 -1.08 2.58 3.38 -1.00 0.57 115.31 119.41 1uop h LEU 656 Ca 0.01 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 1uop h LEU 656 Cb 0.57 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1uop h LEU 656 CO 0.02 -0.01 0.02 1.56 0.09 0.00 0.00 178.44 180.12 1uop h GLN 657 N 0.08 0.67 0.03 1.13 4.20 -0.96 0.15 115.11 120.42 1uop h GLN 657 Ca 0.11 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 1uop h GLN 657 Cb 0.14 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1uop h GLN 657 CO -0.19 0.68 -0.01 -0.92 -0.67 0.00 0.00 178.83 177.71 1uop h TYR 658 N 0.64 -0.04 -0.07 2.96 3.20 -0.97 -2.41 116.97 120.28 1uop h TYR 658 Ca 0.13 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1uop h TYR 658 Cb 0.37 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.65 1uop h TYR 658 CO 0.02 0.65 -0.12 0.82 -1.64 0.00 0.00 178.16 177.89 1uop h ILE 659 N -0.91 1.40 0.00 1.81 1.08 -0.91 -3.31 117.51 116.67 1uop h ILE 659 Ca -0.00 -1.38 -0.42 0.00 -0.39 0.00 0.00 64.86 62.67 1uop h ILE 659 Cb 0.70 2.15 -0.07 0.00 -3.07 0.00 0.00 36.82 36.53 1uop h ILE 659 CO 0.01 0.38 -2.49 0.52 -0.69 0.00 0.00 178.15 175.88 1uop n VAL 660 N -4.64 1.49 0.14 1.67 0.31 -0.15 -4.43 118.33 112.71 1uop n VAL 660 Ca -0.08 -0.49 0.06 0.00 -0.01 0.00 0.00 64.34 63.83 1uop n VAL 660 Cb 0.35 -1.60 0.54 0.00 -0.91 0.00 0.00 33.84 32.23 1uop n VAL 660 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1uop h GLY 661 N 0.77 0.27 2.00 2.92 0.00 -0.74 -1.86 103.07 106.43 1uop h GLY 661 Ca -0.62 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.61 1uop h GLY 661 CO -0.22 0.10 0.00 3.21 0.00 0.00 0.00 176.54 179.62 1uop h ARG 662 N 0.26 0.00 -6.84 4.80 3.08 -1.53 -3.46 114.38 110.69 1uop h ARG 662 Ca 0.07 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.63 1uop h ARG 662 Cb -0.02 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.04 1uop h ARG 662 CO -0.02 0.00 0.43 -1.54 -1.07 0.00 0.00 179.97 177.78 1uop s SER 663 N -4.62 7.21 0.27 7.04 1.04 -0.70 -4.95 113.70 118.98 1uop s SER 663 Ca 0.07 2.14 -0.03 0.00 0.48 0.00 0.00 55.95 58.61 1uop s SER 663 Cb 0.10 -2.61 0.38 0.00 0.10 0.00 0.00 66.02 63.99 1uop s SER 663 CO 0.51 -0.18 1.90 0.03 0.98 0.00 0.00 173.24 176.48 1uop h ARG 664 N 3.51 1.18 0.00 4.02 2.47 -1.89 -2.53 114.38 121.14 1uop h ARG 664 Ca -0.47 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 1uop h ARG 664 Cb 1.21 -0.27 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1uop h ARG 664 CO 0.66 0.78 0.00 0.36 0.56 0.00 0.00 179.97 182.33 1uop n LYS 665 N -4.47 0.17 -2.63 0.04 2.85 -1.26 -4.64 118.16 108.22 1uop n LYS 665 Ca 0.14 0.27 -0.43 0.00 -1.05 0.00 0.00 58.31 57.25 1uop n LYS 665 Cb 0.14 -1.75 -0.02 0.00 -0.65 0.00 0.00 35.03 32.74 1uop n LYS 665 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1uop s GLN 666 N -3.16 3.63 0.00 -1.58 2.00 -0.96 -4.81 119.66 114.79 1uop s GLN 666 Ca 0.08 0.40 0.04 0.00 -2.00 0.00 0.00 55.36 53.88 1uop s GLN 666 Cb 0.12 -3.94 -0.03 0.00 0.80 0.00 0.00 33.01 29.95 1uop s GLN 666 CO 0.47 -1.44 0.22 0.09 -0.50 0.00 0.00 175.29 174.13 1uop n ASN 667 N 7.89 0.33 -4.73 6.67 3.02 -1.26 -4.89 115.26 122.29 1uop n ASN 667 Ca 0.10 -0.67 -0.41 0.00 -0.03 0.00 0.00 54.58 53.57 1uop n ASN 667 Cb 0.49 0.86 -0.04 0.00 -0.61 0.00 0.00 39.78 40.48 1uop n ASN 667 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1uop s ASN 668 N -1.20 7.35 0.54 6.41 0.01 -1.26 -4.73 114.94 122.06 1uop s ASN 668 Ca 0.02 1.63 -0.20 0.00 -0.71 0.00 0.00 52.86 53.60 1uop s ASN 668 Cb 0.03 -2.54 -0.06 0.00 0.41 0.00 0.00 41.25 39.09 1uop s ASN 668 CO 0.13 -0.09 1.11 -2.16 -1.51 0.00 0.00 177.10 174.58 1uop s PRO 669 N 0.28 3.42 -0.27 -0.60 0.04 -1.26 -4.79 135.00 131.83 1uop s PRO 669 Ca 0.45 1.57 -0.00 0.00 0.04 0.00 0.00 61.00 63.06 1uop s PRO 669 Cb -0.22 -2.02 0.08 0.00 0.04 0.00 0.00 34.50 32.39 1uop s PRO 669 CO 0.27 -0.78 0.04 -0.51 0.04 0.00 0.00 177.00 176.05 1uop s LEU 670 N -3.76 2.42 0.10 -3.56 1.43 -1.26 -0.99 118.68 113.06 1uop s LEU 670 Ca 0.72 -1.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.45 1uop s LEU 670 Cb -0.23 -0.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 1uop s LEU 670 CO 0.26 -0.34 -0.13 -0.76 0.23 0.00 0.00 176.35 175.61 1uop s LEU 671 N 1.52 2.37 0.05 1.79 1.43 0.10 -4.86 118.68 121.08 1uop s LEU 671 Ca 0.04 -0.76 0.07 0.00 -1.03 0.00 0.00 54.13 52.45 1uop s LEU 671 Cb -0.18 -0.46 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 1uop s LEU 671 CO -0.15 -0.16 -0.19 -0.51 0.23 0.00 0.00 176.35 175.57 1uop s ILE 672 N -1.99 1.51 -0.11 -0.59 2.07 -1.26 -0.53 121.20 120.30 1uop s ILE 672 Ca 0.05 -1.16 0.03 0.00 -1.41 0.00 0.00 60.65 58.16 1uop s ILE 672 Cb -0.06 -1.33 0.01 0.00 0.13 0.00 0.00 42.46 41.22 1uop s ILE 672 CO 0.02 0.13 -0.19 -2.28 -1.91 0.00 0.00 174.94 170.71 1uop s HIS 673 N -0.83 2.26 -0.32 3.50 5.65 -0.01 -4.39 115.29 121.15 1uop s HIS 673 Ca 0.06 -1.01 -0.03 0.00 0.25 0.00 0.00 55.06 54.33 1uop s HIS 673 Cb -0.09 -1.56 0.05 0.00 -1.18 0.00 0.00 32.58 29.80 1uop s HIS 673 CO 0.02 -0.46 0.04 0.08 -0.65 0.00 0.00 174.74 173.77 1uop s VAL 674 N 0.67 3.23 0.68 0.89 1.01 -1.26 -1.62 120.40 124.00 1uop s VAL 674 Ca -0.12 -1.35 -0.11 0.00 0.00 0.00 0.00 61.98 60.39 1uop s VAL 674 Cb -0.16 -2.87 -0.00 0.00 0.00 0.00 0.00 36.38 33.35 1uop s VAL 674 CO 0.03 -0.16 1.06 -0.62 0.00 0.00 0.00 175.10 175.41 1uop s ASP 675 N 1.33 5.61 0.20 3.32 2.15 -0.28 -4.86 116.67 124.14 1uop s ASP 675 Ca -0.03 1.42 0.07 0.00 0.43 0.00 0.00 52.55 54.44 1uop s ASP 675 Cb -0.20 -2.33 -0.04 0.00 -0.30 0.00 0.00 42.92 40.05 1uop s ASP 675 CO -0.00 -1.27 0.06 0.42 -0.17 0.00 0.00 175.17 174.21 1uop s THR 676 N -3.16 3.98 -1.35 1.71 -4.23 -1.26 -1.42 115.64 109.90 1uop s THR 676 Ca 0.57 -1.41 -0.07 0.00 -1.18 0.00 0.00 61.69 59.61 1uop s THR 676 Cb -0.12 -3.05 0.04 0.00 1.34 0.00 0.00 72.50 70.71 1uop s THR 676 CO 0.54 -0.19 0.47 0.29 -0.54 0.00 0.00 174.62 175.19 1uop n LYS 677 N -0.45 -3.72 -4.05 3.99 5.02 -1.26 -4.93 118.16 112.75 1uop n LYS 677 Ca -0.09 0.63 -0.08 0.00 -2.02 0.00 0.00 58.31 56.75 1uop n LYS 677 Cb 0.56 -5.38 -0.09 0.00 -0.02 0.00 0.00 35.03 30.10 1uop n LYS 677 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1uop s ALA 678 N -2.97 0.41 0.00 7.82 0.00 -0.96 -4.32 121.76 121.74 1uop s ALA 678 Ca 0.32 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1uop s ALA 678 Cb -0.16 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.44 1uop s ALA 678 CO 0.39 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 176.12 1uop n GLY 679 N 0.01 5.21 0.25 0.00 0.00 -1.17 -1.06 105.19 108.43 1uop n GLY 679 Ca -0.12 -0.92 0.03 0.00 0.00 0.00 0.00 46.02 45.01 1uop n GLY 679 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1uop h HIS 680 N 0.00 0.29 0.00 1.61 2.76 -1.78 -3.42 115.15 114.61 1uop h HIS 680 Ca 0.00 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 1uop h HIS 680 Cb 0.00 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 28.87 1uop h HIS 680 CO 0.00 0.36 0.00 0.41 -1.30 0.00 0.00 177.93 177.40 1uop n GLY 681 N -0.98 2.00 3.75 5.26 0.00 -1.26 -4.96 105.19 109.00 1uop n GLY 681 Ca -0.00 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1uop n GLY 681 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uop s ALA 682 N 0.00 3.67 0.00 4.61 0.00 -1.26 -2.04 121.76 126.74 1uop s ALA 682 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.42 1uop s ALA 682 Cb 0.00 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1uop s ALA 682 CO 0.00 -0.87 0.00 0.41 0.00 0.00 0.00 175.76 175.30 1uop n GLY 683 N 1.94 0.79 3.71 0.00 0.00 -1.26 -4.80 105.19 105.57 1uop n GLY 683 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1uop n GLY 683 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1uop s LYS 684 N -0.09 4.13 0.61 1.61 2.20 -0.86 -4.74 119.74 122.60 1uop s LYS 684 Ca 0.00 2.61 -0.18 0.00 -0.36 0.00 0.00 55.97 58.04 1uop s LYS 684 Cb 0.00 -3.32 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 1uop s LYS 684 CO 0.00 -0.80 1.22 -1.25 -0.36 0.00 0.00 175.35 174.16 1uop s PRO 685 N 1.93 2.85 0.28 4.03 0.04 -1.26 -4.77 135.00 138.11 1uop s PRO 685 Ca 0.78 1.87 0.02 0.00 0.04 0.00 0.00 61.00 63.70 1uop s PRO 685 Cb -0.48 -1.91 0.68 0.00 0.04 0.00 0.00 34.50 32.83 1uop s PRO 685 CO 0.34 -1.31 1.68 1.15 0.04 0.00 0.00 177.00 178.89 1uop h THR 686 N 0.75 0.42 -0.86 1.26 2.02 -1.46 -0.71 112.91 114.35 1uop h THR 686 Ca -0.50 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 1uop h THR 686 Cb 1.31 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 1uop h THR 686 CO 0.54 0.06 0.53 0.00 0.37 0.00 0.00 175.52 177.02 1uop h ALA 687 N 1.72 1.09 -0.35 6.16 0.00 -1.87 -0.50 119.26 125.50 1uop h ALA 687 Ca 0.53 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 55.19 1uop h ALA 687 Cb 1.02 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1uop h ALA 687 CO -0.57 0.54 -0.42 0.87 0.00 0.00 0.00 179.25 179.66 1uop h LYS 688 N 1.17 0.89 -0.60 0.00 1.57 -1.53 -2.16 116.57 115.91 1uop h LYS 688 Ca 0.31 -0.49 0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1uop h LYS 688 Cb -0.07 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.21 1uop h LYS 688 CO -0.06 1.13 0.32 0.28 -0.57 0.00 0.00 179.45 180.55 1uop h VAL 689 N 0.71 0.95 -0.32 0.50 2.07 -0.78 -0.03 116.25 119.36 1uop h VAL 689 Ca 0.05 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1uop h VAL 689 Cb 1.01 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1uop h VAL 689 CO 0.10 0.11 0.13 0.40 0.02 0.00 0.00 177.57 178.33 1uop h ILE 690 N 0.59 1.18 -0.74 4.57 2.04 -0.99 -1.68 117.51 122.48 1uop h ILE 690 Ca 0.27 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.64 1uop h ILE 690 Cb 0.17 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 37.14 1uop h ILE 690 CO -0.18 0.19 0.43 -0.33 0.00 0.00 0.00 178.15 178.26 1uop h GLU 691 N 0.37 0.76 -0.19 2.37 4.39 -1.11 -1.50 114.58 119.67 1uop h GLU 691 Ca 0.11 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.73 1uop h GLU 691 Cb 0.18 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1uop h GLU 691 CO -0.01 0.51 0.00 1.49 -1.16 0.00 0.00 179.01 179.84 1uop h GLU 692 N 0.79 0.34 -0.19 2.33 4.81 -0.60 0.19 114.58 122.26 1uop h GLU 692 Ca 0.33 -0.10 -0.11 0.00 -0.13 0.00 0.00 59.36 59.35 1uop h GLU 692 Cb 0.19 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1uop h GLU 692 CO -0.18 0.53 -0.35 -0.39 -0.73 0.00 0.00 179.01 177.89 1uop h VAL 693 N 0.10 1.29 -0.71 0.32 -1.51 -1.25 -0.57 116.25 113.91 1uop h VAL 693 Ca 0.06 -1.44 -0.02 0.00 -1.23 0.00 0.00 66.70 64.07 1uop h VAL 693 Cb 0.38 1.54 -0.03 0.00 -2.13 0.00 0.00 31.29 31.04 1uop h VAL 693 CO 0.01 0.44 0.36 0.28 -1.23 0.00 0.00 177.57 177.43 1uop h SER 694 N 0.33 0.92 -0.15 4.19 0.02 -1.06 -1.02 113.55 116.77 1uop h SER 694 Ca 0.04 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1uop h SER 694 Cb 0.78 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 1uop h SER 694 CO 0.06 0.78 0.09 0.44 -1.14 0.00 0.00 176.83 177.06 1uop h ASP 695 N 0.99 0.19 -0.04 3.07 3.32 -0.59 -1.61 116.42 121.75 1uop h ASP 695 Ca 0.25 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.24 1uop h ASP 695 Cb 0.09 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1uop h ASP 695 CO -0.03 0.21 -0.04 0.24 -1.72 0.00 0.00 179.24 177.89 1uop h MET 696 N 0.15 -0.06 0.00 3.56 2.86 -0.74 -0.67 114.93 120.03 1uop h MET 696 Ca 0.05 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.64 1uop h MET 696 Cb 0.06 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1uop h MET 696 CO -0.01 -0.04 -0.36 0.74 1.06 0.00 0.00 176.91 178.30 1uop h PHE 697 N -0.06 0.00 -0.54 -0.22 0.04 -1.23 -2.16 116.94 112.77 1uop h PHE 697 Ca 0.03 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.71 1uop h PHE 697 Cb 0.10 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 1uop h PHE 697 CO -0.13 0.26 -0.02 0.00 -0.60 0.00 0.00 178.31 177.82 1uop h ALA 698 N 1.74 0.73 0.14 2.45 0.00 -1.17 0.67 119.26 123.82 1uop h ALA 698 Ca -0.01 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.60 1uop h ALA 698 Cb 1.21 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1uop h ALA 698 CO 0.03 0.58 -0.15 0.35 0.00 0.00 0.00 179.25 180.06 1uop h PHE 699 N 0.85 -0.40 -0.42 0.00 3.57 -0.87 -0.44 116.94 119.23 1uop h PHE 699 Ca 0.15 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.70 1uop h PHE 699 Cb 0.57 0.16 -0.05 0.00 2.79 0.00 0.00 35.95 39.42 1uop h PHE 699 CO 0.04 -0.23 0.16 0.82 -2.23 0.00 0.00 178.31 176.87 1uop h ILE 700 N -0.33 0.89 -0.76 1.41 2.04 -1.32 -1.15 117.51 118.29 1uop h ILE 700 Ca 0.01 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 1uop h ILE 700 Cb 0.32 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1uop h ILE 700 CO -0.05 0.06 0.41 0.00 0.00 0.00 0.00 178.15 178.57 1uop h ALA 701 N 1.27 0.97 -0.09 1.87 0.00 -0.66 -0.85 119.26 121.77 1uop h ALA 701 Ca 0.19 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1uop h ALA 701 Cb 0.17 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1uop h ALA 701 CO -0.19 0.49 -0.12 -0.09 0.00 0.00 0.00 179.25 179.34 1uop h ARG 702 N 1.05 0.24 -0.28 0.00 2.43 -0.85 0.25 114.38 117.21 1uop h ARG 702 Ca 0.27 -0.14 -0.11 0.00 -0.81 0.00 0.00 59.98 59.19 1uop h ARG 702 Cb 0.04 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1uop h ARG 702 CO -0.04 0.69 -0.30 0.00 -1.51 0.00 0.00 179.97 178.81 1uop n LEU 704 N -4.08 3.15 -3.65 0.00 4.77 -0.34 -5.00 117.00 111.86 1uop n LEU 704 Ca -0.01 -1.19 -0.27 0.00 -0.03 0.00 0.00 56.01 54.51 1uop n LEU 704 Cb 0.45 -0.10 0.04 0.00 -2.33 0.00 0.00 43.42 41.49 1uop n LEU 704 CO 0.44 0.59 -0.07 -3.20 -1.33 0.00 0.00 177.39 173.82 1uop n ASN 705 N 1.38 -4.39 -4.73 -1.43 5.15 -0.10 -4.98 115.26 106.17 1uop n ASN 705 Ca 0.16 -0.94 -0.37 0.00 -0.60 0.00 0.00 54.58 52.83 1uop n ASN 705 Cb 0.59 -3.71 -0.07 0.00 -0.53 0.00 0.00 39.78 36.06 1uop n ASN 705 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1uop s ILE 706 N -3.53 5.26 0.26 -1.44 1.01 -0.21 -5.03 121.20 117.52 1uop s ILE 706 Ca 0.36 0.68 -0.29 0.00 0.00 0.00 0.00 60.65 61.39 1uop s ILE 706 Cb -0.11 -3.69 -0.09 0.00 0.01 0.00 0.00 42.46 38.58 1uop s ILE 706 CO 0.84 0.38 0.98 -1.81 0.00 0.00 0.00 174.94 175.33 1uop s ASP 707 N 0.44 7.51 0.25 3.58 1.01 -1.26 -4.85 116.67 123.35 1uop s ASP 707 Ca 0.20 2.02 -0.30 0.00 0.71 0.00 0.00 52.55 55.17 1uop s ASP 707 Cb -0.14 -2.61 -0.10 0.00 1.01 0.00 0.00 42.92 41.08 1uop s ASP 707 CO 0.06 0.05 1.43 0.86 0.21 0.00 0.00 175.17 177.78 1uop s TRP 708 N -1.23 3.03 -0.36 4.23 -0.11 -1.26 -4.70 118.94 118.53 1uop s TRP 708 Ca 0.43 1.05 -0.07 0.00 1.22 0.00 0.00 56.10 58.73 1uop s TRP 708 Cb -0.27 -3.81 0.05 0.00 -1.50 0.00 0.00 33.47 27.95 1uop s TRP 708 CO 0.33 -2.61 0.15 0.42 -4.62 0.00 0.00 176.95 170.62 1uop s ILE 709 N -0.04 3.91 -1.97 5.86 1.01 0.88 -5.02 121.20 125.83 1uop s ILE 709 Ca 0.59 -1.24 0.00 0.00 0.00 0.00 0.00 60.65 60.00 1uop s ILE 709 Cb -0.42 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 38.77 1uop s ILE 709 CO 0.43 -0.29 0.49 -2.65 0.00 0.00 0.00 174.94 172.92