#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2y s LEU 2 N 0.00 3.36 -0.26 4.03 1.02 -1.26 -4.84 118.68 120.73 1h2y s LEU 2 Ca 0.00 0.32 0.12 0.00 0.02 0.00 0.00 54.13 54.59 1h2y s LEU 2 Cb 0.00 -2.92 0.57 0.00 0.02 0.00 0.00 46.19 43.86 1h2y s LEU 2 CO 0.00 -1.88 1.54 -1.54 0.02 0.00 0.00 176.35 174.49 1h2y n SER 3 N 10.36 3.60 -4.32 2.29 3.41 -1.26 -4.97 113.62 122.73 1h2y n SER 3 Ca 0.14 -3.34 -0.17 0.00 -0.26 0.00 0.00 58.87 55.25 1h2y n SER 3 Cb 0.50 -0.63 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 1h2y n SER 3 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1h2y s PHE 4 N -3.03 1.53 -0.04 7.33 -0.12 -1.26 -5.15 117.98 117.24 1h2y s PHE 4 Ca 0.46 -0.87 0.07 0.00 -0.05 0.00 0.00 56.93 56.54 1h2y s PHE 4 Cb 0.39 -0.86 -0.01 0.00 -0.63 0.00 0.00 43.02 41.90 1h2y s PHE 4 CO 0.07 0.01 -0.25 -0.65 -0.05 0.00 0.00 175.22 174.35 1h2y s GLN 5 N -3.83 2.32 0.33 1.99 -0.21 -1.26 -5.11 119.66 113.89 1h2y s GLN 5 Ca 0.26 -0.89 -0.29 0.00 0.02 0.00 0.00 55.36 54.46 1h2y s GLN 5 Cb 0.05 -2.06 -0.11 0.00 1.00 0.00 0.00 33.01 31.89 1h2y s GLN 5 CO 0.07 0.44 1.41 0.71 -2.12 0.00 0.00 175.29 175.80 1h2y s TYR 6 N -0.32 2.87 0.71 0.91 2.02 -1.26 -4.97 117.35 117.31 1h2y s TYR 6 Ca 0.02 1.21 -0.14 0.00 -0.37 0.00 0.00 57.07 57.79 1h2y s TYR 6 Cb -0.12 -3.85 0.03 0.00 -0.40 0.00 0.00 41.96 37.62 1h2y s TYR 6 CO 0.02 -2.51 1.16 -1.25 -1.57 0.00 0.00 175.55 171.40 1h2y s PRO 7 N -1.53 2.34 0.12 -1.71 0.04 -1.26 -4.97 135.00 128.03 1h2y s PRO 7 Ca 0.53 1.57 -0.31 0.00 0.04 0.00 0.00 61.00 62.84 1h2y s PRO 7 Cb -0.43 -1.88 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 1h2y s PRO 7 CO 0.54 -1.64 1.28 -0.51 0.04 0.00 0.00 177.00 176.70 1h2y s ASP 8 N -2.35 6.97 -0.11 6.66 1.01 -1.26 -5.01 116.67 122.59 1h2y s ASP 8 Ca 0.70 2.21 -0.01 0.00 0.71 0.00 0.00 52.55 56.16 1h2y s ASP 8 Cb -0.25 -2.59 0.03 0.00 1.01 0.00 0.00 42.92 41.13 1h2y s ASP 8 CO 0.45 -0.52 -0.00 -0.69 0.21 0.00 0.00 175.17 174.62 1h2y s VAL 9 N 0.73 0.53 0.32 -1.27 1.01 -1.26 -5.04 120.40 115.42 1h2y s VAL 9 Ca 0.59 -0.11 -0.29 0.00 0.00 0.00 0.00 61.98 62.17 1h2y s VAL 9 Cb -0.33 -0.74 -0.11 0.00 0.00 0.00 0.00 36.38 35.19 1h2y s VAL 9 CO 0.32 0.17 1.51 -0.47 0.00 0.00 0.00 175.10 176.64 1h2y s TYR 10 N 1.90 2.74 -0.29 5.22 5.04 -1.26 -5.00 117.35 125.71 1h2y s TYR 10 Ca 0.04 1.00 -0.06 0.00 -2.44 0.00 0.00 57.07 55.60 1h2y s TYR 10 Cb -0.13 -3.99 0.01 0.00 0.35 0.00 0.00 41.96 38.19 1h2y s TYR 10 CO -0.06 -3.13 0.07 1.03 -1.34 0.00 0.00 175.55 172.12 1h2y s ARG 11 N -1.18 3.11 -1.01 4.97 0.52 -1.26 -4.75 118.95 119.36 1h2y s ARG 11 Ca 0.58 -0.84 -0.21 0.00 -0.52 0.00 0.00 55.73 54.74 1h2y s ARG 11 Cb -0.46 -3.34 0.09 0.00 0.52 0.00 0.00 34.95 31.76 1h2y s ARG 11 CO 0.53 -0.42 1.34 0.34 0.02 0.00 0.00 175.30 177.11 1h2y s ASP 12 N 1.50 6.60 0.00 0.23 2.15 0.38 -4.82 116.67 122.70 1h2y s ASP 12 Ca 0.03 -1.81 0.14 0.00 0.43 0.00 0.00 52.55 51.34 1h2y s ASP 12 Cb -0.17 -2.50 0.75 0.00 -0.30 0.00 0.00 42.92 40.70 1h2y s ASP 12 CO 0.02 -1.28 1.38 -0.62 -0.17 0.00 0.00 175.17 174.50 1h2y n GLU 13 N 7.80 0.23 0.01 4.34 -0.58 -1.26 -2.17 120.64 129.01 1h2y n GLU 13 Ca 0.31 0.13 0.12 0.00 -0.42 0.00 0.00 57.16 57.30 1h2y n GLU 13 Cb 0.50 -1.50 0.13 0.00 -0.57 0.00 0.00 31.44 30.00 1h2y n GLU 13 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1h2y n THR 14 N -1.26 0.09 -2.21 2.62 -2.24 -1.26 -4.75 114.28 105.27 1h2y n THR 14 Ca 0.07 -0.10 -0.32 0.00 -2.27 0.00 0.00 64.05 61.44 1h2y n THR 14 Cb 0.11 0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 68.59 1h2y n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h2y s ALA 15 N -3.07 2.13 -0.06 6.98 0.00 -0.92 -4.92 121.76 121.89 1h2y s ALA 15 Ca 0.08 -2.09 0.05 0.00 0.00 0.00 0.00 51.96 49.99 1h2y s ALA 15 Cb 0.16 -4.62 -0.00 0.00 0.00 0.00 0.00 23.12 18.66 1h2y s ALA 15 CO 0.75 -4.58 -0.21 0.42 0.00 0.00 0.00 175.76 172.15 1h2y s ILE 16 N 8.83 1.75 0.02 0.00 -1.09 -1.26 -0.58 121.20 128.87 1h2y s ILE 16 Ca 0.64 -0.88 0.05 0.00 -2.23 0.00 0.00 60.65 58.22 1h2y s ILE 16 Cb -0.02 -1.50 -0.02 0.00 -1.58 0.00 0.00 42.46 39.34 1h2y s ILE 16 CO 0.05 0.49 -0.14 -1.58 -1.23 0.00 0.00 174.94 172.53 1h2y s GLN 17 N 0.06 0.99 -0.29 2.79 0.74 -0.17 -4.96 119.66 118.81 1h2y s GLN 17 Ca -0.07 -0.68 -0.13 0.00 0.05 0.00 0.00 55.36 54.53 1h2y s GLN 17 Cb -0.14 -0.98 -0.04 0.00 1.10 0.00 0.00 33.01 32.95 1h2y s GLN 17 CO 0.04 0.25 0.28 0.34 -0.55 0.00 0.00 175.29 175.65 1h2y s ASP 18 N -0.89 6.12 -0.56 6.67 2.15 -1.26 -0.44 116.67 128.46 1h2y s ASP 18 Ca 0.03 0.01 -0.07 0.00 0.43 0.00 0.00 52.55 52.95 1h2y s ASP 18 Cb -0.07 -2.16 0.15 0.00 -0.30 0.00 0.00 42.92 40.53 1h2y s ASP 18 CO 0.01 -0.16 0.42 -0.31 -0.17 0.00 0.00 175.17 174.96 1h2y s TYR 19 N 1.90 3.49 -1.61 -5.34 1.51 0.14 -4.70 117.35 112.73 1h2y s TYR 19 Ca 0.10 -2.22 -0.16 0.00 -1.01 0.00 0.00 57.07 53.78 1h2y s TYR 19 Cb -0.16 -3.42 0.12 0.00 -0.11 0.00 0.00 41.96 38.39 1h2y s TYR 19 CO 0.11 -0.94 0.89 0.72 -1.11 0.00 0.00 175.55 175.22 1h2y n HIS 20 N 4.29 -2.05 0.00 2.71 8.25 -1.26 -0.34 115.22 126.82 1h2y n HIS 20 Ca 0.01 0.86 0.00 0.00 -0.26 0.00 0.00 57.72 58.33 1h2y n HIS 20 Cb 0.41 -3.52 0.00 0.00 1.12 0.00 0.00 29.99 27.99 1h2y n HIS 20 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h2y n GLY 21 N -1.56 1.43 3.57 -1.41 0.00 -1.26 -5.04 105.19 100.91 1h2y n GLY 21 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1h2y n GLY 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1h2y s HIS 22 N -2.34 3.21 -0.05 1.61 5.65 0.54 -5.05 115.29 118.86 1h2y s HIS 22 Ca 0.00 0.19 -0.27 0.00 0.25 0.00 0.00 55.06 55.23 1h2y s HIS 22 Cb 0.00 -2.75 -0.03 0.00 -1.18 0.00 0.00 32.58 28.62 1h2y s HIS 22 CO 0.00 -0.42 0.87 0.15 -0.65 0.00 0.00 174.74 174.69 1h2y s LYS 23 N 2.20 4.48 -0.10 2.88 -0.14 -1.26 0.23 119.74 128.02 1h2y s LYS 23 Ca 0.16 1.19 0.02 0.00 -1.36 0.00 0.00 55.97 55.98 1h2y s LYS 23 Cb -0.16 -3.48 0.01 0.00 -1.68 0.00 0.00 37.83 32.53 1h2y s LYS 23 CO 0.12 -0.06 -0.18 0.08 -0.76 0.00 0.00 175.35 174.55 1h2y s VAL 24 N 1.15 1.65 -0.09 3.17 1.01 0.41 -4.97 120.40 122.74 1h2y s VAL 24 Ca 0.45 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.51 1h2y s VAL 24 Cb -0.19 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.66 1h2y s VAL 24 CO 0.22 0.47 0.42 0.00 0.00 0.00 0.00 175.10 176.21 1h2y n ASP 26 N 3.07 2.26 0.29 0.00 2.03 0.25 -4.97 116.55 119.48 1h2y n ASP 26 Ca -0.10 -3.13 0.18 0.00 0.52 0.00 0.00 54.79 52.26 1h2y n ASP 26 Cb 0.52 -0.66 0.91 0.00 -0.72 0.00 0.00 41.12 41.17 1h2y n ASP 26 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1h2y h PRO 27 N 4.07 0.00 -0.37 -0.67 0.13 -1.77 -1.20 132.00 132.18 1h2y h PRO 27 Ca 0.14 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.17 1h2y h PRO 27 Cb 0.75 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.82 1h2y h PRO 27 CO 0.68 0.00 0.03 0.66 -0.23 0.00 0.00 178.00 179.14 1h2y n TYR 28 N -3.20 1.25 0.08 1.56 4.01 -1.26 -0.47 117.16 119.13 1h2y n TYR 28 Ca -0.01 -1.20 0.14 0.00 -0.16 0.00 0.00 57.90 56.67 1h2y n TYR 28 Cb 0.32 -0.44 0.64 0.00 -0.31 0.00 0.00 39.34 39.54 1h2y n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1h2y h ALA 29 N 1.58 2.22 -0.01 -0.72 0.00 -1.59 -1.16 119.26 119.59 1h2y h ALA 29 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1h2y h ALA 29 Cb 1.68 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 1h2y h ALA 29 CO 0.37 -0.31 0.02 0.11 0.00 0.00 0.00 179.25 179.44 1h2y h TRP 30 N 0.08 0.00 0.00 0.00 5.08 -1.84 -0.81 115.95 118.45 1h2y h TRP 30 Ca 0.16 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.13 1h2y h TRP 30 Cb 0.54 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.70 1h2y h TRP 30 CO -0.00 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 178.44 1h2y n LEU 31 N -3.43 0.00 0.16 0.11 4.77 -0.44 -2.48 117.00 115.69 1h2y n LEU 31 Ca -0.03 0.27 0.13 0.00 -0.03 0.00 0.00 56.01 56.35 1h2y n LEU 31 Cb 0.10 -0.27 0.51 0.00 -2.33 0.00 0.00 43.42 41.42 1h2y n LEU 31 CO 0.23 -0.13 0.89 -0.33 -1.33 0.00 0.00 177.39 176.72 1h2y h GLU 32 N 0.00 0.00 -4.55 3.23 5.08 -1.33 -3.40 114.58 113.61 1h2y h GLU 32 Ca 0.00 0.00 -0.72 0.00 -1.00 0.00 0.00 59.36 57.64 1h2y h GLU 32 Cb 0.14 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.19 1h2y h GLU 32 CO 0.00 0.00 -0.00 0.34 -1.00 0.00 0.00 179.01 178.35 1h2y s ASP 33 N -4.64 6.19 0.57 1.42 -1.08 -1.04 -4.93 116.67 113.17 1h2y s ASP 33 Ca 0.05 -1.45 0.35 0.00 -0.52 0.00 0.00 52.55 50.97 1h2y s ASP 33 Cb 0.09 -2.27 1.69 0.00 -1.46 0.00 0.00 42.92 40.98 1h2y s ASP 33 CO 0.46 -1.00 2.12 1.55 0.52 0.00 0.00 175.17 178.82 1h2y h PRO 34 N 9.07 0.00 -0.00 4.34 0.13 -1.87 -3.14 132.00 140.53 1h2y h PRO 34 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1h2y h PRO 34 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1h2y h PRO 34 CO 1.06 0.04 -0.33 -0.25 -0.23 0.00 0.00 178.00 178.29 1h2y n ASP 35 N -3.26 0.77 -4.81 1.44 8.00 -1.26 -4.54 116.55 112.88 1h2y n ASP 35 Ca -0.01 -0.60 -0.32 0.00 0.71 0.00 0.00 54.79 54.56 1h2y n ASP 35 Cb 0.22 0.15 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 1h2y n ASP 35 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1h2y s SER 36 N -2.69 5.97 0.39 -2.24 1.04 -1.19 -4.92 113.70 110.06 1h2y s SER 36 Ca 0.20 1.75 0.09 0.00 0.48 0.00 0.00 55.95 58.47 1h2y s SER 36 Cb 0.19 -2.53 0.79 0.00 0.10 0.00 0.00 66.02 64.57 1h2y s SER 36 CO 0.58 -1.04 1.92 -0.33 0.98 0.00 0.00 173.24 175.36 1h2y h GLU 37 N 0.50 0.26 -0.33 4.02 4.39 -1.92 -1.71 114.58 119.77 1h2y h GLU 37 Ca -0.47 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.14 1h2y h GLU 37 Cb 1.21 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.81 1h2y h GLU 37 CO 0.58 0.38 0.06 1.96 -1.16 0.00 0.00 179.01 180.83 1h2y h GLN 38 N 0.25 0.55 -0.34 2.33 7.50 -1.94 0.88 115.11 124.32 1h2y h GLN 38 Ca 0.05 -0.14 -0.17 0.00 0.50 0.00 0.00 58.65 58.89 1h2y h GLN 38 Cb 0.35 -0.07 -0.00 0.00 0.05 0.00 0.00 27.48 27.81 1h2y h GLN 38 CO 0.02 0.62 -0.44 1.15 -1.50 0.00 0.00 178.83 178.69 1h2y h THR 39 N 0.38 1.28 -0.57 -0.54 2.02 -1.75 -1.50 112.91 112.24 1h2y h THR 39 Ca 0.10 -1.62 -0.07 0.00 0.77 0.00 0.00 66.41 65.59 1h2y h THR 39 Cb 0.34 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 1h2y h THR 39 CO 0.01 0.53 0.06 0.11 0.37 0.00 0.00 175.52 176.60 1h2y h LYS 40 N 0.71 0.92 -0.44 6.66 1.57 -1.19 -1.09 116.57 123.71 1h2y h LYS 40 Ca 0.05 -0.24 -0.11 0.00 -1.87 0.00 0.00 60.65 58.48 1h2y h LYS 40 Cb 1.03 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.21 1h2y h LYS 40 CO 0.10 0.88 -0.16 0.00 -0.57 0.00 0.00 179.45 179.69 1h2y h ALA 41 N 1.20 0.89 -0.05 3.86 0.00 -0.68 -1.93 119.26 122.54 1h2y h ALA 41 Ca 0.17 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1h2y h ALA 41 Cb 0.42 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1h2y h ALA 41 CO 0.01 0.63 0.03 0.35 0.00 0.00 0.00 179.25 180.28 1h2y h PHE 42 N 0.74 0.07 -0.27 0.00 3.04 -0.78 -1.35 116.94 118.38 1h2y h PHE 42 Ca 0.11 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.06 1h2y h PHE 42 Cb 0.68 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.15 1h2y h PHE 42 CO 0.04 0.10 0.18 0.28 -2.02 0.00 0.00 178.31 176.88 1h2y h VAL 43 N 0.03 1.08 -0.58 1.41 2.07 -1.06 -1.77 116.25 117.43 1h2y h VAL 43 Ca 0.02 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1h2y h VAL 43 Cb 0.05 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1h2y h VAL 43 CO -0.00 0.07 0.34 -0.33 0.02 0.00 0.00 177.57 177.67 1h2y h GLU 44 N 0.37 0.65 -0.45 1.57 4.39 -1.17 -1.06 114.58 118.87 1h2y h GLU 44 Ca 0.10 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.69 1h2y h GLU 44 Cb -0.03 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 1h2y h GLU 44 CO -0.02 0.43 -0.03 0.00 -1.16 0.00 0.00 179.01 178.23 1h2y h ALA 45 N 1.26 1.12 -0.05 3.43 0.00 -0.94 -0.94 119.26 123.14 1h2y h ALA 45 Ca 0.24 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1h2y h ALA 45 Cb 0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1h2y h ALA 45 CO -0.11 0.56 -0.06 1.96 0.00 0.00 0.00 179.25 181.60 1h2y h GLN 46 N 0.69 0.13 -0.31 0.00 1.08 -0.93 -3.03 115.11 112.74 1h2y h GLN 46 Ca 0.13 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1h2y h GLN 46 Cb 0.47 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.88 1h2y h GLN 46 CO 0.02 0.60 0.20 -0.91 -0.95 0.00 0.00 178.83 177.79 1h2y h ASN 47 N -0.34 0.36 -0.51 1.46 2.35 -1.15 -1.12 115.58 116.64 1h2y h ASN 47 Ca 0.01 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.77 1h2y h ASN 47 Cb 0.58 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.83 1h2y h ASN 47 CO 0.01 0.27 0.34 0.50 -1.65 0.00 0.00 177.43 176.90 1h2y h LYS 48 N 0.43 0.57 0.02 0.81 3.64 -1.05 -0.92 116.57 120.07 1h2y h LYS 48 Ca 0.11 -0.03 -0.34 0.00 -1.27 0.00 0.00 60.65 59.12 1h2y h LYS 48 Cb -0.03 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.61 1h2y h LYS 48 CO -0.02 0.38 -2.02 0.44 -2.27 0.00 0.00 179.45 175.96 1h2y n ILE 49 N -4.47 1.57 -0.07 2.00 -5.35 -0.76 -4.39 119.36 107.89 1h2y n ILE 49 Ca 0.06 -0.76 -0.12 0.00 -0.27 0.00 0.00 62.75 61.65 1h2y n ILE 49 Cb 0.13 -1.05 -0.05 0.00 -1.74 0.00 0.00 39.64 36.93 1h2y n ILE 49 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1h2y h THR 50 N 0.01 1.28 -0.01 7.28 2.02 -0.97 -3.09 112.91 119.43 1h2y h THR 50 Ca -0.41 -1.02 0.02 0.00 0.77 0.00 0.00 66.41 65.77 1h2y h THR 50 Cb 2.07 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 69.98 1h2y h THR 50 CO 0.05 0.31 -0.09 0.58 0.37 0.00 0.00 175.52 176.74 1h2y h VAL 51 N 0.13 0.76 -0.24 3.16 2.07 -1.39 -1.69 116.25 119.05 1h2y h VAL 51 Ca 0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.54 1h2y h VAL 51 Cb 0.49 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1h2y h VAL 51 CO 0.02 0.00 -0.01 -0.65 0.02 0.00 0.00 177.57 176.95 1h2y h PRO 52 N -0.15 0.36 -0.37 1.57 0.11 -1.77 -0.72 132.00 131.04 1h2y h PRO 52 Ca 0.04 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 1h2y h PRO 52 Cb 0.20 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 1h2y h PRO 52 CO -0.10 0.40 0.16 0.35 -0.21 0.00 0.00 178.00 178.59 1h2y h PHE 53 N 0.35 0.55 -0.23 0.65 3.57 -1.34 -1.53 116.94 118.96 1h2y h PHE 53 Ca 0.08 -0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 1h2y h PHE 53 Cb 0.25 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1h2y h PHE 53 CO 0.01 0.49 -0.46 -0.07 -2.23 0.00 0.00 178.31 176.05 1h2y h LEU 54 N 0.45 0.64 0.00 0.59 3.38 -0.80 -3.28 115.31 116.29 1h2y h LEU 54 Ca 0.12 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1h2y h LEU 54 Cb 0.16 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1h2y h LEU 54 CO -0.01 1.00 -0.33 -0.62 0.09 0.00 0.00 178.44 178.57 1h2y n GLU 55 N -4.00 0.19 -0.16 1.13 1.02 -0.32 -4.42 120.64 114.08 1h2y n GLU 55 Ca -0.02 0.10 -0.09 0.00 -0.02 0.00 0.00 57.16 57.13 1h2y n GLU 55 Cb 0.55 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 1h2y n GLU 55 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1h2y h GLN 56 N 0.00 0.69 -6.19 3.49 4.20 -1.34 -3.42 115.11 112.54 1h2y h GLN 56 Ca 0.00 -0.13 -0.56 0.00 0.06 0.00 0.00 58.65 58.02 1h2y h GLN 56 Cb 0.67 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.29 1h2y h GLN 56 CO 0.00 0.64 0.51 0.00 -0.67 0.00 0.00 178.83 179.31 1h2y n PRO 58 N 5.00 0.06 0.25 0.00 -0.04 -1.26 -1.76 135.00 137.24 1h2y n PRO 58 Ca 0.08 0.50 0.07 0.00 -0.04 0.00 0.00 63.50 64.11 1h2y n PRO 58 Cb 0.49 -1.83 0.59 0.00 -0.04 0.00 0.00 33.50 32.71 1h2y n PRO 58 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1h2y h ILE 59 N 0.00 1.02 -0.79 0.52 2.10 -1.94 -1.30 117.51 117.12 1h2y h ILE 59 Ca 0.00 -0.30 -0.04 0.00 1.08 0.00 0.00 64.86 65.59 1h2y h ILE 59 Cb 0.27 1.17 -0.04 0.00 -1.09 0.00 0.00 36.82 37.13 1h2y h ILE 59 CO 0.00 0.09 0.33 -0.09 -1.08 0.00 0.00 178.15 177.40 1h2y h ARG 60 N 0.00 1.17 -0.46 2.19 2.43 -1.64 0.77 114.38 118.84 1h2y h ARG 60 Ca -0.00 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 58.87 1h2y h ARG 60 Cb 0.16 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1h2y h ARG 60 CO 0.01 0.94 -0.09 0.78 -1.51 0.00 0.00 179.97 180.10 1h2y h GLY 61 N 1.14 0.95 0.97 2.80 0.00 -1.48 0.15 103.07 107.62 1h2y h GLY 61 Ca 0.27 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.79 1h2y h GLY 61 CO -0.02 0.71 0.21 1.41 0.00 0.00 0.00 176.54 178.84 1h2y h LEU 62 N 0.73 0.69 0.12 3.11 3.38 -0.83 -0.88 115.31 121.62 1h2y h LEU 62 Ca 0.12 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1h2y h LEU 62 Cb 0.63 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1h2y h LEU 62 CO 0.04 0.66 -0.06 0.22 0.09 0.00 0.00 178.44 179.40 1h2y h TYR 63 N 0.67 -0.15 -0.83 1.13 5.03 -0.76 -1.47 116.97 120.60 1h2y h TYR 63 Ca 0.17 -0.00 0.11 0.00 2.58 0.00 0.00 58.73 61.59 1h2y h TYR 63 Cb 0.18 0.05 -0.08 0.00 1.55 0.00 0.00 36.73 38.44 1h2y h TYR 63 CO 0.00 0.08 0.45 -0.22 -1.32 0.00 0.00 178.16 177.15 1h2y h LYS 64 N -0.37 0.70 -0.46 1.82 3.64 -0.84 0.26 116.57 121.33 1h2y h LYS 64 Ca -0.02 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1h2y h LYS 64 Cb 0.30 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1h2y h LYS 64 CO 0.03 0.46 0.05 1.49 -2.27 0.00 0.00 179.45 179.21 1h2y h GLU 65 N 0.72 0.78 -0.27 1.90 4.81 -1.00 -0.70 114.58 120.82 1h2y h GLU 65 Ca 0.42 -0.22 -0.13 0.00 -0.13 0.00 0.00 59.36 59.29 1h2y h GLU 65 Cb 0.46 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1h2y h GLU 65 CO -0.29 0.81 -0.36 -0.09 -0.73 0.00 0.00 179.01 178.35 1h2y h ARG 66 N 0.64 0.61 -0.30 1.92 9.65 -0.51 -2.12 114.38 124.27 1h2y h ARG 66 Ca 0.14 -0.30 -0.05 0.00 -1.10 0.00 0.00 59.98 58.67 1h2y h ARG 66 Cb 0.43 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.99 1h2y h ARG 66 CO 0.01 0.88 0.01 1.98 2.80 0.00 0.00 179.97 185.66 1h2y h MET 67 N 0.51 0.52 -0.79 0.20 4.05 -0.31 -0.14 114.93 118.97 1h2y h MET 67 Ca 0.05 -0.16 -0.02 0.00 -0.28 0.00 0.00 59.70 59.29 1h2y h MET 67 Cb 0.87 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.58 1h2y h MET 67 CO 0.07 0.66 0.42 1.15 0.23 0.00 0.00 176.91 179.44 1h2y h THR 68 N 0.32 1.24 0.03 -0.77 2.02 -1.04 0.96 112.91 115.66 1h2y h THR 68 Ca 0.09 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 1h2y h THR 68 Cb 0.42 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1h2y h THR 68 CO 0.01 0.27 -0.01 -0.33 0.37 0.00 0.00 175.52 175.83 1h2y h GLU 69 N 1.11 -0.03 -0.04 6.66 5.08 -1.18 -3.10 114.58 123.08 1h2y h GLU 69 Ca 0.28 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.46 1h2y h GLU 69 Cb 0.05 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1h2y h GLU 69 CO -0.04 0.40 -0.76 -0.07 -1.00 0.00 0.00 179.01 177.54 1h2y h LEU 70 N -0.48 0.32 0.00 1.33 3.38 -0.90 -2.98 115.31 115.99 1h2y h LEU 70 Ca -0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1h2y h LEU 70 Cb 0.45 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1h2y h LEU 70 CO 0.01 0.97 0.00 0.00 0.09 0.00 0.00 178.44 179.50 1h2y n TYR 71 N -3.77 0.00 -2.73 1.13 9.36 0.32 -4.42 117.16 117.05 1h2y n TYR 71 Ca -0.03 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.75 1h2y n TYR 71 Cb 0.72 -0.44 -0.00 0.00 -0.63 0.00 0.00 39.34 38.99 1h2y n TYR 71 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1h2y s ASP 72 N -2.88 6.91 0.01 2.98 2.15 -1.13 -4.71 116.67 120.01 1h2y s ASP 72 Ca 0.15 -2.62 -0.06 0.00 0.43 0.00 0.00 52.55 50.45 1h2y s ASP 72 Cb 0.17 -2.50 -0.00 0.00 -0.30 0.00 0.00 42.92 40.28 1h2y s ASP 72 CO 0.44 -1.01 0.11 -0.72 -0.17 0.00 0.00 175.17 173.82 1h2y s TYR 73 N 3.18 0.09 0.21 -5.34 -0.85 -1.26 -4.96 117.35 108.41 1h2y s TYR 73 Ca 0.49 -0.25 -0.32 0.00 -0.52 0.00 0.00 57.07 56.47 1h2y s TYR 73 Cb 0.01 -0.08 -0.11 0.00 0.38 0.00 0.00 41.96 42.16 1h2y s TYR 73 CO 0.04 -0.30 1.65 -1.25 -1.52 0.00 0.00 175.55 174.17 1h2y s PRO 74 N -1.65 4.16 -0.23 -3.49 0.04 -1.24 -3.84 135.00 128.74 1h2y s PRO 74 Ca -0.13 2.52 0.02 0.00 0.04 0.00 0.00 61.00 63.45 1h2y s PRO 74 Cb -0.07 -3.09 0.05 0.00 0.04 0.00 0.00 34.50 31.43 1h2y s PRO 74 CO 0.00 -0.68 -0.14 0.15 0.04 0.00 0.00 177.00 176.37 1h2y s LYS 75 N 0.90 2.49 0.13 4.56 1.02 -0.20 -4.94 119.74 123.71 1h2y s LYS 75 Ca 0.71 -1.15 0.08 0.00 0.02 0.00 0.00 55.97 55.63 1h2y s LYS 75 Cb -0.47 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 1h2y s LYS 75 CO 0.34 -0.44 -0.12 0.71 -0.92 0.00 0.00 175.35 174.92 1h2y s TYR 76 N 1.17 2.65 0.41 3.18 1.51 -1.26 -0.90 117.35 124.11 1h2y s TYR 76 Ca -0.04 -0.21 0.08 0.00 -1.01 0.00 0.00 57.07 55.89 1h2y s TYR 76 Cb -0.17 -1.36 -0.01 0.00 -0.11 0.00 0.00 41.96 40.31 1h2y s TYR 76 CO -0.08 0.45 0.43 -1.54 -1.11 0.00 0.00 175.55 173.70 1h2y s SER 77 N -2.41 5.29 0.53 2.29 1.04 -0.41 -4.99 113.70 115.04 1h2y s SER 77 Ca 0.22 -0.61 -0.21 0.00 0.48 0.00 0.00 55.95 55.83 1h2y s SER 77 Cb -0.10 -0.65 -0.05 0.00 0.10 0.00 0.00 66.02 65.32 1h2y s SER 77 CO 0.13 -0.66 1.23 0.00 0.98 0.00 0.00 173.24 174.92 1h2y s HIS 79 N -1.52 2.72 -0.16 0.00 3.76 -1.26 -4.58 115.29 114.26 1h2y s HIS 79 Ca 0.71 1.54 -0.14 0.00 -0.15 0.00 0.00 55.06 57.02 1h2y s HIS 79 Cb -0.32 -3.11 0.04 0.00 1.11 0.00 0.00 32.58 30.30 1h2y s HIS 79 CO 0.37 -1.54 0.41 -0.59 -0.85 0.00 0.00 174.74 172.54 1h2y s PHE 80 N -2.42 -0.46 -0.08 1.40 -0.71 0.26 -4.70 117.98 111.26 1h2y s PHE 80 Ca 0.66 1.12 -0.11 0.00 -1.04 0.00 0.00 56.93 57.56 1h2y s PHE 80 Cb -0.19 0.16 -0.05 0.00 -1.21 0.00 0.00 43.02 41.74 1h2y s PHE 80 CO 0.42 -0.23 0.26 0.21 -1.34 0.00 0.00 175.22 174.54 1h2y s LYS 81 N 0.31 3.73 -0.11 1.99 2.20 -1.26 -0.21 119.74 126.38 1h2y s LYS 81 Ca -0.01 0.10 -0.03 0.00 -0.36 0.00 0.00 55.97 55.67 1h2y s LYS 81 Cb -0.03 -3.23 0.04 0.00 -1.51 0.00 0.00 37.83 33.10 1h2y s LYS 81 CO -0.00 0.68 0.06 0.15 -0.36 0.00 0.00 175.35 175.87 1h2y s LYS 82 N -0.85 0.14 6.48 4.03 -0.14 -0.50 -5.00 119.74 123.89 1h2y s LYS 82 Ca 0.18 0.09 0.00 0.00 -1.36 0.00 0.00 55.97 54.89 1h2y s LYS 82 Cb -0.14 -1.22 0.00 0.00 -1.68 0.00 0.00 37.83 34.79 1h2y s LYS 82 CO 0.07 -0.48 0.00 0.41 -0.76 0.00 0.00 175.35 174.59 1h2y n GLY 83 N 5.25 2.30 0.88 -3.33 0.00 -1.25 -2.23 105.19 106.81 1h2y n GLY 83 Ca -0.06 -0.41 0.08 0.00 0.00 0.00 0.00 46.02 45.63 1h2y n GLY 83 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1h2y n LYS 84 N 13.30 2.11 -4.41 1.61 5.02 -1.26 -4.94 118.16 129.59 1h2y n LYS 84 Ca 0.00 -1.72 -0.21 0.00 -2.02 0.00 0.00 58.31 54.36 1h2y n LYS 84 Cb 0.00 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 33.52 1h2y n LYS 84 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1h2y s ARG 85 N -1.39 1.50 0.05 1.97 0.52 -0.95 -4.67 118.95 115.98 1h2y s ARG 85 Ca 0.33 -1.71 0.04 0.00 -0.52 0.00 0.00 55.73 53.87 1h2y s ARG 85 Cb 0.17 -1.26 -0.04 0.00 0.52 0.00 0.00 34.95 34.34 1h2y s ARG 85 CO 0.23 0.15 -0.06 0.71 0.02 0.00 0.00 175.30 176.34 1h2y s TYR 86 N -2.90 2.88 0.13 -0.53 2.02 0.40 -1.42 117.35 117.93 1h2y s TYR 86 Ca 0.27 -0.06 0.04 0.00 -0.37 0.00 0.00 57.07 56.95 1h2y s TYR 86 Cb 0.01 -1.55 -0.04 0.00 -0.40 0.00 0.00 41.96 39.97 1h2y s TYR 86 CO 0.11 0.41 -0.10 -0.06 -1.57 0.00 0.00 175.55 174.33 1h2y s PHE 87 N -1.12 1.20 -0.19 2.71 0.40 0.71 -0.87 117.98 120.82 1h2y s PHE 87 Ca 0.20 -0.72 -0.29 0.00 -0.60 0.00 0.00 56.93 55.53 1h2y s PHE 87 Cb -0.11 -0.63 0.13 0.00 0.51 0.00 0.00 43.02 42.92 1h2y s PHE 87 CO 0.11 0.06 1.01 1.52 0.70 0.00 0.00 175.22 178.62 1h2y s TYR 88 N -2.97 -0.39 0.15 0.36 -0.85 -0.97 -0.58 117.35 112.12 1h2y s TYR 88 Ca 0.12 0.74 -0.09 0.00 -0.52 0.00 0.00 57.07 57.33 1h2y s TYR 88 Cb 0.00 0.43 -0.06 0.00 0.38 0.00 0.00 41.96 42.71 1h2y s TYR 88 CO 0.00 -0.31 0.45 -0.06 -1.52 0.00 0.00 175.55 174.12 1h2y s PHE 89 N -0.79 3.50 -0.23 -3.49 0.08 -1.26 -0.64 117.98 115.15 1h2y s PHE 89 Ca -0.00 0.77 -0.19 0.00 0.12 0.00 0.00 56.93 57.62 1h2y s PHE 89 Cb -0.02 -2.16 0.06 0.00 -0.57 0.00 0.00 43.02 40.33 1h2y s PHE 89 CO -0.00 0.41 0.59 -0.47 -0.10 0.00 0.00 175.22 175.65 1h2y s TYR 90 N -1.61 -0.70 -0.14 0.36 5.04 0.25 -1.29 117.35 119.26 1h2y s TYR 90 Ca 0.40 1.64 0.00 0.00 -2.44 0.00 0.00 57.07 56.67 1h2y s TYR 90 Cb -0.13 0.27 0.02 0.00 0.35 0.00 0.00 41.96 42.48 1h2y s TYR 90 CO 0.21 -0.34 -0.12 1.21 -1.34 0.00 0.00 175.55 175.17 1h2y s ASN 91 N 0.54 2.54 0.64 4.32 3.84 -0.08 -0.65 114.94 126.09 1h2y s ASN 91 Ca -0.02 -0.44 0.35 0.00 0.21 0.00 0.00 52.86 52.96 1h2y s ASN 91 Cb -0.05 -1.06 1.95 0.00 -0.55 0.00 0.00 41.25 41.54 1h2y s ASN 91 CO -0.02 -0.08 2.16 0.71 -2.79 0.00 0.00 177.10 177.08 1h2y h THR 92 N 6.11 0.18 0.00 -5.21 1.35 -1.88 -0.51 112.91 112.95 1h2y h THR 92 Ca -0.35 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1h2y h THR 92 Cb 1.13 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1h2y h THR 92 CO 0.49 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.37 1h2y n GLY 93 N -1.24 0.42 0.44 5.82 0.00 -1.25 -3.59 105.19 105.79 1h2y n GLY 93 Ca -0.01 0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.21 1h2y n GLY 93 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1h2y n LEU 94 N 0.00 2.90 -4.76 0.99 4.77 -1.26 -4.44 117.00 115.19 1h2y n LEU 94 Ca 0.00 -2.62 -0.39 0.00 -0.03 0.00 0.00 56.01 52.97 1h2y n LEU 94 Cb 0.00 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1h2y n LEU 94 CO 0.00 0.66 0.94 -1.10 -1.33 0.00 0.00 177.39 176.56 1h2y s GLN 95 N -2.10 3.78 0.35 3.23 -0.21 -1.26 -4.82 119.66 118.63 1h2y s GLN 95 Ca 0.27 2.09 0.03 0.00 0.02 0.00 0.00 55.36 57.77 1h2y s GLN 95 Cb 0.21 -2.60 0.64 0.00 1.00 0.00 0.00 33.01 32.27 1h2y s GLN 95 CO 0.07 -0.63 1.99 -0.91 -2.12 0.00 0.00 175.29 173.69 1h2y h ASN 96 N 2.33 0.74 -4.29 5.90 2.35 -1.95 -3.40 115.58 117.26 1h2y h ASN 96 Ca -0.50 -0.01 -0.34 0.00 -0.55 0.00 0.00 56.30 54.90 1h2y h ASN 96 Cb 1.26 -0.18 -0.25 0.00 0.05 0.00 0.00 38.32 39.20 1h2y h ASN 96 CO 0.61 0.52 -0.76 -1.10 -1.65 0.00 0.00 177.43 175.05 1h2y s GLN 97 N -5.74 0.60 0.52 0.81 -1.52 -1.26 -1.78 119.66 111.30 1h2y s GLN 97 Ca -0.10 -0.51 -0.20 0.00 -1.95 0.00 0.00 55.36 52.60 1h2y s GLN 97 Cb 0.18 -0.52 -0.07 0.00 -0.22 0.00 0.00 33.01 32.38 1h2y s GLN 97 CO 0.77 0.13 1.10 -0.98 -0.25 0.00 0.00 175.29 176.05 1h2y s ARG 98 N -0.82 3.51 -0.03 2.91 1.70 -1.26 -4.75 118.95 120.21 1h2y s ARG 98 Ca -0.02 1.52 -0.00 0.00 -0.47 0.00 0.00 55.73 56.76 1h2y s ARG 98 Cb -0.06 -2.04 -0.04 0.00 -0.57 0.00 0.00 34.95 32.25 1h2y s ARG 98 CO 0.00 -0.70 0.03 0.08 -1.08 0.00 0.00 175.30 173.63 1h2y s VAL 99 N -1.85 4.41 -0.25 4.99 1.01 0.18 -4.54 120.40 124.35 1h2y s VAL 99 Ca 0.71 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 62.10 1h2y s VAL 99 Cb -0.21 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 1h2y s VAL 99 CO 0.25 0.44 0.43 -0.22 0.00 0.00 0.00 175.10 175.99 1h2y s LEU 100 N -1.41 4.08 0.26 3.92 2.96 -0.21 -0.58 118.68 127.69 1h2y s LEU 100 Ca 0.19 0.43 0.08 0.00 -0.22 0.00 0.00 54.13 54.61 1h2y s LEU 100 Cb -0.12 -2.53 -0.04 0.00 0.50 0.00 0.00 46.19 44.01 1h2y s LEU 100 CO 0.09 -0.18 0.12 -0.31 -1.32 0.00 0.00 176.35 174.74 1h2y s TYR 101 N 1.91 2.95 0.01 5.38 1.51 0.18 -0.31 117.35 128.98 1h2y s TYR 101 Ca 0.18 -0.15 0.01 0.00 -1.01 0.00 0.00 57.07 56.10 1h2y s TYR 101 Cb -0.15 -1.32 -0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1h2y s TYR 101 CO 0.09 0.56 -0.03 0.54 -1.11 0.00 0.00 175.55 175.60 1h2y s VAL 102 N -2.21 0.21 -0.01 0.71 0.11 -0.38 -2.28 120.40 116.55 1h2y s VAL 102 Ca 0.32 -0.37 -0.03 0.00 -2.93 0.00 0.00 61.98 58.96 1h2y s VAL 102 Cb -0.07 -0.24 -0.00 0.00 -1.53 0.00 0.00 36.38 34.54 1h2y s VAL 102 CO 0.23 -0.11 0.07 0.00 -3.33 0.00 0.00 175.10 171.97 1h2y s GLN 103 N -0.51 0.25 0.23 1.54 -2.07 -0.05 -1.14 119.66 117.91 1h2y s GLN 103 Ca -0.04 -0.19 0.25 0.00 -1.82 0.00 0.00 55.36 53.56 1h2y s GLN 103 Cb -0.04 0.10 0.89 0.00 -1.09 0.00 0.00 33.01 32.88 1h2y s GLN 103 CO -0.00 -0.05 1.75 -0.25 -1.32 0.00 0.00 175.29 175.42 1h2y n ASP 104 N 2.27 0.74 -3.47 12.60 8.00 -1.26 -0.45 116.55 134.98 1h2y n ASP 104 Ca -0.18 0.62 -0.13 0.00 0.71 0.00 0.00 54.79 55.81 1h2y n ASP 104 Cb 0.57 -0.80 -0.03 0.00 -0.02 0.00 0.00 41.12 40.85 1h2y n ASP 104 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1h2y s SER 105 N -4.38 -0.53 0.57 -2.24 1.04 -1.26 -4.65 113.70 102.25 1h2y s SER 105 Ca 0.08 0.07 0.27 0.00 0.48 0.00 0.00 55.95 56.85 1h2y s SER 105 Cb 0.11 0.57 1.55 0.00 0.10 0.00 0.00 66.02 68.35 1h2y s SER 105 CO 0.50 -0.89 2.04 0.25 0.98 0.00 0.00 173.24 176.13 1h2y h LEU 106 N 2.23 0.00 0.00 2.42 5.85 -1.97 -0.57 115.31 123.27 1h2y h LEU 106 Ca -0.33 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1h2y h LEU 106 Cb 1.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.30 1h2y h LEU 106 CO 0.39 0.00 -1.29 -0.62 -0.34 0.00 0.00 178.44 176.58 1h2y n GLU 107 N -3.93 0.26 -1.22 1.25 1.02 -1.26 -5.00 120.64 111.75 1h2y n GLU 107 Ca 0.04 -0.06 -0.31 0.00 -0.02 0.00 0.00 57.16 56.81 1h2y n GLU 107 Cb 0.43 -1.53 0.10 0.00 -0.02 0.00 0.00 31.44 30.42 1h2y n GLU 107 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1h2y s GLY 108 N -3.59 1.68 0.23 0.62 0.00 -0.22 -4.99 107.32 101.05 1h2y s GLY 108 Ca 0.02 0.29 -0.30 0.00 0.00 0.00 0.00 44.72 44.73 1h2y s GLY 108 CO 0.86 0.64 1.39 1.85 0.00 0.00 0.00 173.10 177.84 1h2y s GLU 109 N -4.89 4.31 0.33 2.90 2.12 -1.26 -4.82 118.70 117.40 1h2y s GLU 109 Ca 0.62 2.21 -0.06 0.00 0.36 0.00 0.00 54.97 58.10 1h2y s GLU 109 Cb -0.18 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.02 1h2y s GLU 109 CO 0.56 -0.35 0.62 0.00 -0.54 0.00 0.00 175.26 175.55 1h2y s ALA 110 N 0.01 3.55 0.02 6.30 0.00 -1.26 -4.52 121.76 125.86 1h2y s ALA 110 Ca 0.58 -0.50 -0.02 0.00 0.00 0.00 0.00 51.96 52.01 1h2y s ALA 110 Cb -0.40 -2.40 -0.02 0.00 0.00 0.00 0.00 23.12 20.31 1h2y s ALA 110 CO 0.42 0.12 0.02 -0.98 0.00 0.00 0.00 175.76 175.34 1h2y s ARG 111 N -3.77 0.41 0.14 0.00 1.70 -0.29 -4.97 118.95 112.17 1h2y s ARG 111 Ca 0.45 -0.63 -0.31 0.00 -0.47 0.00 0.00 55.73 54.77 1h2y s ARG 111 Cb -0.10 0.15 -0.10 0.00 -0.57 0.00 0.00 34.95 34.33 1h2y s ARG 111 CO 0.32 -0.08 1.67 0.08 -1.08 0.00 0.00 175.30 176.21 1h2y s VAL 112 N -1.79 2.62 -0.24 4.99 1.01 -1.26 -1.25 120.40 124.49 1h2y s VAL 112 Ca -0.12 0.31 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 1h2y s VAL 112 Cb -0.07 -3.20 -0.11 0.00 0.00 0.00 0.00 36.38 33.00 1h2y s VAL 112 CO -0.02 0.01 -0.29 0.33 0.00 0.00 0.00 175.10 175.13 1h2y n PHE 113 N 4.78 0.00 -3.61 5.22 7.35 0.58 -4.85 117.46 126.94 1h2y n PHE 113 Ca 0.16 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.69 1h2y n PHE 113 Cb 0.38 -0.87 -0.13 0.00 0.35 0.00 0.00 39.48 39.21 1h2y n PHE 113 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1h2y s LEU 114 N -7.15 -0.22 -0.39 -2.13 2.96 -0.72 -4.96 118.68 106.06 1h2y s LEU 114 Ca -0.33 0.32 -0.02 0.00 -0.22 0.00 0.00 54.13 53.87 1h2y s LEU 114 Cb 0.12 0.55 0.10 0.00 0.50 0.00 0.00 46.19 47.47 1h2y s LEU 114 CO 0.44 -0.27 0.17 -0.62 -1.32 0.00 0.00 176.35 174.75 1h2y s ASP 115 N 2.38 5.17 0.58 3.68 -1.08 -1.26 -1.04 116.67 125.10 1h2y s ASP 115 Ca 0.03 -1.96 0.36 0.00 -0.52 0.00 0.00 52.55 50.47 1h2y s ASP 115 Cb -0.13 -1.80 1.75 0.00 -1.46 0.00 0.00 42.92 41.28 1h2y s ASP 115 CO -0.09 -0.50 2.14 -0.65 0.52 0.00 0.00 175.17 176.59 1h2y h PRO 116 N 8.00 0.00 -0.40 4.34 0.11 -1.90 -3.13 132.00 139.02 1h2y h PRO 116 Ca -0.13 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.02 1h2y h PRO 116 Cb 1.05 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1h2y h PRO 116 CO 0.66 0.03 0.27 -0.91 -0.21 0.00 0.00 178.00 177.84 1h2y h ASN 117 N 0.00 0.33 0.05 -2.05 2.35 -1.86 -1.10 115.58 113.30 1h2y h ASN 117 Ca -0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1h2y h ASN 117 Cb 0.31 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.60 1h2y h ASN 117 CO 0.00 0.23 -0.00 2.30 -1.65 0.00 0.00 177.43 178.31 1h2y n ILE 118 N -4.48 0.00 0.95 2.81 -5.35 -1.18 -3.33 119.36 108.77 1h2y n ILE 118 Ca 0.04 -0.01 0.13 0.00 -0.27 0.00 0.00 62.75 62.64 1h2y n ILE 118 Cb 0.18 -0.46 0.38 0.00 -1.74 0.00 0.00 39.64 38.01 1h2y n ILE 118 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1h2y n LEU 119 N -0.98 0.35 -3.49 7.28 4.77 -0.42 -4.91 117.00 119.60 1h2y n LEU 119 Ca 0.23 0.22 -0.15 0.00 -0.03 0.00 0.00 56.01 56.27 1h2y n LEU 119 Cb 0.13 -0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 1h2y n LEU 119 CO 0.18 0.05 0.46 -0.94 -1.33 0.00 0.00 177.39 175.82 1h2y s SER 120 N -3.15 -0.60 0.25 -1.43 1.04 -1.21 -4.86 113.70 103.73 1h2y s SER 120 Ca 0.12 0.46 -0.01 0.00 0.48 0.00 0.00 55.95 56.99 1h2y s SER 120 Cb 0.18 0.53 0.30 0.00 0.10 0.00 0.00 66.02 67.13 1h2y s SER 120 CO 0.64 -0.70 1.69 0.44 0.98 0.00 0.00 173.24 176.29 1h2y h ASP 121 N 2.63 0.66 -0.60 7.02 5.19 -1.91 -3.21 116.42 126.20 1h2y h ASP 121 Ca -0.28 -0.22 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 1h2y h ASP 121 Cb 1.20 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.53 1h2y h ASP 121 CO 0.38 0.86 0.00 -0.90 -3.12 0.00 0.00 179.24 176.46 1h2y n ASP 122 N -4.13 3.61 -1.29 6.45 5.68 -1.26 -4.97 116.55 120.64 1h2y n ASP 122 Ca 0.00 -2.00 -0.13 0.00 -0.50 0.00 0.00 54.79 52.17 1h2y n ASP 122 Cb 0.40 -0.40 -0.02 0.00 -1.14 0.00 0.00 41.12 39.96 1h2y n ASP 122 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h2y n GLY 123 N 1.26 0.37 0.58 6.12 0.00 -1.21 -4.83 105.19 107.48 1h2y n GLY 123 Ca 0.20 -0.38 0.10 0.00 0.00 0.00 0.00 46.02 45.94 1h2y n GLY 123 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h2y n THR 124 N -3.53 0.26 -4.08 2.61 -2.24 -1.26 -4.12 114.28 101.92 1h2y n THR 124 Ca -0.14 -0.38 -0.35 0.00 -2.27 0.00 0.00 64.05 60.91 1h2y n THR 124 Cb 0.55 0.35 -0.13 0.00 -2.10 0.00 0.00 70.33 69.00 1h2y n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1h2y s VAL 125 N -1.74 3.77 0.09 2.28 1.01 -1.26 -0.04 120.40 124.52 1h2y s VAL 125 Ca 0.31 -0.38 0.04 0.00 0.00 0.00 0.00 61.98 61.96 1h2y s VAL 125 Cb 0.17 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 1h2y s VAL 125 CO 0.24 0.43 -0.11 0.00 0.00 0.00 0.00 175.10 175.66 1h2y s ALA 126 N 1.07 1.16 0.19 5.51 0.00 -0.23 -4.79 121.76 124.68 1h2y s ALA 126 Ca 0.02 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 50.53 1h2y s ALA 126 Cb -0.14 -0.01 -0.09 0.00 0.00 0.00 0.00 23.12 22.88 1h2y s ALA 126 CO 0.01 0.03 1.31 -1.17 0.00 0.00 0.00 175.76 175.93 1h2y s LEU 127 N -2.26 4.41 -0.39 0.00 2.96 -1.26 -0.83 118.68 121.31 1h2y s LEU 127 Ca 0.04 2.39 0.01 0.00 -0.22 0.00 0.00 54.13 56.35 1h2y s LEU 127 Cb -0.05 -3.61 0.15 0.00 0.50 0.00 0.00 46.19 43.18 1h2y s LEU 127 CO 0.01 -0.53 0.25 -0.60 -1.32 0.00 0.00 176.35 174.17 1h2y s ARG 128 N -0.05 0.78 0.00 1.98 3.52 0.61 -4.85 118.95 120.94 1h2y s ARG 128 Ca 0.57 -1.66 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 1h2y s ARG 128 Cb -0.36 -1.52 0.00 0.00 -1.56 0.00 0.00 34.95 31.51 1h2y s ARG 128 CO 0.38 -1.25 0.00 0.41 -0.81 0.00 0.00 175.30 174.03 1h2y n GLY 129 N 3.63 -0.14 3.54 8.12 0.00 -1.26 -3.83 105.19 115.25 1h2y n GLY 129 Ca 0.16 -1.52 -0.08 0.00 0.00 0.00 0.00 46.02 44.58 1h2y n GLY 129 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h2y s TYR 130 N -2.78 -0.35 -0.26 1.61 -0.85 -1.26 -0.67 117.35 112.78 1h2y s TYR 130 Ca 0.00 0.16 -0.16 0.00 -0.52 0.00 0.00 57.07 56.55 1h2y s TYR 130 Cb 0.00 0.57 0.08 0.00 0.38 0.00 0.00 41.96 42.98 1h2y s TYR 130 CO 0.00 -0.69 0.65 0.00 -1.52 0.00 0.00 175.55 173.99 1h2y s ALA 131 N -3.32 -1.75 0.21 9.51 0.00 -0.18 -4.95 121.76 121.28 1h2y s ALA 131 Ca 0.05 2.26 -0.06 0.00 0.00 0.00 0.00 51.96 54.21 1h2y s ALA 131 Cb -0.01 -1.33 -0.06 0.00 0.00 0.00 0.00 23.12 21.72 1h2y s ALA 131 CO -0.08 -0.36 0.47 -0.06 0.00 0.00 0.00 175.76 175.73 1h2y s PHE 132 N 1.48 3.46 0.84 0.00 0.40 -1.26 -0.68 117.98 122.21 1h2y s PHE 132 Ca -0.09 0.64 -0.10 0.00 -0.60 0.00 0.00 56.93 56.78 1h2y s PHE 132 Cb -0.05 -2.08 0.10 0.00 0.51 0.00 0.00 43.02 41.49 1h2y s PHE 132 CO -0.17 0.32 1.11 -1.54 0.70 0.00 0.00 175.22 175.64 1h2y s SER 133 N -2.65 3.84 0.29 1.36 1.04 -0.03 -4.72 113.70 112.83 1h2y s SER 133 Ca 0.43 1.92 0.03 0.00 0.48 0.00 0.00 55.95 58.81 1h2y s SER 133 Cb -0.11 -2.51 0.61 0.00 0.10 0.00 0.00 66.02 64.10 1h2y s SER 133 CO 0.25 -2.48 1.82 -0.08 0.98 0.00 0.00 173.24 173.74 1h2y h GLU 134 N -1.44 0.91 -0.00 4.02 4.57 -1.87 -0.24 114.58 120.53 1h2y h GLU 134 Ca -0.44 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 1h2y h GLU 134 Cb 1.25 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1h2y h GLU 134 CO 0.48 0.60 -0.01 -0.40 -1.18 0.00 0.00 179.01 178.50 1h2y n ASP 135 N -4.65 0.17 -0.22 1.04 5.68 -1.26 -4.55 116.55 112.75 1h2y n ASP 135 Ca 0.20 -0.78 -0.03 0.00 -0.50 0.00 0.00 54.79 53.68 1h2y n ASP 135 Cb 0.41 -0.08 -0.01 0.00 -1.14 0.00 0.00 41.12 40.30 1h2y n ASP 135 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h2y n GLY 136 N 1.11 0.53 0.05 6.12 0.00 -0.10 -3.90 105.19 109.00 1h2y n GLY 136 Ca 0.20 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 46.15 1h2y n GLY 136 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h2y n GLU 137 N -1.65 0.35 -4.25 1.61 -0.58 -1.26 -4.71 120.64 110.15 1h2y n GLU 137 Ca -0.03 0.02 -0.22 0.00 -0.42 0.00 0.00 57.16 56.52 1h2y n GLU 137 Cb 0.25 -1.64 -0.12 0.00 -0.57 0.00 0.00 31.44 29.36 1h2y n GLU 137 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1h2y s TYR 138 N -3.23 1.58 -0.03 -0.32 2.02 -1.26 -0.54 117.35 115.57 1h2y s TYR 138 Ca 0.03 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.29 1h2y s TYR 138 Cb 0.13 -0.87 0.03 0.00 -0.40 0.00 0.00 41.96 40.85 1h2y s TYR 138 CO 0.79 0.16 0.00 0.12 -1.57 0.00 0.00 175.55 175.05 1h2y s PHE 139 N -1.28 0.26 -0.05 2.71 5.36 -0.41 -0.85 117.98 123.72 1h2y s PHE 139 Ca 0.04 0.02 0.03 0.00 -0.96 0.00 0.00 56.93 56.06 1h2y s PHE 139 Cb -0.10 -0.36 -0.03 0.00 -0.34 0.00 0.00 43.02 42.20 1h2y s PHE 139 CO 0.04 -0.11 -0.13 0.00 -1.46 0.00 0.00 175.22 173.55 1h2y s ALA 140 N 0.96 2.73 -0.05 11.12 0.00 0.14 -0.83 121.76 135.84 1h2y s ALA 140 Ca -0.09 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.82 1h2y s ALA 140 Cb -0.13 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 21.99 1h2y s ALA 140 CO -0.02 0.56 0.20 1.52 0.00 0.00 0.00 175.76 178.02 1h2y s TYR 141 N -0.75 -0.16 -0.01 0.00 1.13 -0.13 -1.01 117.35 116.43 1h2y s TYR 141 Ca 0.12 0.36 -0.08 0.00 -1.41 0.00 0.00 57.07 56.06 1h2y s TYR 141 Cb -0.11 0.05 -0.05 0.00 -1.10 0.00 0.00 41.96 40.75 1h2y s TYR 141 CO 0.01 -0.18 0.27 0.20 -2.51 0.00 0.00 175.55 173.33 1h2y s GLY 142 N -0.41 2.26 -0.08 5.49 0.00 0.15 -0.79 107.32 113.94 1h2y s GLY 142 Ca -0.05 -0.54 0.02 0.00 0.00 0.00 0.00 44.72 44.15 1h2y s GLY 142 CO 0.01 -0.33 -0.15 1.08 0.00 0.00 0.00 173.10 173.71 1h2y s LEU 143 N -1.60 1.75 -0.01 0.66 1.43 0.06 -0.29 118.68 120.68 1h2y s LEU 143 Ca 0.26 -0.38 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1h2y s LEU 143 Cb -0.13 -1.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.05 1h2y s LEU 143 CO 0.14 0.05 -0.19 -0.44 0.23 0.00 0.00 176.35 176.15 1h2y s SER 144 N 0.68 3.66 -0.09 2.29 0.01 -0.01 -1.81 113.70 118.42 1h2y s SER 144 Ca -0.14 -0.36 -0.01 0.00 1.31 0.00 0.00 55.95 56.75 1h2y s SER 144 Cb -0.16 -0.61 -0.03 0.00 0.21 0.00 0.00 66.02 65.43 1h2y s SER 144 CO 0.04 0.30 -0.02 0.00 0.41 0.00 0.00 173.24 173.97 1h2y s ALA 145 N -0.77 3.16 -1.58 1.44 0.00 -1.26 -1.06 121.76 121.69 1h2y s ALA 145 Ca 0.12 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.25 1h2y s ALA 145 Cb -0.10 -1.41 0.00 0.00 0.00 0.00 0.00 23.12 21.61 1h2y s ALA 145 CO 0.02 0.55 0.00 0.43 0.00 0.00 0.00 175.76 176.76 1h2y n SER 146 N 2.30 -4.97 0.00 0.00 7.64 0.94 -2.60 113.62 116.94 1h2y n SER 146 Ca -0.18 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1h2y n SER 146 Cb 0.53 -4.24 0.00 0.00 -1.01 0.00 0.00 64.21 59.49 1h2y n SER 146 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h2y n GLY 147 N -0.77 0.93 3.77 0.23 0.00 -1.26 -2.45 105.19 105.63 1h2y n GLY 147 Ca -0.20 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.48 1h2y n GLY 147 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1h2y s SER 148 N -2.93 5.35 0.51 1.61 0.15 -1.07 -3.95 113.70 113.38 1h2y s SER 148 Ca 0.00 2.14 0.30 0.00 0.70 0.00 0.00 55.95 59.09 1h2y s SER 148 Cb 0.00 -2.57 1.17 0.00 -1.71 0.00 0.00 66.02 62.91 1h2y s SER 148 CO 0.00 -1.47 1.92 0.44 1.20 0.00 0.00 173.24 175.33 1h2y h ASP 149 N 0.64 0.00 -3.97 5.45 3.32 -1.92 -3.42 116.42 116.52 1h2y h ASP 149 Ca -0.49 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.02 1h2y h ASP 149 Cb 1.26 0.00 0.12 0.00 0.22 0.00 0.00 39.33 40.93 1h2y h ASP 149 CO 0.55 0.07 0.75 0.26 -1.72 0.00 0.00 179.24 179.15 1h2y s TRP 150 N -3.64 2.49 0.04 4.55 0.52 -1.26 -4.60 118.94 117.04 1h2y s TRP 150 Ca 0.01 1.20 0.04 0.00 0.02 0.00 0.00 56.10 57.37 1h2y s TRP 150 Cb 0.09 -4.00 -0.02 0.00 -1.15 0.00 0.00 33.47 28.39 1h2y s TRP 150 CO 0.58 -3.05 -0.12 0.08 0.02 0.00 0.00 176.95 174.46 1h2y s VAL 151 N -1.15 0.91 -0.17 4.03 1.01 0.21 -4.39 120.40 120.85 1h2y s VAL 151 Ca 0.57 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1h2y s VAL 151 Cb -0.46 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.06 1h2y s VAL 151 CO 0.61 -0.14 -0.19 -0.89 0.00 0.00 0.00 175.10 174.49 1h2y s THR 152 N -1.02 2.22 -0.11 3.92 2.01 -0.75 -3.24 115.64 118.66 1h2y s THR 152 Ca -0.02 -0.90 -0.16 0.00 0.31 0.00 0.00 61.69 60.91 1h2y s THR 152 Cb -0.08 -1.92 -0.05 0.00 0.01 0.00 0.00 72.50 70.46 1h2y s THR 152 CO 0.01 0.53 0.42 -0.63 -0.69 0.00 0.00 174.62 174.26 1h2y s ILE 153 N 1.11 5.20 0.37 1.82 1.01 -0.12 -0.76 121.20 129.83 1h2y s ILE 153 Ca 0.00 0.83 0.07 0.00 0.00 0.00 0.00 60.65 61.55 1h2y s ILE 153 Cb -0.14 -3.75 -0.07 0.00 0.01 0.00 0.00 42.46 38.50 1h2y s ILE 153 CO -0.08 0.38 -0.02 -0.54 0.00 0.00 0.00 174.94 174.68 1h2y s LYS 154 N 0.33 1.86 0.06 2.79 1.02 0.03 -0.79 119.74 125.04 1h2y s LYS 154 Ca 0.23 -2.02 0.03 0.00 0.02 0.00 0.00 55.97 54.23 1h2y s LYS 154 Cb -0.15 -1.55 -0.03 0.00 -0.52 0.00 0.00 37.83 35.58 1h2y s LYS 154 CO 0.09 -0.00 -0.09 -0.06 -0.92 0.00 0.00 175.35 174.37 1h2y s PHE 155 N -2.76 0.81 0.01 3.18 0.40 -1.24 -0.95 117.98 117.44 1h2y s PHE 155 Ca 0.34 -0.56 -0.04 0.00 -0.60 0.00 0.00 56.93 56.07 1h2y s PHE 155 Cb 0.07 -0.47 -0.01 0.00 0.51 0.00 0.00 43.02 43.12 1h2y s PHE 155 CO 0.17 -0.06 0.06 -1.64 0.70 0.00 0.00 175.22 174.45 1h2y s MET 156 N -1.99 0.43 -0.13 0.44 -1.94 -0.01 -1.40 119.30 114.70 1h2y s MET 156 Ca -0.05 -0.54 -0.18 0.00 -1.71 0.00 0.00 55.69 53.21 1h2y s MET 156 Cb -0.07 0.17 -0.04 0.00 2.01 0.00 0.00 34.83 36.89 1h2y s MET 156 CO -0.00 -0.09 0.46 0.21 -0.01 0.00 0.00 175.02 175.59 1h2y s LYS 157 N -1.61 4.31 0.12 2.03 2.20 0.43 -1.28 119.74 125.93 1h2y s LYS 157 Ca -0.14 0.40 -0.18 0.00 -0.36 0.00 0.00 55.97 55.70 1h2y s LYS 157 Cb -0.08 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.75 1h2y s LYS 157 CO -0.00 0.12 1.69 0.28 -0.36 0.00 0.00 175.35 177.08 1h2y h VAL 158 N 4.78 1.16 -2.34 4.02 2.07 -1.13 -1.56 116.25 123.24 1h2y h VAL 158 Ca -0.40 -0.46 -0.56 0.00 0.82 0.00 0.00 66.70 66.10 1h2y h VAL 158 Cb 1.17 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1h2y h VAL 158 CO 0.75 0.16 1.36 -0.62 0.02 0.00 0.00 177.57 179.25 1h2y s ASP 159 N -5.68 5.58 0.00 0.57 2.15 -1.26 -1.27 116.67 116.77 1h2y s ASP 159 Ca -0.13 1.26 0.00 0.00 0.43 0.00 0.00 52.55 54.10 1h2y s ASP 159 Cb 0.09 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 1h2y s ASP 159 CO 0.73 -1.96 0.00 0.61 -0.17 0.00 0.00 175.17 174.37 1h2y n GLY 160 N 5.58 0.74 4.08 2.66 0.00 -1.26 -4.36 105.19 112.64 1h2y n GLY 160 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1h2y n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2y n ALA 161 N -0.59 -2.07 -2.69 4.61 0.00 -0.40 -4.89 120.51 114.49 1h2y n ALA 161 Ca 0.00 -0.34 -0.41 0.00 0.00 0.00 0.00 53.44 52.68 1h2y n ALA 161 Cb 0.00 -1.40 -0.04 0.00 0.00 0.00 0.00 19.45 18.01 1h2y n ALA 161 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1h2y s LYS 162 N -6.89 4.37 0.12 0.00 -0.14 -0.60 -4.88 119.74 111.73 1h2y s LYS 162 Ca 0.05 1.12 -0.30 0.00 -1.36 0.00 0.00 55.97 55.47 1h2y s LYS 162 Cb -0.02 -3.53 -0.07 0.00 -1.68 0.00 0.00 37.83 32.53 1h2y s LYS 162 CO 0.93 -0.23 1.18 -1.21 -0.76 0.00 0.00 175.35 175.26 1h2y s GLU 163 N 1.78 4.48 0.24 1.68 2.02 -1.26 -0.43 118.70 127.22 1h2y s GLU 163 Ca 0.42 1.79 0.06 0.00 0.02 0.00 0.00 54.97 57.25 1h2y s GLU 163 Cb -0.18 -3.30 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 1h2y s GLU 163 CO 0.16 -0.14 0.28 -0.51 0.02 0.00 0.00 175.26 175.07 1h2y s LEU 164 N 0.38 4.07 0.41 1.80 1.43 -0.49 -4.89 118.68 121.38 1h2y s LEU 164 Ca 0.55 -0.09 0.21 0.00 -1.03 0.00 0.00 54.13 53.77 1h2y s LEU 164 Cb -0.30 -2.60 0.80 0.00 0.03 0.00 0.00 46.19 44.11 1h2y s LEU 164 CO 0.32 -0.05 1.78 -0.65 0.23 0.00 0.00 176.35 177.99 1h2y h PRO 165 N 1.37 0.00 -6.33 1.29 0.11 -1.96 -3.42 132.00 123.05 1h2y h PRO 165 Ca -0.50 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 64.97 1h2y h PRO 165 Cb 1.23 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.39 1h2y h PRO 165 CO 0.61 0.30 0.77 -0.25 -0.21 0.00 0.00 178.00 179.22 1h2y n ASP 166 N -3.48 2.61 -3.76 -2.05 9.92 -1.26 -4.99 116.55 113.53 1h2y n ASP 166 Ca -0.00 1.07 -0.15 0.00 -0.53 0.00 0.00 54.79 55.18 1h2y n ASP 166 Cb 0.47 -1.30 -0.16 0.00 -0.64 0.00 0.00 41.12 39.49 1h2y n ASP 166 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1h2y s VAL 167 N 1.80 -0.06 -0.17 2.53 1.01 -1.26 -3.64 120.40 120.61 1h2y s VAL 167 Ca 0.86 0.22 0.00 0.00 0.00 0.00 0.00 61.98 63.07 1h2y s VAL 167 Cb -0.83 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 35.45 1h2y s VAL 167 CO 0.48 0.09 -0.15 -0.76 0.00 0.00 0.00 175.10 174.76 1h2y s LEU 168 N 1.15 2.45 0.38 3.92 1.43 0.03 -4.58 118.68 123.47 1h2y s LEU 168 Ca -0.08 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 1h2y s LEU 168 Cb -0.13 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.50 1h2y s LEU 168 CO -0.03 0.06 0.32 -1.61 0.23 0.00 0.00 176.35 175.31 1h2y s GLU 169 N 0.97 2.56 -1.49 1.70 0.41 -1.26 -0.94 118.70 120.64 1h2y s GLU 169 Ca -0.02 -1.48 0.00 0.00 -0.41 0.00 0.00 54.97 53.05 1h2y s GLU 169 Cb -0.15 -2.36 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1h2y s GLU 169 CO -0.03 -0.07 0.00 0.54 -0.49 0.00 0.00 175.26 175.21 1h2y n ARG 170 N -1.44 -1.35 -3.42 1.61 1.74 -1.26 -4.89 116.66 107.65 1h2y n ARG 170 Ca 0.01 0.85 -0.38 0.00 -0.77 0.00 0.00 57.85 57.56 1h2y n ARG 170 Cb 0.61 -5.29 -0.06 0.00 -1.02 0.00 0.00 32.46 26.71 1h2y n ARG 170 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1h2y s VAL 171 N -2.84 5.11 -0.27 1.55 1.01 -1.20 -1.26 120.40 122.50 1h2y s VAL 171 Ca 0.00 0.87 -0.25 0.00 0.00 0.00 0.00 61.98 62.60 1h2y s VAL 171 Cb 0.00 -3.75 0.09 0.00 0.00 0.00 0.00 36.38 32.72 1h2y s VAL 171 CO 0.00 0.46 0.82 -0.75 0.00 0.00 0.00 175.10 175.63 1h2y s LYS 172 N -0.23 0.72 -1.46 2.72 2.20 -1.25 -0.62 119.74 121.82 1h2y s LYS 172 Ca 0.24 0.87 -0.03 0.00 -0.36 0.00 0.00 55.97 56.69 1h2y s LYS 172 Cb -0.16 0.34 0.03 0.00 -1.51 0.00 0.00 37.83 36.53 1h2y s LYS 172 CO 0.11 -0.09 0.46 1.19 -0.36 0.00 0.00 175.35 176.67 1h2y n PHE 173 N 2.59 -1.65 -3.96 4.03 3.72 -1.26 -4.76 117.46 116.17 1h2y n PHE 173 Ca -0.14 0.75 -0.33 0.00 -0.05 0.00 0.00 57.45 57.68 1h2y n PHE 173 Cb 0.55 -3.57 -0.05 0.00 -0.94 0.00 0.00 39.48 35.47 1h2y n PHE 173 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1h2y s SER 174 N -4.18 6.17 0.67 4.37 0.15 -1.26 -4.92 113.70 114.69 1h2y s SER 174 Ca 0.13 0.28 -0.07 0.00 0.70 0.00 0.00 55.95 56.99 1h2y s SER 174 Cb -0.07 -1.89 0.04 0.00 -1.71 0.00 0.00 66.02 62.39 1h2y s SER 174 CO 0.90 0.25 0.99 0.00 1.20 0.00 0.00 173.24 176.58 1h2y s MET 176 N -5.18 0.31 -0.04 0.00 -1.94 -1.25 -4.06 119.30 107.14 1h2y s MET 176 Ca 0.58 0.13 -0.02 0.00 -1.71 0.00 0.00 55.69 54.67 1h2y s MET 176 Cb -0.11 -0.68 0.03 0.00 2.01 0.00 0.00 34.83 36.09 1h2y s MET 176 CO 0.46 -0.86 0.07 0.00 -0.01 0.00 0.00 175.02 174.68 1h2y s ALA 177 N 2.42 0.18 0.14 3.03 0.00 -0.85 -4.81 121.76 121.88 1h2y s ALA 177 Ca 0.10 0.23 -0.23 0.00 0.00 0.00 0.00 51.96 52.06 1h2y s ALA 177 Cb -0.14 -0.64 -0.08 0.00 0.00 0.00 0.00 23.12 22.26 1h2y s ALA 177 CO -0.24 -0.50 0.71 -1.58 0.00 0.00 0.00 175.76 174.16 1h2y s TRP 178 N 2.17 3.87 0.38 0.00 0.52 -1.26 -0.36 118.94 124.27 1h2y s TRP 178 Ca 0.05 1.52 -0.26 0.00 0.02 0.00 0.00 56.10 57.43 1h2y s TRP 178 Cb -0.12 -2.68 -0.09 0.00 -1.15 0.00 0.00 33.47 29.43 1h2y s TRP 178 CO -0.03 0.54 1.12 0.95 0.02 0.00 0.00 176.95 179.54 1h2y s THR 179 N -1.15 3.38 -1.09 2.01 -4.23 -0.81 -4.80 115.64 108.96 1h2y s THR 179 Ca 0.34 1.17 0.05 0.00 -1.18 0.00 0.00 61.69 62.08 1h2y s THR 179 Cb -0.22 -3.66 0.05 0.00 1.34 0.00 0.00 72.50 70.01 1h2y s THR 179 CO 0.24 0.12 1.14 1.41 -0.54 0.00 0.00 174.62 176.99 1h2y n HIS 180 N 0.25 0.00 1.51 3.99 -0.00 -1.26 -1.33 115.22 118.39 1h2y n HIS 180 Ca 0.03 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.90 1h2y n HIS 180 Cb 0.47 -0.46 0.71 0.00 -0.00 0.00 0.00 29.99 30.71 1h2y n HIS 180 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1h2y n ASP 181 N -1.46 0.28 -0.12 0.41 5.68 -1.26 -4.88 116.55 115.20 1h2y n ASP 181 Ca 0.02 -0.54 -0.02 0.00 -0.50 0.00 0.00 54.79 53.75 1h2y n ASP 181 Cb 0.06 -0.13 -0.01 0.00 -1.14 0.00 0.00 41.12 39.91 1h2y n ASP 181 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h2y n GLY 182 N 1.23 0.39 0.20 6.12 0.00 -0.44 -4.91 105.19 107.79 1h2y n GLY 182 Ca 0.16 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 1h2y n GLY 182 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1h2y h LYS 183 N 0.42 0.72 0.00 1.61 3.64 -1.91 -3.47 116.57 117.58 1h2y h LYS 183 Ca -0.03 -0.67 0.00 0.00 -1.27 0.00 0.00 60.65 58.68 1h2y h LYS 183 Cb 0.53 0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1h2y h LYS 183 CO 0.05 1.27 0.03 0.41 -2.27 0.00 0.00 179.45 178.93 1h2y n GLY 184 N 0.88 1.67 2.88 5.01 0.00 -1.26 -1.14 105.19 113.24 1h2y n GLY 184 Ca -0.09 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 1h2y n GLY 184 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1h2y s MET 185 N -2.01 0.04 0.36 1.61 1.75 -0.31 -1.92 119.30 118.83 1h2y s MET 185 Ca 0.01 -0.04 -0.20 0.00 -1.25 0.00 0.00 55.69 54.22 1h2y s MET 185 Cb -0.00 -0.02 -0.10 0.00 2.84 0.00 0.00 34.83 37.55 1h2y s MET 185 CO 0.01 0.00 0.85 -0.06 -0.65 0.00 0.00 175.02 175.18 1h2y s PHE 186 N -0.08 3.42 0.22 4.11 0.08 0.52 -0.44 117.98 125.81 1h2y s PHE 186 Ca -0.01 1.48 -0.23 0.00 0.12 0.00 0.00 56.93 58.30 1h2y s PHE 186 Cb -0.01 -2.73 0.04 0.00 -0.57 0.00 0.00 43.02 39.75 1h2y s PHE 186 CO -0.00 0.05 0.79 1.52 -0.10 0.00 0.00 175.22 177.48 1h2y s TYR 187 N -1.96 -0.21 0.04 0.36 1.13 -0.58 -2.01 117.35 114.12 1h2y s TYR 187 Ca 0.56 -0.18 0.06 0.00 -1.41 0.00 0.00 57.07 56.09 1h2y s TYR 187 Cb -0.12 0.67 -0.03 0.00 -1.10 0.00 0.00 41.96 41.38 1h2y s TYR 187 CO 0.17 -1.06 -0.12 -0.80 -2.51 0.00 0.00 175.55 171.22 1h2y s ASN 188 N -2.90 4.20 0.03 -0.18 -0.87 -1.26 -0.67 114.94 113.30 1h2y s ASN 188 Ca 0.10 -0.31 -0.08 0.00 -1.57 0.00 0.00 52.86 51.00 1h2y s ASN 188 Cb -0.04 -0.82 0.00 0.00 -0.02 0.00 0.00 41.25 40.37 1h2y s ASN 188 CO 0.03 0.25 0.17 0.00 -2.57 0.00 0.00 177.10 174.99 1h2y s ALA 189 N -0.99 -0.31 0.03 0.60 0.00 -0.91 -3.93 121.76 116.24 1h2y s ALA 189 Ca 0.17 -0.28 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 1h2y s ALA 189 Cb -0.11 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 1h2y s ALA 189 CO 0.07 -0.32 0.15 0.71 0.00 0.00 0.00 175.76 176.38 1h2y s TYR 190 N -2.29 3.43 0.86 0.00 2.02 -0.39 -1.09 117.35 119.89 1h2y s TYR 190 Ca -0.07 0.25 -0.11 0.00 -0.37 0.00 0.00 57.07 56.76 1h2y s TYR 190 Cb -0.03 -1.75 0.11 0.00 -0.40 0.00 0.00 41.96 39.90 1h2y s TYR 190 CO -0.03 0.59 1.15 -2.14 -1.57 0.00 0.00 175.55 173.55 1h2y s PRO 191 N -2.16 1.40 0.51 -1.71 0.02 -1.26 -4.89 135.00 126.90 1h2y s PRO 191 Ca 0.29 1.52 -0.23 0.00 0.02 0.00 0.00 61.00 62.60 1h2y s PRO 191 Cb -0.13 -1.77 -0.06 0.00 0.02 0.00 0.00 34.50 32.56 1h2y s PRO 191 CO 0.21 -2.35 1.37 1.04 -0.33 0.00 0.00 177.00 176.95 1h2y n GLN 192 N -3.88 1.88 -4.05 5.54 1.13 -1.26 -5.02 117.38 111.73 1h2y n GLN 192 Ca 0.12 0.68 -0.11 0.00 -1.94 0.00 0.00 57.00 55.75 1h2y n GLN 192 Cb 0.52 -2.58 -0.11 0.00 0.11 0.00 0.00 30.24 28.18 1h2y n GLN 192 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1h2y s GLN 193 N -2.69 0.49 0.57 -1.09 -2.07 -1.26 -5.14 119.66 108.46 1h2y s GLN 193 Ca 0.68 -0.78 -0.19 0.00 -1.82 0.00 0.00 55.36 53.24 1h2y s GLN 193 Cb -0.43 -0.13 -0.05 0.00 -1.09 0.00 0.00 33.01 31.31 1h2y s GLN 193 CO 0.52 0.00 1.18 -0.51 -1.32 0.00 0.00 175.29 175.17 1h2y s ASP 194 N -1.74 5.42 0.00 12.60 1.01 -1.26 -4.81 116.67 127.90 1h2y s ASP 194 Ca -0.09 2.31 0.00 0.00 0.71 0.00 0.00 52.55 55.48 1h2y s ASP 194 Cb -0.08 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1h2y s ASP 194 CO -0.01 -1.43 0.00 0.61 0.21 0.00 0.00 175.17 174.55 1h2y n GLY 195 N 0.38 -1.65 3.85 0.21 0.00 -1.26 -4.94 105.19 101.78 1h2y n GLY 195 Ca 0.13 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.40 1h2y n GLY 195 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h2y s LYS 196 N 0.00 3.97 -0.38 1.61 1.02 -1.26 -5.01 119.74 119.68 1h2y s LYS 196 Ca 0.00 0.76 0.13 0.00 0.02 0.00 0.00 55.97 56.88 1h2y s LYS 196 Cb 0.00 -2.30 0.38 0.00 -0.52 0.00 0.00 37.83 35.39 1h2y s LYS 196 CO 0.00 -0.03 0.84 0.43 -0.92 0.00 0.00 175.35 175.66 1h2y n SER 197 N -0.96 1.59 0.00 2.83 7.64 -1.26 -4.66 113.62 118.80 1h2y n SER 197 Ca 0.05 -3.03 0.00 0.00 1.01 0.00 0.00 58.87 56.89 1h2y n SER 197 Cb 0.54 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1h2y n SER 197 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1h2y n ASP 198 N 0.09 1.06 0.00 6.43 5.75 -1.26 -4.98 116.55 123.64 1h2y n ASP 198 Ca 0.22 -1.23 0.00 0.00 -0.01 0.00 0.00 54.79 53.77 1h2y n ASP 198 Cb 0.68 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.77 1h2y n ASP 198 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1h2y n GLY 199 N -0.11 1.51 0.01 6.12 0.00 -1.26 -4.76 105.19 106.70 1h2y n GLY 199 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1h2y n GLY 199 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h2y n THR 200 N -1.26 0.04 -2.32 2.61 -2.24 -1.26 -3.83 114.28 106.03 1h2y n THR 200 Ca 0.00 -0.07 -0.28 0.00 -2.27 0.00 0.00 64.05 61.43 1h2y n THR 200 Cb 0.00 0.54 0.02 0.00 -2.10 0.00 0.00 70.33 68.79 1h2y n THR 200 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1h2y s GLU 201 N -3.06 3.14 0.00 -0.78 1.03 -1.26 -4.78 118.70 112.99 1h2y s GLU 201 Ca 0.08 0.20 0.09 0.00 0.03 0.00 0.00 54.97 55.37 1h2y s GLU 201 Cb 0.16 -2.24 0.05 0.00 -0.80 0.00 0.00 34.13 31.30 1h2y s GLU 201 CO 0.80 -0.62 0.72 0.25 -1.33 0.00 0.00 175.26 175.08 1h2y n THR 202 N -2.59 0.00 -1.58 1.83 -2.24 -1.26 -4.90 114.28 103.54 1h2y n THR 202 Ca 0.04 -0.46 -0.52 0.00 -2.27 0.00 0.00 64.05 60.84 1h2y n THR 202 Cb 0.56 1.16 -0.06 0.00 -2.10 0.00 0.00 70.33 69.90 1h2y n THR 202 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1h2y n SER 203 N 0.22 1.42 -4.77 3.42 7.64 -1.26 -0.71 113.62 119.58 1h2y n SER 203 Ca 0.05 1.13 -0.40 0.00 1.01 0.00 0.00 58.87 60.66 1h2y n SER 203 Cb 0.22 -1.18 -0.01 0.00 -1.01 0.00 0.00 64.21 62.23 1h2y n SER 203 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1h2y s THR 204 N 0.25 2.67 -0.41 0.44 -1.32 -1.26 -2.45 115.64 113.56 1h2y s THR 204 Ca 0.82 0.62 -0.13 0.00 -1.21 0.00 0.00 61.69 61.79 1h2y s THR 204 Cb -0.95 -3.37 0.04 0.00 -1.51 0.00 0.00 72.50 66.71 1h2y s THR 204 CO 0.49 0.10 0.27 0.20 -2.21 0.00 0.00 174.62 173.48 1h2y s ASN 205 N -0.69 5.91 0.23 8.08 0.02 -0.31 -4.82 114.94 123.35 1h2y s ASN 205 Ca 0.55 -1.09 0.04 0.00 -1.02 0.00 0.00 52.86 51.33 1h2y s ASN 205 Cb -0.38 -2.09 -0.05 0.00 0.02 0.00 0.00 41.25 38.75 1h2y s ASN 205 CO 0.49 -0.47 -0.00 -0.76 0.02 0.00 0.00 177.10 176.38 1h2y s LEU 206 N 1.59 2.19 -1.19 0.60 1.43 -1.26 -4.88 118.68 117.16 1h2y s LEU 206 Ca 0.03 -1.22 -0.07 0.00 -1.03 0.00 0.00 54.13 51.84 1h2y s LEU 206 Cb -0.21 -0.27 0.01 0.00 0.03 0.00 0.00 46.19 45.75 1h2y s LEU 206 CO 0.07 -0.51 1.04 1.41 0.23 0.00 0.00 176.35 178.59 1h2y n HIS 207 N -0.42 -2.51 -2.11 0.29 8.25 -0.10 -4.57 115.22 114.06 1h2y n HIS 207 Ca -0.05 0.90 -0.41 0.00 -0.26 0.00 0.00 57.72 57.90 1h2y n HIS 207 Cb 0.64 -4.61 -0.02 0.00 1.12 0.00 0.00 29.99 27.12 1h2y n HIS 207 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1h2y s GLN 208 N -6.07 4.35 0.32 -0.41 0.74 -1.26 -4.36 119.66 112.96 1h2y s GLN 208 Ca 0.47 2.23 0.07 0.00 0.05 0.00 0.00 55.36 58.17 1h2y s GLN 208 Cb -0.21 -3.07 -0.06 0.00 1.10 0.00 0.00 33.01 30.77 1h2y s GLN 208 CO 0.65 -0.21 -0.04 0.15 -0.55 0.00 0.00 175.29 175.29 1h2y s LYS 209 N -1.70 1.68 -0.20 1.67 1.02 -0.25 -4.68 119.74 117.28 1h2y s LYS 209 Ca 0.50 -1.88 -0.06 0.00 0.02 0.00 0.00 55.97 54.54 1h2y s LYS 209 Cb -0.40 -1.29 -0.03 0.00 -0.52 0.00 0.00 37.83 35.59 1h2y s LYS 209 CO 0.52 0.01 0.02 -1.17 -0.92 0.00 0.00 175.35 173.81 1h2y s LEU 210 N -3.52 3.37 0.30 3.17 2.96 -0.69 -2.15 118.68 122.12 1h2y s LEU 210 Ca 0.32 -0.16 0.09 0.00 -0.22 0.00 0.00 54.13 54.16 1h2y s LEU 210 Cb 0.05 -1.86 -0.06 0.00 0.50 0.00 0.00 46.19 44.83 1h2y s LEU 210 CO 0.14 0.07 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.82 1h2y s TYR 211 N 0.97 2.17 -0.16 5.38 2.02 0.16 -1.20 117.35 126.69 1h2y s TYR 211 Ca 0.02 -0.53 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 1h2y s TYR 211 Cb -0.14 -1.15 0.03 0.00 -0.40 0.00 0.00 41.96 40.30 1h2y s TYR 211 CO 0.02 0.50 -0.12 -0.47 -1.57 0.00 0.00 175.55 173.91 1h2y s TYR 212 N -2.75 2.13 -0.26 2.71 5.04 0.34 -1.52 117.35 123.04 1h2y s TYR 212 Ca 0.30 -1.25 -0.11 0.00 -2.44 0.00 0.00 57.07 53.57 1h2y s TYR 212 Cb 0.01 -1.56 -0.05 0.00 0.35 0.00 0.00 41.96 40.71 1h2y s TYR 212 CO 0.14 -0.67 0.18 -1.58 -1.34 0.00 0.00 175.55 172.27 1h2y s HIS 213 N 1.50 3.25 -0.16 4.97 5.65 0.41 -1.54 115.29 129.37 1h2y s HIS 213 Ca 0.03 0.15 -0.24 0.00 0.25 0.00 0.00 55.06 55.25 1h2y s HIS 213 Cb -0.14 -2.33 -0.02 0.00 -1.18 0.00 0.00 32.58 28.91 1h2y s HIS 213 CO -0.10 -0.07 0.79 0.08 -0.65 0.00 0.00 174.74 174.78 1h2y s VAL 214 N 1.48 4.92 0.27 0.89 1.01 -1.26 -1.16 120.40 126.55 1h2y s VAL 214 Ca 0.07 1.54 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 1h2y s VAL 214 Cb -0.15 -4.10 -0.12 0.00 0.00 0.00 0.00 36.38 32.01 1h2y s VAL 214 CO 0.08 0.06 1.55 -0.11 0.00 0.00 0.00 175.10 176.68 1h2y n LEU 215 N 5.05 3.92 0.00 3.92 7.94 -0.29 -2.47 117.00 135.08 1h2y n LEU 215 Ca 0.03 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.07 1h2y n LEU 215 Cb 0.49 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 42.90 1h2y n LEU 215 CO 0.47 -0.05 0.00 0.61 -1.11 0.00 0.00 177.39 177.31 1h2y n GLY 216 N 2.32 0.80 3.58 -3.96 0.00 -1.26 -4.99 105.19 101.68 1h2y n GLY 216 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 1h2y n GLY 216 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h2y s THR 217 N -2.06 1.52 0.40 2.61 -4.23 -1.03 -5.08 115.64 107.76 1h2y s THR 217 Ca 0.00 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.37 1h2y s THR 217 Cb 0.00 -2.76 -0.08 0.00 1.34 0.00 0.00 72.50 71.00 1h2y s THR 217 CO 0.00 0.00 0.81 -1.81 -0.54 0.00 0.00 174.62 173.08 1h2y s ASP 218 N -3.66 6.65 0.55 3.99 1.01 -1.26 -4.81 116.67 119.14 1h2y s ASP 218 Ca 0.30 1.29 0.24 0.00 0.71 0.00 0.00 52.55 55.09 1h2y s ASP 218 Cb 0.08 -2.39 1.56 0.00 1.01 0.00 0.00 42.92 43.19 1h2y s ASP 218 CO 0.15 -0.36 2.20 -0.61 0.21 0.00 0.00 175.17 176.75 1h2y h GLN 219 N 1.57 0.00 0.00 8.23 4.15 -1.96 -1.26 115.11 125.84 1h2y h GLN 219 Ca -0.47 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1h2y h GLN 219 Cb 1.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.87 1h2y h GLN 219 CO 0.64 0.01 0.00 0.66 -1.93 0.00 0.00 178.83 178.21 1h2y h SER 220 N 0.00 0.00 0.31 -0.69 4.64 -1.96 -1.27 113.55 114.59 1h2y h SER 220 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1h2y h SER 220 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1h2y h SER 220 CO 0.00 0.00 -0.46 -0.62 -0.87 0.00 0.00 176.83 174.89 1h2y n GLU 221 N -2.60 0.41 -1.66 4.77 1.02 -0.47 -4.98 120.64 117.12 1h2y n GLU 221 Ca -0.01 -0.26 -0.42 0.00 -0.02 0.00 0.00 57.16 56.45 1h2y n GLU 221 Cb 0.11 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 1h2y n GLU 221 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1h2y n ASP 222 N -1.07 2.06 -4.73 1.62 9.92 -0.48 -4.96 116.55 118.91 1h2y n ASP 222 Ca 0.08 1.12 -0.40 0.00 -0.53 0.00 0.00 54.79 55.07 1h2y n ASP 222 Cb 0.35 -1.43 -0.05 0.00 -0.64 0.00 0.00 41.12 39.36 1h2y n ASP 222 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1h2y s ILE 223 N -1.18 4.91 -0.28 0.53 -1.09 -0.59 -4.86 121.20 118.65 1h2y s ILE 223 Ca 0.60 1.50 -0.24 0.00 -2.23 0.00 0.00 60.65 60.28 1h2y s ILE 223 Cb -0.56 -4.06 -0.00 0.00 -1.58 0.00 0.00 42.46 36.25 1h2y s ILE 223 CO 0.59 0.31 0.80 -0.22 -1.23 0.00 0.00 174.94 175.19 1h2y s LEU 224 N 0.37 4.08 -0.12 2.97 2.96 -1.26 -0.51 118.68 127.18 1h2y s LEU 224 Ca 0.37 0.82 0.16 0.00 -0.22 0.00 0.00 54.13 55.27 1h2y s LEU 224 Cb -0.19 -3.11 -0.24 0.00 0.50 0.00 0.00 46.19 43.15 1h2y s LEU 224 CO 0.20 -0.56 0.19 0.00 -1.32 0.00 0.00 176.35 174.85 1h2y s ALA 226 N -2.73 -1.66 0.03 0.00 0.00 -1.18 -2.85 121.76 113.36 1h2y s ALA 226 Ca -0.08 1.94 -0.17 0.00 0.00 0.00 0.00 51.96 53.66 1h2y s ALA 226 Cb 0.07 -1.13 0.03 0.00 0.00 0.00 0.00 23.12 22.09 1h2y s ALA 226 CO 0.72 -0.32 0.38 -1.83 0.00 0.00 0.00 175.76 174.71 1h2y s GLU 227 N 0.55 0.85 -0.48 0.00 -1.05 -1.26 -1.70 118.70 115.61 1h2y s GLU 227 Ca -0.02 -0.33 0.07 0.00 -0.15 0.00 0.00 54.97 54.54 1h2y s GLU 227 Cb -0.05 0.38 0.25 0.00 -0.44 0.00 0.00 34.13 34.27 1h2y s GLU 227 CO -0.02 -0.28 0.60 1.19 0.95 0.00 0.00 175.26 177.71 1h2y n PHE 228 N 0.70 1.12 0.24 4.83 3.72 -1.26 -4.97 117.46 121.83 1h2y n PHE 228 Ca -0.19 -3.78 0.14 0.00 -0.05 0.00 0.00 57.45 53.57 1h2y n PHE 228 Cb 0.59 -0.43 0.81 0.00 -0.94 0.00 0.00 39.48 39.51 1h2y n PHE 228 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1h2y h PRO 229 N 4.07 0.00 -0.01 -1.08 0.13 -1.98 -0.87 132.00 132.26 1h2y h PRO 229 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1h2y h PRO 229 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1h2y h PRO 229 CO 0.60 0.00 -0.12 -0.25 -0.23 0.00 0.00 178.00 178.00 1h2y n ASP 230 N -4.04 1.10 -3.37 1.44 8.00 -1.26 -4.41 116.55 114.01 1h2y n ASP 230 Ca -0.01 -1.11 -0.26 0.00 0.71 0.00 0.00 54.79 54.12 1h2y n ASP 230 Cb 0.20 0.05 -0.09 0.00 -0.02 0.00 0.00 41.12 41.25 1h2y n ASP 230 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1h2y n GLU 231 N -0.36 0.34 -0.02 -1.24 -0.58 -0.33 -5.01 120.64 113.43 1h2y n GLU 231 Ca 0.16 -3.23 0.24 0.00 -0.42 0.00 0.00 57.16 53.91 1h2y n GLU 231 Cb 0.33 -1.61 0.71 0.00 -0.57 0.00 0.00 31.44 30.30 1h2y n GLU 231 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1h2y h PRO 232 N 5.31 0.00 0.00 3.49 0.11 -1.77 -1.59 132.00 137.55 1h2y h PRO 232 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1h2y h PRO 232 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1h2y h PRO 232 CO 0.40 0.00 -0.64 1.63 -0.21 0.00 0.00 178.00 179.18 1h2y n LYS 233 N -3.81 0.16 -2.05 1.05 5.02 -1.26 -0.92 118.16 116.34 1h2y n LYS 233 Ca 0.12 0.03 -0.40 0.00 -2.02 0.00 0.00 58.31 56.05 1h2y n LYS 233 Cb 0.82 -1.58 -0.01 0.00 -0.02 0.00 0.00 35.03 34.24 1h2y n LYS 233 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1h2y s TRP 234 N -3.10 2.85 -0.11 2.13 0.52 -0.60 -4.65 118.94 115.98 1h2y s TRP 234 Ca 0.08 1.39 -0.01 0.00 0.02 0.00 0.00 56.10 57.58 1h2y s TRP 234 Cb 0.15 -3.70 0.03 0.00 -1.15 0.00 0.00 33.47 28.81 1h2y s TRP 234 CO 0.73 -2.10 -0.02 -1.64 0.02 0.00 0.00 176.95 173.94 1h2y s MET 235 N -2.13 0.95 -0.30 4.98 -1.94 -0.39 -4.37 119.30 116.10 1h2y s MET 235 Ca 0.55 -0.15 -0.06 0.00 -1.71 0.00 0.00 55.69 54.32 1h2y s MET 235 Cb -0.39 -1.44 0.02 0.00 2.01 0.00 0.00 34.83 35.02 1h2y s MET 235 CO 0.51 -0.37 0.08 0.20 -0.01 0.00 0.00 175.02 175.43 1h2y s GLY 236 N 1.84 1.79 -0.14 -0.03 0.00 -1.26 -0.86 107.32 108.67 1h2y s GLY 236 Ca 0.03 -1.54 -0.07 0.00 0.00 0.00 0.00 44.72 43.15 1h2y s GLY 236 CO -0.07 0.67 0.12 -0.32 0.00 0.00 0.00 173.10 173.51 1h2y s GLY 237 N 1.46 2.10 0.16 0.20 0.00 -0.35 -4.68 107.32 106.21 1h2y s GLY 237 Ca 0.01 -0.67 0.05 0.00 0.00 0.00 0.00 44.72 44.11 1h2y s GLY 237 CO 0.02 -0.28 0.16 0.00 0.00 0.00 0.00 173.10 173.01 1h2y s ALA 238 N -0.68 3.64 -0.10 3.20 0.00 -1.26 -0.82 121.76 125.74 1h2y s ALA 238 Ca 0.13 -1.18 -0.23 0.00 0.00 0.00 0.00 51.96 50.69 1h2y s ALA 238 Cb -0.12 -1.44 0.05 0.00 0.00 0.00 0.00 23.12 21.61 1h2y s ALA 238 CO 0.03 0.51 0.54 -1.83 0.00 0.00 0.00 175.76 175.01 1h2y s GLU 239 N -3.11 0.81 0.02 0.00 -1.05 -0.72 -4.59 118.70 110.07 1h2y s GLU 239 Ca 0.32 0.33 -0.15 0.00 -0.15 0.00 0.00 54.97 55.32 1h2y s GLU 239 Cb -0.10 0.38 -0.06 0.00 -0.44 0.00 0.00 34.13 33.91 1h2y s GLU 239 CO 0.24 -0.20 0.43 -0.51 0.95 0.00 0.00 175.26 176.18 1h2y s LEU 240 N -0.69 4.46 0.87 1.83 2.01 -1.26 -0.11 118.68 125.80 1h2y s LEU 240 Ca -0.08 0.99 -0.11 0.00 0.01 0.00 0.00 54.13 54.94 1h2y s LEU 240 Cb -0.03 -2.70 0.12 0.00 0.01 0.00 0.00 46.19 43.60 1h2y s LEU 240 CO 0.05 0.29 1.15 -0.94 1.01 0.00 0.00 176.35 177.92 1h2y s SER 241 N -1.19 3.24 0.51 2.29 1.04 0.05 -4.85 113.70 114.80 1h2y s SER 241 Ca 0.26 2.19 0.22 0.00 0.48 0.00 0.00 55.95 59.09 1h2y s SER 241 Cb -0.17 -2.57 1.31 0.00 0.10 0.00 0.00 66.02 64.70 1h2y s SER 241 CO 0.15 -2.89 2.02 0.44 0.98 0.00 0.00 173.24 173.94 1h2y h ASP 242 N -1.58 0.06 -0.00 7.02 3.32 -1.92 -0.01 116.42 123.31 1h2y h ASP 242 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1h2y h ASP 242 Cb 1.27 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1h2y h ASP 242 CO 0.44 0.03 -0.01 -0.90 -1.72 0.00 0.00 179.24 177.08 1h2y n ASP 243 N -4.43 1.34 0.00 6.45 5.68 -1.26 -4.94 116.55 119.39 1h2y n ASP 243 Ca 0.07 -1.43 0.00 0.00 -0.50 0.00 0.00 54.79 52.93 1h2y n ASP 243 Cb 0.47 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 1h2y n ASP 243 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h2y n GLY 244 N 1.17 0.40 0.09 6.12 0.00 -0.02 -4.90 105.19 108.05 1h2y n GLY 244 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 1h2y n GLY 244 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1h2y h ARG 245 N 1.01 0.16 -6.64 1.61 2.43 -1.92 -3.43 114.38 107.60 1h2y h ARG 245 Ca 0.00 -0.28 -0.68 0.00 -0.81 0.00 0.00 59.98 58.21 1h2y h ARG 245 Cb 0.26 0.10 -0.27 0.00 -0.42 0.00 0.00 29.97 29.65 1h2y h ARG 245 CO 0.00 1.11 -0.88 0.71 -1.51 0.00 0.00 179.97 179.41 1h2y s TYR 246 N -2.67 2.25 -0.24 2.20 1.51 -1.26 -0.60 117.35 118.55 1h2y s TYR 246 Ca -0.03 -0.41 -0.10 0.00 -1.01 0.00 0.00 57.07 55.52 1h2y s TYR 246 Cb 0.08 -1.36 -0.05 0.00 -0.11 0.00 0.00 41.96 40.52 1h2y s TYR 246 CO 0.86 0.11 0.15 0.08 -1.11 0.00 0.00 175.55 175.63 1h2y s VAL 247 N -0.78 5.30 -0.20 0.71 1.01 -0.50 -0.77 120.40 125.17 1h2y s VAL 247 Ca 0.11 0.16 -0.06 0.00 0.00 0.00 0.00 61.98 62.19 1h2y s VAL 247 Cb -0.10 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 1h2y s VAL 247 CO 0.02 0.35 0.03 -0.76 0.00 0.00 0.00 175.10 174.75 1h2y s LEU 248 N 1.02 3.48 -0.25 3.92 1.43 0.85 -1.03 118.68 128.10 1h2y s LEU 248 Ca 0.07 -0.10 -0.06 0.00 -1.03 0.00 0.00 54.13 53.01 1h2y s LEU 248 Cb -0.13 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 1h2y s LEU 248 CO 0.04 0.09 0.04 -0.22 0.23 0.00 0.00 176.35 176.53 1h2y s LEU 249 N 0.87 3.36 -0.36 1.79 2.96 0.46 -1.75 118.68 126.01 1h2y s LEU 249 Ca 0.02 -0.32 -0.10 0.00 -0.22 0.00 0.00 54.13 53.51 1h2y s LEU 249 Cb -0.14 -1.87 0.03 0.00 0.50 0.00 0.00 46.19 44.70 1h2y s LEU 249 CO 0.02 -0.05 0.18 -0.44 -1.32 0.00 0.00 176.35 174.74 1h2y s SER 250 N 1.57 5.64 -0.24 3.68 0.01 -0.00 -1.36 113.70 123.00 1h2y s SER 250 Ca 0.06 -0.97 -0.10 0.00 1.31 0.00 0.00 55.95 56.24 1h2y s SER 250 Cb -0.15 -1.99 -0.05 0.00 0.21 0.00 0.00 66.02 64.03 1h2y s SER 250 CO 0.02 -0.36 0.16 -0.63 0.41 0.00 0.00 173.24 172.84 1h2y s ILE 251 N 1.53 5.36 0.19 1.44 1.01 -0.80 -1.21 121.20 128.72 1h2y s ILE 251 Ca 0.02 0.18 0.11 0.00 0.00 0.00 0.00 60.65 60.96 1h2y s ILE 251 Cb -0.19 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 1h2y s ILE 251 CO 0.06 0.35 -0.19 -0.13 0.00 0.00 0.00 174.94 175.03 1h2y s ARG 252 N 0.99 1.70 -0.29 2.79 0.52 -0.04 -1.32 118.95 123.30 1h2y s ARG 252 Ca 0.08 -1.43 -0.01 0.00 -0.52 0.00 0.00 55.73 53.84 1h2y s ARG 252 Cb -0.13 -1.95 0.13 0.00 0.52 0.00 0.00 34.95 33.52 1h2y s ARG 252 CO 0.04 0.41 0.28 -2.00 0.02 0.00 0.00 175.30 174.06 1h2y s GLU 253 N -2.70 0.31 0.00 3.54 2.12 -1.26 -1.26 118.70 119.45 1h2y s GLU 253 Ca 0.22 -0.14 0.00 0.00 0.36 0.00 0.00 54.97 55.41 1h2y s GLU 253 Cb -0.08 -0.71 0.00 0.00 0.26 0.00 0.00 34.13 33.60 1h2y s GLU 253 CO 0.11 -1.01 0.00 0.41 -0.54 0.00 0.00 175.26 174.24 1h2y n GLY 254 N 5.31 -1.67 0.70 -1.50 0.00 -1.26 -4.70 105.19 102.06 1h2y n GLY 254 Ca -0.02 -2.06 0.08 0.00 0.00 0.00 0.00 46.02 44.02 1h2y n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2y s ASP 256 N -1.20 5.50 -1.38 0.00 1.01 -1.26 -4.89 116.67 114.45 1h2y s ASP 256 Ca 0.22 2.27 -0.16 0.00 0.71 0.00 0.00 52.55 55.60 1h2y s ASP 256 Cb 0.14 -2.59 0.06 0.00 1.01 0.00 0.00 42.92 41.54 1h2y s ASP 256 CO 0.20 -1.38 1.98 -0.81 0.21 0.00 0.00 175.17 175.37 1h2y n PRO 257 N -1.41 3.03 -3.74 8.23 -0.04 -1.26 -4.82 135.00 135.00 1h2y n PRO 257 Ca 0.12 -2.95 -0.11 0.00 -0.04 0.00 0.00 63.50 60.52 1h2y n PRO 257 Cb 0.50 -3.39 -0.07 0.00 -0.04 0.00 0.00 33.50 30.50 1h2y n PRO 257 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1h2y s VAL 258 N 3.68 0.08 -0.10 0.52 -7.23 -1.26 -3.33 120.40 112.75 1h2y s VAL 258 Ca 0.50 -0.69 -0.30 0.00 -1.81 0.00 0.00 61.98 59.69 1h2y s VAL 258 Cb 0.09 -1.00 0.11 0.00 0.56 0.00 0.00 36.38 36.14 1h2y s VAL 258 CO -0.00 -0.38 0.89 0.54 -0.31 0.00 0.00 175.10 175.84 1h2y s ASN 259 N -2.20 -0.45 0.49 4.85 4.22 -0.36 -4.75 114.94 116.74 1h2y s ASN 259 Ca -0.03 0.43 -0.13 0.00 -2.14 0.00 0.00 52.86 50.98 1h2y s ASN 259 Cb -0.00 0.38 -0.07 0.00 1.28 0.00 0.00 41.25 42.85 1h2y s ASN 259 CO -0.05 -0.46 0.90 -0.13 -2.04 0.00 0.00 177.10 175.33 1h2y s ARG 260 N -1.44 3.81 -0.19 3.55 0.52 -0.44 -4.63 118.95 120.14 1h2y s ARG 260 Ca -0.03 0.71 -0.03 0.00 -0.52 0.00 0.00 55.73 55.86 1h2y s ARG 260 Cb -0.00 -2.23 0.06 0.00 0.52 0.00 0.00 34.95 33.29 1h2y s ARG 260 CO 0.02 -0.23 0.04 -1.17 0.02 0.00 0.00 175.30 173.98 1h2y s LEU 261 N -4.20 1.15 0.24 2.53 1.98 0.35 -1.91 118.68 118.82 1h2y s LEU 261 Ca 0.55 -0.79 0.09 0.00 -2.89 0.00 0.00 54.13 51.09 1h2y s LEU 261 Cb -0.10 -0.58 -0.04 0.00 0.66 0.00 0.00 46.19 46.12 1h2y s LEU 261 CO 0.35 -0.30 -0.04 0.26 -1.89 0.00 0.00 176.35 174.73 1h2y s TRP 262 N 1.87 2.66 0.05 5.38 0.51 -0.46 -1.24 118.94 127.70 1h2y s TRP 262 Ca -0.01 -0.23 -0.01 0.00 -2.12 0.00 0.00 56.10 53.74 1h2y s TRP 262 Cb -0.17 -1.21 -0.04 0.00 -0.81 0.00 0.00 33.47 31.24 1h2y s TRP 262 CO -0.08 0.60 -0.03 1.52 -0.51 0.00 0.00 176.95 178.45 1h2y s TYR 263 N -2.14 0.52 -0.11 -1.98 -0.85 -0.35 -0.40 117.35 112.04 1h2y s TYR 263 Ca 0.29 -1.04 -0.02 0.00 -0.52 0.00 0.00 57.07 55.79 1h2y s TYR 263 Cb -0.07 -0.39 0.04 0.00 0.38 0.00 0.00 41.96 41.92 1h2y s TYR 263 CO 0.18 -0.36 0.01 0.00 -1.52 0.00 0.00 175.55 173.86 1h2y s ASP 265 N 1.94 6.26 0.51 0.00 -1.08 -1.26 -1.41 116.67 121.63 1h2y s ASP 265 Ca 0.04 0.37 0.17 0.00 -0.52 0.00 0.00 52.55 52.61 1h2y s ASP 265 Cb -0.13 -2.55 1.25 0.00 -1.46 0.00 0.00 42.92 40.03 1h2y s ASP 265 CO -0.06 -1.58 2.11 -0.07 0.52 0.00 0.00 175.17 176.08 1h2y h LEU 266 N 12.58 0.05 -2.00 -1.34 3.38 -1.20 -0.31 115.31 126.49 1h2y h LEU 266 Ca -0.26 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1h2y h LEU 266 Cb 1.09 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1h2y h LEU 266 CO 1.16 0.04 -0.05 1.56 0.09 0.00 0.00 178.44 181.23 1h2y h GLN 267 N 0.06 0.00 -0.03 1.13 4.20 -1.90 -2.13 115.11 116.44 1h2y h GLN 267 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1h2y h GLN 267 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1h2y h GLN 267 CO -0.01 0.05 0.00 1.04 -0.67 0.00 0.00 178.83 179.25 1h2y n GLN 268 N -4.30 1.36 -2.41 1.46 1.13 -0.13 -4.87 117.38 109.62 1h2y n GLN 268 Ca -0.03 -0.53 -0.41 0.00 -1.94 0.00 0.00 57.00 54.09 1h2y n GLN 268 Cb 0.13 -1.45 -0.04 0.00 0.11 0.00 0.00 30.24 29.00 1h2y n GLN 268 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1h2y s GLU 269 N -1.97 4.52 0.43 -1.09 0.41 -0.80 -4.91 118.70 115.29 1h2y s GLU 269 Ca 0.39 1.83 0.14 0.00 -0.41 0.00 0.00 54.97 56.92 1h2y s GLU 269 Cb 0.20 -3.25 1.03 0.00 -1.78 0.00 0.00 34.13 30.33 1h2y s GLU 269 CO 0.32 -0.05 1.97 0.77 -0.49 0.00 0.00 175.26 177.78 1h2y h SER 270 N 5.24 0.37 0.00 -0.19 0.02 -1.90 -3.35 113.55 113.73 1h2y h SER 270 Ca -0.44 0.01 -0.21 0.00 -0.84 0.00 0.00 61.79 60.31 1h2y h SER 270 Cb 1.21 -0.07 -0.14 0.00 0.14 0.00 0.00 62.40 63.54 1h2y h SER 270 CO 0.74 0.22 -0.31 -3.20 -1.14 0.00 0.00 176.83 173.13 1h2y n ASN 271 N -4.47 -1.91 -0.14 3.07 5.15 -1.26 -5.15 115.26 110.55 1h2y n ASN 271 Ca 0.10 -2.60 0.00 0.00 -0.60 0.00 0.00 54.58 51.49 1h2y n ASN 271 Cb 0.39 1.18 0.00 0.00 -0.53 0.00 0.00 39.78 40.82 1h2y n ASN 271 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h2y n GLY 272 N -0.41 -1.60 3.53 8.20 0.00 -1.26 -4.60 105.19 109.05 1h2y n GLY 272 Ca -0.03 -1.30 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 1h2y n GLY 272 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h2y s ILE 273 N 0.00 4.08 0.00 -0.61 1.01 -1.26 -4.78 121.20 119.64 1h2y s ILE 273 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.96 1h2y s ILE 273 Cb 0.00 -4.73 0.00 0.00 0.01 0.00 0.00 42.46 37.74 1h2y s ILE 273 CO 0.00 -1.48 0.15 0.35 0.00 0.00 0.00 174.94 173.97 1h2y n THR 274 N 6.30 0.00 -0.43 2.92 -2.24 -1.26 -5.00 114.28 114.56 1h2y n THR 274 Ca 0.02 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1h2y n THR 274 Cb 0.48 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1h2y n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h2y n GLY 275 N 0.54 -0.72 3.67 3.38 0.00 -1.26 -4.93 105.19 105.87 1h2y n GLY 275 Ca 0.00 -0.42 -0.45 0.00 0.00 0.00 0.00 46.02 45.15 1h2y n GLY 275 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1h2y n ILE 276 N 2.05 0.57 -1.41 -0.61 2.08 -1.11 -4.44 119.36 116.49 1h2y n ILE 276 Ca 0.00 -0.10 -0.31 0.00 0.56 0.00 0.00 62.75 62.90 1h2y n ILE 276 Cb 0.00 -2.05 0.07 0.00 -0.75 0.00 0.00 39.64 36.92 1h2y n ILE 276 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1h2y s LEU 277 N 3.77 3.10 -1.37 1.39 1.43 -1.13 -4.93 118.68 120.95 1h2y s LEU 277 Ca 0.89 1.77 -0.15 0.00 -1.03 0.00 0.00 54.13 55.60 1h2y s LEU 277 Cb -0.57 -4.52 0.02 0.00 0.03 0.00 0.00 46.19 41.16 1h2y s LEU 277 CO 0.45 -1.80 2.13 0.29 0.23 0.00 0.00 176.35 177.66 1h2y n LYS 278 N -3.28 2.74 -2.10 1.70 5.02 -1.26 -4.96 118.16 116.02 1h2y n LYS 278 Ca 0.09 -2.61 -0.41 0.00 -2.02 0.00 0.00 58.31 53.35 1h2y n LYS 278 Cb 0.53 -3.29 -0.03 0.00 -0.02 0.00 0.00 35.03 32.23 1h2y n LYS 278 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1h2y s TRP 279 N 3.62 3.13 -0.25 2.13 0.52 -1.26 -4.65 118.94 122.19 1h2y s TRP 279 Ca 0.49 1.06 -0.07 0.00 0.02 0.00 0.00 56.10 57.61 1h2y s TRP 279 Cb 0.13 -3.74 -0.02 0.00 -1.15 0.00 0.00 33.47 28.69 1h2y s TRP 279 CO -0.04 -2.40 0.05 0.08 0.02 0.00 0.00 176.95 174.66 1h2y s VAL 280 N 0.21 4.17 -1.30 4.03 1.01 0.23 -4.94 120.40 123.80 1h2y s VAL 280 Ca 0.59 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 62.23 1h2y s VAL 280 Cb -0.40 -2.95 0.14 0.00 0.00 0.00 0.00 36.38 33.17 1h2y s VAL 280 CO 0.39 0.34 1.84 0.29 0.00 0.00 0.00 175.10 177.97 1h2y n LYS 281 N 4.91 3.40 0.02 2.72 5.02 -1.26 -1.22 118.16 131.74 1h2y n LYS 281 Ca -0.16 -3.41 -0.10 0.00 -2.02 0.00 0.00 58.31 52.62 1h2y n LYS 281 Cb 0.51 -3.06 -0.04 0.00 -0.02 0.00 0.00 35.03 32.43 1h2y n LYS 281 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1h2y h LEU 282 N 9.02 -0.71 -7.59 -0.35 5.85 -1.89 -3.34 115.31 116.30 1h2y h LEU 282 Ca 0.42 0.11 -0.63 0.00 0.84 0.00 0.00 57.88 58.61 1h2y h LEU 282 Cb 0.70 0.31 -0.39 0.00 0.37 0.00 0.00 40.66 41.65 1h2y h LEU 282 CO 1.58 -0.29 -0.75 -0.63 -0.34 0.00 0.00 178.44 178.01 1h2y s ILE 283 N -6.08 1.78 -0.64 4.05 -1.09 -0.37 -5.00 121.20 113.85 1h2y s ILE 283 Ca -0.15 -1.78 0.03 0.00 -2.23 0.00 0.00 60.65 56.51 1h2y s ILE 283 Cb 0.10 -2.20 0.37 0.00 -1.58 0.00 0.00 42.46 39.15 1h2y s ILE 283 CO 0.67 -0.42 1.40 -0.67 -1.23 0.00 0.00 174.94 174.68 1h2y n ASP 284 N 4.50 5.70 -3.45 3.58 2.03 -1.25 -0.50 116.55 127.17 1h2y n ASP 284 Ca -0.03 -3.74 -0.08 0.00 0.52 0.00 0.00 54.79 51.46 1h2y n ASP 284 Cb 0.43 -0.72 -0.00 0.00 -0.72 0.00 0.00 41.12 40.11 1h2y n ASP 284 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1h2y s ASN 285 N -2.64 -0.14 -0.43 1.67 2.20 -1.26 -5.07 114.94 109.27 1h2y s ASN 285 Ca 0.48 -0.84 0.04 0.00 -0.94 0.00 0.00 52.86 51.60 1h2y s ASN 285 Cb 0.36 0.77 0.47 0.00 -2.00 0.00 0.00 41.25 40.85 1h2y s ASN 285 CO -0.23 -1.48 1.56 0.49 -2.94 0.00 0.00 177.10 174.50 1h2y n PHE 286 N -0.49 2.67 0.23 1.54 3.72 -1.26 -3.54 117.46 120.33 1h2y n PHE 286 Ca -0.06 -2.41 0.12 0.00 -0.05 0.00 0.00 57.45 55.05 1h2y n PHE 286 Cb 0.59 -0.79 0.14 0.00 -0.94 0.00 0.00 39.48 38.49 1h2y n PHE 286 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1h2y h GLU 287 N 1.90 0.00 -3.32 -1.08 5.08 -1.97 -3.44 114.58 111.76 1h2y h GLU 287 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1h2y h GLU 287 Cb 1.33 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.50 1h2y h GLU 287 CO 1.01 0.00 0.05 0.20 -1.00 0.00 0.00 179.01 179.28 1h2y s GLY 288 N -4.18 0.17 -0.06 -3.84 0.00 -1.26 -4.88 107.32 93.26 1h2y s GLY 288 Ca 0.05 -0.53 -0.08 0.00 0.00 0.00 0.00 44.72 44.16 1h2y s GLY 288 CO 0.70 -0.34 0.22 1.85 0.00 0.00 0.00 173.10 175.53 1h2y s GLU 289 N -3.95 3.56 -0.29 2.90 2.12 -1.21 -1.23 118.70 120.60 1h2y s GLU 289 Ca 0.15 -0.02 -0.03 0.00 0.36 0.00 0.00 54.97 55.44 1h2y s GLU 289 Cb -0.03 -3.17 0.10 0.00 0.26 0.00 0.00 34.13 31.29 1h2y s GLU 289 CO 0.06 0.73 0.11 0.71 -0.54 0.00 0.00 175.26 176.33 1h2y s TYR 290 N -1.11 0.98 -0.37 5.30 2.02 -1.26 -3.44 117.35 119.47 1h2y s TYR 290 Ca 0.20 -1.25 -0.13 0.00 -0.37 0.00 0.00 57.07 55.52 1h2y s TYR 290 Cb -0.13 -1.27 0.01 0.00 -0.40 0.00 0.00 41.96 40.17 1h2y s TYR 290 CO 0.09 -0.83 0.25 0.34 -1.57 0.00 0.00 175.55 173.83 1h2y s ASP 291 N 1.87 5.94 0.18 2.29 2.15 0.12 -4.93 116.67 124.29 1h2y s ASP 291 Ca 0.09 -0.77 -0.33 0.00 0.43 0.00 0.00 52.55 51.96 1h2y s ASP 291 Cb -0.17 -2.10 -0.13 0.00 -0.30 0.00 0.00 42.92 40.22 1h2y s ASP 291 CO -0.29 -0.36 1.63 0.00 -0.17 0.00 0.00 175.17 175.98 1h2y n TYR 292 N 5.09 2.45 -0.05 -5.34 9.36 -1.26 -0.69 117.16 126.72 1h2y n TYR 292 Ca -0.12 0.19 -0.10 0.00 3.32 0.00 0.00 57.90 61.19 1h2y n TYR 292 Cb 0.48 -2.59 -0.03 0.00 -0.63 0.00 0.00 39.34 36.56 1h2y n TYR 292 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1h2y n VAL 293 N 3.58 1.10 -3.81 2.97 0.31 0.15 -4.88 118.33 117.76 1h2y n VAL 293 Ca 0.16 0.03 -0.01 0.00 -0.01 0.00 0.00 64.34 64.52 1h2y n VAL 293 Cb 0.31 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.39 1h2y n VAL 293 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1h2y s THR 294 N -2.38 0.00 0.04 2.52 -1.32 -1.15 -4.48 115.64 108.87 1h2y s THR 294 Ca -0.18 -0.45 -0.09 0.00 -1.21 0.00 0.00 61.69 59.75 1h2y s THR 294 Cb 0.05 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.56 1h2y s THR 294 CO 0.25 0.00 0.19 0.54 -2.21 0.00 0.00 174.62 173.39 1h2y s ASN 295 N -3.26 0.04 -0.29 8.08 4.22 -1.26 -0.36 114.94 122.10 1h2y s ASN 295 Ca 0.19 -0.39 -0.01 0.00 -2.14 0.00 0.00 52.86 50.51 1h2y s ASN 295 Cb -0.00 0.29 0.09 0.00 1.28 0.00 0.00 41.25 42.91 1h2y s ASN 295 CO 0.01 -0.57 0.08 -1.61 -2.04 0.00 0.00 177.10 172.98 1h2y s GLU 296 N -2.66 0.75 7.54 3.55 0.41 -0.34 -4.91 118.70 123.04 1h2y s GLU 296 Ca -0.04 -0.99 0.00 0.00 -0.41 0.00 0.00 54.97 53.53 1h2y s GLU 296 Cb -0.01 -2.03 0.00 0.00 -1.78 0.00 0.00 34.13 30.31 1h2y s GLU 296 CO -0.04 -0.93 0.00 0.41 -0.49 0.00 0.00 175.26 174.21 1h2y n GLY 297 N 4.87 2.87 0.49 -1.39 0.00 -1.26 -1.61 105.19 109.17 1h2y n GLY 297 Ca -0.03 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.89 1h2y n GLY 297 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h2y n THR 298 N 0.00 0.06 -3.18 2.61 -2.24 -1.26 -4.76 114.28 105.50 1h2y n THR 298 Ca 0.00 -0.27 -0.43 0.00 -2.27 0.00 0.00 64.05 61.08 1h2y n THR 298 Cb 0.00 0.45 -0.07 0.00 -2.10 0.00 0.00 70.33 68.60 1h2y n THR 298 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1h2y s VAL 299 N -1.94 4.92 -0.23 2.28 1.01 -0.63 -0.82 120.40 124.99 1h2y s VAL 299 Ca 0.37 -0.10 -0.10 0.00 0.00 0.00 0.00 61.98 62.15 1h2y s VAL 299 Cb 0.20 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1h2y s VAL 299 CO 0.32 -0.56 0.13 -0.36 0.00 0.00 0.00 175.10 174.63 1h2y s PHE 300 N 2.57 3.30 -0.24 5.22 0.40 0.52 -1.20 117.98 128.56 1h2y s PHE 300 Ca 0.18 0.17 -0.15 0.00 -0.60 0.00 0.00 56.93 56.53 1h2y s PHE 300 Cb -0.16 -2.22 -0.04 0.00 0.51 0.00 0.00 43.02 41.12 1h2y s PHE 300 CO 0.17 0.08 0.36 0.99 0.70 0.00 0.00 175.22 177.52 1h2y s THR 301 N 0.89 5.20 0.08 0.64 2.01 0.51 -0.19 115.64 124.78 1h2y s THR 301 Ca 0.07 0.58 0.08 0.00 0.31 0.00 0.00 61.69 62.73 1h2y s THR 301 Cb -0.13 -3.69 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 1h2y s THR 301 CO 0.03 0.21 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.60 1h2y s PHE 302 N 1.70 1.83 -0.06 4.92 0.08 0.12 -0.67 117.98 125.89 1h2y s PHE 302 Ca 0.16 -0.40 -0.18 0.00 0.12 0.00 0.00 56.93 56.62 1h2y s PHE 302 Cb -0.15 -1.03 -0.05 0.00 -0.57 0.00 0.00 43.02 41.22 1h2y s PHE 302 CO 0.09 0.17 0.50 0.21 -0.10 0.00 0.00 175.22 176.08 1h2y s LYS 303 N -1.63 4.26 0.08 0.44 2.20 0.13 -1.22 119.74 124.00 1h2y s LYS 303 Ca 0.07 0.53 -0.02 0.00 -0.36 0.00 0.00 55.97 56.19 1h2y s LYS 303 Cb -0.10 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.82 1h2y s LYS 303 CO 0.03 0.31 0.04 -0.08 -0.36 0.00 0.00 175.35 175.29 1h2y s THR 304 N 0.10 0.17 -0.05 3.43 -1.32 0.02 -0.71 115.64 117.28 1h2y s THR 304 Ca 0.27 -1.74 0.07 0.00 -1.21 0.00 0.00 61.69 59.08 1h2y s THR 304 Cb -0.16 -1.66 0.10 0.00 -1.51 0.00 0.00 72.50 69.27 1h2y s THR 304 CO 0.13 -0.77 1.04 -0.46 -2.21 0.00 0.00 174.62 172.34 1h2y n ASN 305 N 0.02 2.02 -4.59 8.08 0.23 -1.22 -1.14 115.26 118.65 1h2y n ASN 305 Ca -0.11 -2.35 -0.42 0.00 -0.53 0.00 0.00 54.58 51.17 1h2y n ASN 305 Cb 0.62 -0.16 -0.03 0.00 -2.08 0.00 0.00 39.78 38.14 1h2y n ASN 305 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1h2y s ARG 306 N -1.61 3.04 -1.37 -3.83 6.06 -1.26 -1.67 118.95 118.31 1h2y s ARG 306 Ca 0.11 1.72 -0.05 0.00 -2.50 0.00 0.00 55.73 55.01 1h2y s ARG 306 Cb 0.10 -4.35 0.03 0.00 0.06 0.00 0.00 34.95 30.79 1h2y s ARG 306 CO 0.01 -2.21 0.41 0.72 -2.50 0.00 0.00 175.30 171.74 1h2y n HIS 307 N 11.86 -1.74 -3.02 5.12 8.25 -1.26 -4.89 115.22 129.54 1h2y n HIS 307 Ca 0.28 0.38 -0.08 0.00 -0.26 0.00 0.00 57.72 58.04 1h2y n HIS 307 Cb 0.47 -3.53 -0.02 0.00 1.12 0.00 0.00 29.99 28.03 1h2y n HIS 307 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1h2y s SER 308 N -2.55 -0.71 0.55 0.41 1.04 -0.67 -5.03 113.70 106.74 1h2y s SER 308 Ca 0.27 -1.75 0.37 0.00 0.48 0.00 0.00 55.95 55.32 1h2y s SER 308 Cb -0.13 1.39 1.94 0.00 0.10 0.00 0.00 66.02 69.31 1h2y s SER 308 CO 0.33 -0.12 2.13 1.55 0.98 0.00 0.00 173.24 178.12 1h2y h PRO 309 N 5.72 0.00 -0.26 4.02 0.13 -1.91 -0.49 132.00 139.21 1h2y h PRO 309 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1h2y h PRO 309 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1h2y h PRO 309 CO 0.11 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 177.97 1h2y n ASN 310 N -2.85 2.68 -0.62 1.44 3.02 -1.26 -1.12 115.26 116.55 1h2y n ASN 310 Ca -0.02 -1.87 0.00 0.00 -0.03 0.00 0.00 54.58 52.66 1h2y n ASN 310 Cb 0.10 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1h2y n ASN 310 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1h2y n TYR 311 N 1.00 -1.71 -3.92 3.10 4.02 -0.19 -1.27 117.16 118.19 1h2y n TYR 311 Ca 0.18 0.92 -0.10 0.00 -0.01 0.00 0.00 57.90 58.89 1h2y n TYR 311 Cb 0.49 -1.74 -0.01 0.00 -0.02 0.00 0.00 39.34 38.06 1h2y n TYR 311 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 176.86 174.87 1h2y s ARG 312 N -4.58 1.98 -0.15 -0.72 1.70 -0.29 -4.31 118.95 112.58 1h2y s ARG 312 Ca 0.00 -1.43 -0.02 0.00 -0.47 0.00 0.00 55.73 53.81 1h2y s ARG 312 Cb 0.00 0.55 -0.02 0.00 -0.57 0.00 0.00 34.95 34.91 1h2y s ARG 312 CO 0.00 -0.88 -0.09 -0.51 -1.08 0.00 0.00 175.30 172.73 1h2y s LEU 313 N -3.09 2.89 0.14 -1.89 1.43 -0.28 -0.80 118.68 117.09 1h2y s LEU 313 Ca 0.20 -0.28 0.07 0.00 -1.03 0.00 0.00 54.13 53.10 1h2y s LEU 313 Cb -0.03 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 1h2y s LEU 313 CO 0.13 0.15 -0.17 0.27 0.23 0.00 0.00 176.35 176.96 1h2y s ILE 314 N 0.48 1.61 -0.19 -0.59 -4.36 -0.36 -0.95 121.20 116.83 1h2y s ILE 314 Ca -0.07 -1.81 -0.03 0.00 -0.26 0.00 0.00 60.65 58.48 1h2y s ILE 314 Cb -0.15 -1.70 -0.01 0.00 1.25 0.00 0.00 42.46 41.85 1h2y s ILE 314 CO 0.04 -0.34 -0.07 0.20 0.24 0.00 0.00 174.94 175.01 1h2y s ASN 315 N -2.54 4.26 -0.18 4.36 0.02 0.71 -0.70 114.94 120.88 1h2y s ASN 315 Ca 0.12 -0.35 -0.02 0.00 -1.02 0.00 0.00 52.86 51.60 1h2y s ASN 315 Cb -0.06 -1.71 -0.01 0.00 0.02 0.00 0.00 41.25 39.50 1h2y s ASN 315 CO 0.05 0.05 -0.10 -0.63 0.02 0.00 0.00 177.10 176.48 1h2y s ILE 316 N 1.07 3.05 -0.30 0.60 1.01 0.74 -1.51 121.20 125.86 1h2y s ILE 316 Ca 0.01 -0.63 -0.17 0.00 0.00 0.00 0.00 60.65 59.86 1h2y s ILE 316 Cb -0.15 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 1h2y s ILE 316 CO -0.01 0.48 0.47 -0.62 0.00 0.00 0.00 174.94 175.27 1h2y s ASP 317 N 0.97 6.34 0.65 3.58 -1.08 -1.26 -0.35 116.67 125.50 1h2y s ASP 317 Ca -0.01 0.25 0.37 0.00 -0.52 0.00 0.00 52.55 52.64 1h2y s ASP 317 Cb -0.15 -2.25 2.07 0.00 -1.46 0.00 0.00 42.92 41.13 1h2y s ASP 317 CO -0.01 -0.32 2.22 -0.26 0.52 0.00 0.00 175.17 177.32 1h2y h PHE 318 N 8.22 0.00 -0.00 -5.34 -1.00 -1.38 -0.07 116.94 117.36 1h2y h PHE 318 Ca -0.29 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.49 1h2y h PHE 318 Cb 1.14 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.70 1h2y h PHE 318 CO 0.74 0.00 -0.30 0.25 -1.61 0.00 0.00 178.31 177.40 1h2y n THR 319 N -3.25 0.00 -2.92 -1.55 -2.24 -1.26 -4.24 114.28 98.81 1h2y n THR 319 Ca -0.02 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 1h2y n THR 319 Cb 0.18 0.23 0.03 0.00 -2.10 0.00 0.00 70.33 68.67 1h2y n THR 319 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1h2y n ASP 320 N -0.99 -1.28 0.21 3.42 2.03 -0.13 -5.04 116.55 114.76 1h2y n ASP 320 Ca 0.10 -3.28 0.15 0.00 0.52 0.00 0.00 54.79 52.28 1h2y n ASP 320 Cb 0.33 0.87 0.69 0.00 -0.72 0.00 0.00 41.12 42.29 1h2y n ASP 320 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1h2y h PRO 321 N 3.38 0.00 -6.71 -0.67 0.13 -1.48 -3.39 132.00 123.26 1h2y h PRO 321 Ca -0.03 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.53 1h2y h PRO 321 Cb 1.02 0.00 0.10 0.00 0.13 0.00 0.00 31.00 32.24 1h2y h PRO 321 CO 0.32 0.00 0.61 0.39 -0.23 0.00 0.00 178.00 179.09 1h2y n GLU 322 N -2.59 2.20 -0.31 0.86 1.02 -1.26 -4.88 120.64 115.69 1h2y n GLU 322 Ca 0.00 0.78 0.12 0.00 -0.02 0.00 0.00 57.16 58.04 1h2y n GLU 322 Cb 0.17 -2.42 0.35 0.00 -0.02 0.00 0.00 31.44 29.52 1h2y n GLU 322 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1h2y h GLU 323 N 3.46 0.72 0.00 3.49 4.81 -1.99 0.13 114.58 125.21 1h2y h GLU 323 Ca -0.46 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1h2y h GLU 323 Cb 1.27 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 1h2y h GLU 323 CO 0.70 0.48 -0.01 0.66 -0.73 0.00 0.00 179.01 180.11 1h2y h SER 324 N 0.74 0.00 0.79 1.04 4.64 -1.97 -2.10 113.55 116.70 1h2y h SER 324 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1h2y h SER 324 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1h2y h SER 324 CO -0.25 0.01 -0.82 0.29 -0.87 0.00 0.00 176.83 175.19 1h2y n LYS 325 N -3.20 0.37 -1.67 4.77 4.76 0.03 -4.95 118.16 118.27 1h2y n LYS 325 Ca -0.02 0.07 -0.41 0.00 -2.87 0.00 0.00 58.31 55.08 1h2y n LYS 325 Cb 0.11 -1.70 0.01 0.00 -1.84 0.00 0.00 35.03 31.62 1h2y n LYS 325 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 1h2y n TRP 326 N -2.21 1.80 -4.09 2.13 8.01 -0.79 -4.95 117.44 117.34 1h2y n TRP 326 Ca 0.02 0.52 -0.36 0.00 -1.31 0.00 0.00 57.50 56.37 1h2y n TRP 326 Cb 0.47 -2.32 -0.08 0.00 -2.01 0.00 0.00 31.31 27.36 1h2y n TRP 326 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.69 176.83 1h2y s LYS 327 N -2.17 3.38 -0.44 -0.99 -0.14 -0.57 -4.94 119.74 113.87 1h2y s LYS 327 Ca 0.62 -0.28 -0.20 0.00 -1.36 0.00 0.00 55.97 54.75 1h2y s LYS 327 Cb -0.52 -3.05 0.03 0.00 -1.68 0.00 0.00 37.83 32.61 1h2y s LYS 327 CO 0.57 0.65 0.63 0.08 -0.76 0.00 0.00 175.35 176.51 1h2y s VAL 328 N -0.68 4.85 -0.11 3.17 1.01 -1.26 -0.20 120.40 127.17 1h2y s VAL 328 Ca 0.12 0.03 -0.27 0.00 0.00 0.00 0.00 61.98 61.86 1h2y s VAL 328 Cb -0.12 -4.20 -0.27 0.00 0.00 0.00 0.00 36.38 31.79 1h2y s VAL 328 CO 0.02 -0.60 0.85 0.25 0.00 0.00 0.00 175.10 175.62 1h2y h LEU 329 N 9.66 0.12 -7.28 3.92 5.85 -1.37 -3.43 115.31 122.77 1h2y h LEU 329 Ca -0.26 -0.94 -0.56 0.00 0.84 0.00 0.00 57.88 56.96 1h2y h LEU 329 Cb 1.10 -0.04 -0.40 0.00 0.37 0.00 0.00 40.66 41.69 1h2y h LEU 329 CO 0.89 1.05 -0.76 -0.69 -0.34 0.00 0.00 178.44 178.59 1h2y s VAL 330 N -2.45 0.87 0.86 1.05 1.01 -0.96 -4.37 120.40 116.42 1h2y s VAL 330 Ca -0.17 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 60.63 1h2y s VAL 330 Cb -0.02 -1.46 0.12 0.00 0.00 0.00 0.00 36.38 35.02 1h2y s VAL 330 CO 0.72 -0.41 1.17 -2.84 0.00 0.00 0.00 175.10 173.74 1h2y s PRO 331 N 1.66 1.33 0.31 2.72 0.02 -1.26 -1.12 135.00 138.66 1h2y s PRO 331 Ca 0.03 1.61 -0.29 0.00 0.02 0.00 0.00 61.00 62.37 1h2y s PRO 331 Cb -0.17 -1.76 -0.10 0.00 0.02 0.00 0.00 34.50 32.49 1h2y s PRO 331 CO -0.15 -2.41 1.35 -2.00 -0.33 0.00 0.00 177.00 173.45 1h2y s GLU 332 N -4.46 4.32 0.43 5.54 2.12 -1.26 -4.80 118.70 120.59 1h2y s GLU 332 Ca 0.69 2.25 -0.17 0.00 0.36 0.00 0.00 54.97 58.09 1h2y s GLU 332 Cb -0.25 -3.08 -0.09 0.00 0.26 0.00 0.00 34.13 30.97 1h2y s GLU 332 CO 0.55 -0.26 0.90 -1.58 -0.54 0.00 0.00 175.26 174.33 1h2y s HIS 333 N -0.82 3.38 0.40 5.30 5.65 -1.26 -4.98 115.29 122.96 1h2y s HIS 333 Ca 0.52 1.43 0.07 0.00 0.25 0.00 0.00 55.06 57.33 1h2y s HIS 333 Cb -0.40 -2.73 0.82 0.00 -1.18 0.00 0.00 32.58 29.09 1h2y s HIS 333 CO 0.51 -0.15 2.03 1.49 -0.65 0.00 0.00 174.74 177.97 1h2y h GLU 334 N 1.62 0.53 0.00 2.88 4.81 -1.99 -3.39 114.58 119.04 1h2y h GLU 334 Ca -0.48 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.71 1h2y h GLU 334 Cb 1.18 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.45 1h2y h GLU 334 CO 0.62 0.39 -0.12 1.17 -0.73 0.00 0.00 179.01 180.34 1h2y n LYS 335 N -4.44 0.29 -2.57 1.92 4.81 -1.26 -5.05 118.16 111.86 1h2y n LYS 335 Ca 0.03 0.00 -0.41 0.00 -0.87 0.00 0.00 58.31 57.06 1h2y n LYS 335 Cb 0.09 -0.56 -0.04 0.00 0.02 0.00 0.00 35.03 34.54 1h2y n LYS 335 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1h2y s ASP 336 N -1.97 7.34 -0.10 3.14 1.01 -1.26 -4.83 116.67 120.00 1h2y s ASP 336 Ca 0.00 2.03 -0.22 0.00 0.71 0.00 0.00 52.55 55.07 1h2y s ASP 336 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 1h2y s ASP 336 CO 0.00 -0.16 0.63 -0.69 0.21 0.00 0.00 175.17 175.16 1h2y s VAL 337 N -0.30 5.08 -0.59 -1.27 1.01 -0.86 -4.38 120.40 119.08 1h2y s VAL 337 Ca 0.48 1.27 -0.25 0.00 0.00 0.00 0.00 61.98 63.48 1h2y s VAL 337 Cb -0.28 -3.97 0.04 0.00 0.00 0.00 0.00 36.38 32.18 1h2y s VAL 337 CO 0.34 0.25 1.05 -0.22 0.00 0.00 0.00 175.10 176.53 1h2y s LEU 338 N 0.89 3.84 -0.05 3.92 2.96 -0.40 -0.66 118.68 129.18 1h2y s LEU 338 Ca 0.33 -0.31 -0.27 0.00 -0.22 0.00 0.00 54.13 53.67 1h2y s LEU 338 Cb -0.17 -2.84 -0.22 0.00 0.50 0.00 0.00 46.19 43.46 1h2y s LEU 338 CO 0.15 -1.40 1.14 -0.33 -1.32 0.00 0.00 176.35 174.59 1h2y h GLU 339 N 9.49 0.01 -3.14 1.98 5.08 -1.29 -3.45 114.58 123.26 1h2y h GLU 339 Ca -0.26 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1h2y h GLU 339 Cb 1.07 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.20 1h2y h GLU 339 CO 1.15 0.62 0.12 1.67 -1.00 0.00 0.00 179.01 181.57 1h2y s TRP 340 N -3.73 -0.37 0.00 4.33 1.48 -1.18 -5.03 118.94 114.44 1h2y s TRP 340 Ca -0.17 0.10 0.00 0.00 -1.06 0.00 0.00 56.10 54.98 1h2y s TRP 340 Cb 0.00 0.47 -0.00 0.00 -1.16 0.00 0.00 33.47 32.78 1h2y s TRP 340 CO 0.68 -0.85 -0.02 0.08 -4.06 0.00 0.00 176.95 172.79 1h2y s VAL 341 N -3.79 0.10 0.05 -0.66 1.01 -1.26 -1.66 120.40 114.18 1h2y s VAL 341 Ca 0.03 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 61.85 1h2y s VAL 341 Cb -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 36.38 36.23 1h2y s VAL 341 CO -0.10 -0.07 -0.12 0.00 0.00 0.00 0.00 175.10 174.82 1h2y s ALA 342 N -0.28 0.98 -0.15 5.51 0.00 -0.43 -4.91 121.76 122.48 1h2y s ALA 342 Ca -0.02 -0.82 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 1h2y s ALA 342 Cb -0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1h2y s ALA 342 CO -0.00 0.14 0.01 0.00 0.00 0.00 0.00 175.76 175.91 1h2y s VAL 344 N 0.02 0.13 -1.47 0.00 0.11 -0.32 -1.96 120.40 116.91 1h2y s VAL 344 Ca 0.03 -1.10 -0.07 0.00 -2.93 0.00 0.00 61.98 57.91 1h2y s VAL 344 Cb -0.13 -0.83 0.05 0.00 -1.53 0.00 0.00 36.38 33.95 1h2y s VAL 344 CO 0.02 -0.61 0.69 -1.14 -3.33 0.00 0.00 175.10 170.73 1h2y n ARG 345 N 0.88 -4.19 0.00 1.54 0.63 0.31 -1.75 116.66 114.08 1h2y n ARG 345 Ca -0.20 0.49 0.00 0.00 -0.92 0.00 0.00 57.85 57.23 1h2y n ARG 345 Cb 0.58 -5.02 0.00 0.00 0.45 0.00 0.00 32.46 28.47 1h2y n ARG 345 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1h2y n SER 346 N -2.90 0.00 -0.40 6.15 7.64 0.45 -4.09 113.62 120.47 1h2y n SER 346 Ca -0.15 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.81 1h2y n SER 346 Cb 0.61 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.98 1h2y n SER 346 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1h2y n ASN 347 N 1.65 2.37 -4.59 6.43 2.04 -1.24 -4.99 115.26 116.92 1h2y n ASN 347 Ca 0.00 -3.36 -0.30 0.00 -0.44 0.00 0.00 54.58 50.49 1h2y n ASN 347 Cb 0.00 -0.49 -0.10 0.00 -2.53 0.00 0.00 39.78 36.67 1h2y n ASN 347 CO 0.00 0.00 0.00 -0.36 -0.44 0.00 0.00 177.26 176.46 1h2y s PHE 348 N -3.00 2.78 -0.07 -2.53 0.08 -0.72 -0.96 117.98 113.57 1h2y s PHE 348 Ca 0.36 -0.13 0.03 0.00 0.12 0.00 0.00 56.93 57.30 1h2y s PHE 348 Cb 0.32 -1.46 0.01 0.00 -0.57 0.00 0.00 43.02 41.32 1h2y s PHE 348 CO 0.01 0.43 -0.15 -0.51 -0.10 0.00 0.00 175.22 174.89 1h2y s LEU 349 N -2.18 1.79 -0.28 -0.37 1.43 0.17 -1.17 118.68 118.06 1h2y s LEU 349 Ca 0.22 -0.36 -0.10 0.00 -1.03 0.00 0.00 54.13 52.86 1h2y s LEU 349 Cb -0.11 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 45.12 1h2y s LEU 349 CO 0.14 0.08 0.16 -0.69 0.23 0.00 0.00 176.35 176.27 1h2y s VAL 350 N 0.45 4.91 -0.13 -1.59 1.01 0.99 -0.07 120.40 125.97 1h2y s VAL 350 Ca -0.13 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 1h2y s VAL 350 Cb -0.15 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 1h2y s VAL 350 CO 0.04 0.21 -0.07 -0.76 0.00 0.00 0.00 175.10 174.52 1h2y s LEU 351 N 1.69 3.09 -0.20 3.92 1.43 0.39 -1.32 118.68 127.69 1h2y s LEU 351 Ca 0.06 -0.16 -0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1h2y s LEU 351 Cb -0.16 -1.72 -0.00 0.00 0.03 0.00 0.00 46.19 44.34 1h2y s LEU 351 CO 0.08 0.21 -0.10 0.00 0.23 0.00 0.00 176.35 176.77 1h2y s TYR 353 N 1.29 2.87 -0.27 0.00 2.02 -0.59 -0.79 117.35 121.87 1h2y s TYR 353 Ca 0.03 -0.15 -0.02 0.00 -0.37 0.00 0.00 57.07 56.57 1h2y s TYR 353 Cb -0.14 -1.34 0.04 0.00 -0.40 0.00 0.00 41.96 40.12 1h2y s TYR 353 CO -0.05 0.55 -0.03 -1.17 -1.57 0.00 0.00 175.55 173.27 1h2y s LEU 354 N -3.30 3.52 -0.31 -1.29 2.96 0.16 -1.28 118.68 119.14 1h2y s LEU 354 Ca 0.30 -1.06 -0.03 0.00 -0.22 0.00 0.00 54.13 53.11 1h2y s LEU 354 Cb -0.08 -1.68 0.04 0.00 0.50 0.00 0.00 46.19 44.97 1h2y s LEU 354 CO 0.20 -0.19 0.03 -2.28 -1.32 0.00 0.00 176.35 172.79 1h2y s HIS 355 N 1.29 3.24 -1.42 5.38 5.65 0.46 -2.03 115.29 127.86 1h2y s HIS 355 Ca -0.03 -1.70 -0.02 0.00 0.25 0.00 0.00 55.06 53.57 1h2y s HIS 355 Cb -0.18 -2.15 0.01 0.00 -1.18 0.00 0.00 32.58 29.08 1h2y s HIS 355 CO -0.03 -0.77 0.48 -0.25 -0.65 0.00 0.00 174.74 173.52 1h2y n ASP 356 N 4.69 -0.72 -1.52 9.88 8.00 -1.26 -1.46 116.55 134.16 1h2y n ASP 356 Ca -0.13 -0.98 -0.16 0.00 0.71 0.00 0.00 54.79 54.23 1h2y n ASP 356 Cb 0.44 -3.15 -0.03 0.00 -0.02 0.00 0.00 41.12 38.35 1h2y n ASP 356 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1h2y n VAL 357 N -4.40 -0.41 -4.39 2.53 0.31 -1.26 -5.00 118.33 105.70 1h2y n VAL 357 Ca -0.27 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 63.87 1h2y n VAL 357 Cb 0.67 -2.02 -0.14 0.00 -0.91 0.00 0.00 33.84 31.43 1h2y n VAL 357 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1h2y s LYS 358 N -4.13 0.82 0.40 5.55 1.02 -0.53 -4.46 119.74 118.42 1h2y s LYS 358 Ca 0.00 -0.45 -0.15 0.00 0.02 0.00 0.00 55.97 55.39 1h2y s LYS 358 Cb 0.00 -0.79 -0.09 0.00 -0.52 0.00 0.00 37.83 36.44 1h2y s LYS 358 CO 0.00 0.21 0.84 -0.80 -0.92 0.00 0.00 175.35 174.68 1h2y s ASN 359 N -0.46 6.72 0.04 2.83 0.02 -0.36 -0.40 114.94 123.33 1h2y s ASN 359 Ca 0.03 1.39 0.02 0.00 -1.02 0.00 0.00 52.86 53.28 1h2y s ASN 359 Cb -0.05 -2.42 -0.02 0.00 0.02 0.00 0.00 41.25 38.77 1h2y s ASN 359 CO -0.00 -0.36 -0.08 0.42 0.02 0.00 0.00 177.10 177.10 1h2y s THR 360 N -2.24 0.53 -0.02 1.60 -4.23 -0.40 -4.79 115.64 106.08 1h2y s THR 360 Ca 0.56 -1.11 0.03 0.00 -1.18 0.00 0.00 61.69 59.98 1h2y s THR 360 Cb -0.10 -0.64 0.00 0.00 1.34 0.00 0.00 72.50 73.10 1h2y s THR 360 CO 0.22 -0.41 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.05 1h2y s LEU 361 N -1.64 1.84 0.06 4.79 1.43 -1.26 -1.54 118.68 122.36 1h2y s LEU 361 Ca -0.09 -0.18 -0.14 0.00 -1.03 0.00 0.00 54.13 52.69 1h2y s LEU 361 Cb -0.09 -0.53 0.02 0.00 0.03 0.00 0.00 46.19 45.62 1h2y s LEU 361 CO 0.00 0.08 0.31 0.00 0.23 0.00 0.00 176.35 176.97 1h2y s GLN 362 N 0.10 0.86 -0.15 1.70 -2.07 -0.52 -1.16 119.66 118.42 1h2y s GLN 362 Ca -0.01 -0.58 -0.05 0.00 -1.82 0.00 0.00 55.36 52.89 1h2y s GLN 362 Cb -0.07 0.37 -0.04 0.00 -1.09 0.00 0.00 33.01 32.19 1h2y s GLN 362 CO 0.00 -0.29 0.02 -1.17 -1.32 0.00 0.00 175.29 172.54 1h2y s LEU 363 N -2.28 3.64 0.19 2.60 2.96 0.63 -0.46 118.68 125.95 1h2y s LEU 363 Ca -0.02 0.06 0.07 0.00 -0.22 0.00 0.00 54.13 54.02 1h2y s LEU 363 Cb 0.00 -1.89 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 1h2y s LEU 363 CO -0.06 0.24 -0.13 -1.00 -1.32 0.00 0.00 176.35 174.08 1h2y s HIS 364 N -0.02 1.60 0.05 5.38 3.76 0.89 -0.11 115.29 126.84 1h2y s HIS 364 Ca 0.04 -0.62 -0.26 0.00 -0.15 0.00 0.00 55.06 54.07 1h2y s HIS 364 Cb -0.13 -0.76 -0.05 0.00 1.11 0.00 0.00 32.58 32.76 1h2y s HIS 364 CO 0.02 0.29 0.82 0.34 -0.85 0.00 0.00 174.74 175.35 1h2y s ASP 365 N -3.25 7.26 0.15 1.40 2.15 -0.32 -0.66 116.67 123.41 1h2y s ASP 365 Ca 0.21 1.51 -0.12 0.00 0.43 0.00 0.00 52.55 54.58 1h2y s ASP 365 Cb -0.00 -2.50 0.02 0.00 -0.30 0.00 0.00 42.92 40.14 1h2y s ASP 365 CO 0.05 -0.03 1.60 0.25 -0.17 0.00 0.00 175.17 176.87 1h2y h LEU 366 N 5.83 0.88 -0.49 -1.34 5.85 -1.36 0.16 115.31 124.84 1h2y h LEU 366 Ca -0.43 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 57.95 1h2y h LEU 366 Cb 1.21 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 1h2y h LEU 366 CO 0.72 0.98 0.21 0.00 -0.34 0.00 0.00 178.44 180.01 1h2y h ALA 367 N 0.93 0.63 0.00 1.25 0.00 -1.94 -3.35 119.26 116.78 1h2y h ALA 367 Ca 0.14 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1h2y h ALA 367 Cb 0.54 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1h2y h ALA 367 CO 0.03 0.22 -1.69 0.25 0.00 0.00 0.00 179.25 178.06 1h2y n THR 368 N -4.59 0.32 -0.62 0.00 -2.24 -1.24 -5.00 114.28 100.91 1h2y n THR 368 Ca 0.02 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1h2y n THR 368 Cb 0.14 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1h2y n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h2y n GLY 369 N 1.94 0.81 3.77 3.38 0.00 0.57 -4.87 105.19 110.79 1h2y n GLY 369 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1h2y n GLY 369 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2y s ALA 370 N -3.23 3.26 0.18 4.61 0.00 -1.25 -4.60 121.76 120.72 1h2y s ALA 370 Ca 0.00 1.21 -0.30 0.00 0.00 0.00 0.00 51.96 52.86 1h2y s ALA 370 Cb 0.00 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.56 1h2y s ALA 370 CO 0.00 -0.79 1.35 -1.17 0.00 0.00 0.00 175.76 175.16 1h2y s LEU 371 N -2.40 4.40 -0.04 0.00 2.96 -1.26 -1.17 118.68 121.16 1h2y s LEU 371 Ca 0.56 2.42 0.01 0.00 -0.22 0.00 0.00 54.13 56.90 1h2y s LEU 371 Cb -0.37 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 42.68 1h2y s LEU 371 CO 0.48 -0.59 -0.03 0.18 -1.32 0.00 0.00 176.35 175.07 1h2y n LEU 372 N 2.97 2.34 -3.68 -0.68 4.77 0.84 -4.92 117.00 118.64 1h2y n LEU 372 Ca 0.08 -0.02 -0.14 0.00 -0.03 0.00 0.00 56.01 55.90 1h2y n LEU 372 Cb 0.42 -0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 41.32 1h2y n LEU 372 CO 0.58 0.47 0.23 -0.75 -1.33 0.00 0.00 177.39 176.60 1h2y s LYS 373 N -2.09 0.69 -0.19 3.23 2.47 -1.03 -4.98 119.74 117.84 1h2y s LYS 373 Ca -0.05 0.58 -0.05 0.00 -1.56 0.00 0.00 55.97 54.88 1h2y s LYS 373 Cb 0.02 0.33 -0.03 0.00 -1.46 0.00 0.00 37.83 36.69 1h2y s LYS 373 CO 0.12 -0.12 0.00 0.42 0.16 0.00 0.00 175.35 175.93 1h2y s ILE 374 N -0.09 4.06 -0.45 5.43 1.01 -1.26 -0.27 121.20 129.63 1h2y s ILE 374 Ca -0.03 -0.28 -0.20 0.00 0.00 0.00 0.00 60.65 60.14 1h2y s ILE 374 Cb -0.03 -2.82 0.03 0.00 0.01 0.00 0.00 42.46 39.64 1h2y s ILE 374 CO 0.02 0.45 0.60 -0.36 0.00 0.00 0.00 174.94 175.65 1h2y s PHE 375 N 0.77 3.08 0.28 3.97 0.08 -0.31 -5.00 117.98 120.84 1h2y s PHE 375 Ca 0.00 -0.20 -0.30 0.00 0.12 0.00 0.00 56.93 56.55 1h2y s PHE 375 Cb -0.14 -3.29 -0.11 0.00 -0.57 0.00 0.00 43.02 38.92 1h2y s PHE 375 CO 0.02 -0.87 1.51 -1.25 -0.10 0.00 0.00 175.22 174.53 1h2y s PRO 376 N 2.66 4.20 0.02 0.24 0.04 -1.26 -4.18 135.00 136.71 1h2y s PRO 376 Ca 0.19 2.44 -0.03 0.00 0.04 0.00 0.00 61.00 63.64 1h2y s PRO 376 Cb -0.15 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.31 1h2y s PRO 376 CO 0.17 -0.51 0.03 -0.51 0.04 0.00 0.00 177.00 176.22 1h2y s LEU 377 N -0.61 2.00 0.00 -3.56 1.43 -1.26 -5.07 118.68 111.61 1h2y s LEU 377 Ca 0.60 -0.44 -0.15 0.00 -1.03 0.00 0.00 54.13 53.10 1h2y s LEU 377 Cb -0.45 0.33 0.21 0.00 0.03 0.00 0.00 46.19 46.32 1h2y s LEU 377 CO 0.47 -0.36 1.19 -0.62 0.23 0.00 0.00 176.35 177.26 1h2y n GLU 378 N 1.39 -1.36 -2.22 1.70 -0.58 -1.26 -4.95 120.64 113.36 1h2y n GLU 378 Ca -0.23 -1.84 -0.43 0.00 -0.42 0.00 0.00 57.16 54.25 1h2y n GLU 378 Cb 0.56 -1.27 -0.02 0.00 -0.57 0.00 0.00 31.44 30.13 1h2y n GLU 378 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1h2y s VAL 379 N -3.56 3.88 -1.87 2.62 1.01 -1.26 -4.82 120.40 116.41 1h2y s VAL 379 Ca 0.68 1.03 0.00 0.00 0.00 0.00 0.00 61.98 63.69 1h2y s VAL 379 Cb -0.02 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1h2y s VAL 379 CO 0.48 -0.25 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1h2y n GLY 380 N 4.27 -0.69 3.17 4.51 0.00 -1.26 -4.75 105.19 110.43 1h2y n GLY 380 Ca 0.17 -0.43 -0.17 0.00 0.00 0.00 0.00 46.02 45.59 1h2y n GLY 380 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h2y s SER 381 N -4.00 1.57 -0.35 1.61 0.01 0.01 -1.23 113.70 111.32 1h2y s SER 381 Ca 0.00 -0.68 -0.14 0.00 1.31 0.00 0.00 55.95 56.44 1h2y s SER 381 Cb 0.00 -0.03 -0.01 0.00 0.21 0.00 0.00 66.02 66.19 1h2y s SER 381 CO 0.00 -0.14 0.29 -0.69 0.41 0.00 0.00 173.24 173.11 1h2y s VAL 382 N -1.65 5.24 -1.35 3.43 1.01 -1.26 -1.04 120.40 124.78 1h2y s VAL 382 Ca 0.00 -0.19 0.12 0.00 0.00 0.00 0.00 61.98 61.91 1h2y s VAL 382 Cb -0.08 -3.79 0.14 0.00 0.00 0.00 0.00 36.38 32.66 1h2y s VAL 382 CO 0.02 -0.09 0.96 1.33 0.00 0.00 0.00 175.10 177.32 1h2y n VAL 383 N 5.17 0.22 -3.63 2.92 0.24 0.12 -5.00 118.33 118.38 1h2y n VAL 383 Ca -0.11 -0.61 -0.15 0.00 -2.04 0.00 0.00 64.34 61.43 1h2y n VAL 383 Cb 0.49 1.08 -0.07 0.00 -1.47 0.00 0.00 33.84 33.87 1h2y n VAL 383 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1h2y s GLY 384 N -0.98 -0.38 -0.08 7.63 0.00 -1.21 -4.93 107.32 107.37 1h2y s GLY 384 Ca 0.16 0.77 -0.30 0.00 0.00 0.00 0.00 44.72 45.34 1h2y s GLY 384 CO 0.15 0.48 0.74 -0.47 0.00 0.00 0.00 173.10 174.00 1h2y s TYR 385 N -1.53 -0.61 -0.07 1.90 6.14 -1.26 -1.13 117.35 120.78 1h2y s TYR 385 Ca -0.11 1.08 -0.09 0.00 0.64 0.00 0.00 57.07 58.59 1h2y s TYR 385 Cb -0.02 0.41 0.02 0.00 0.42 0.00 0.00 41.96 42.79 1h2y s TYR 385 CO 0.05 -0.55 0.24 -1.54 0.64 0.00 0.00 175.55 174.40 1h2y s SER 386 N -1.08 -0.21 0.00 4.32 1.04 -0.25 -4.97 113.70 112.54 1h2y s SER 386 Ca -0.09 0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.68 1h2y s SER 386 Cb -0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1h2y s SER 386 CO 0.08 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.73 1h2y n GLY 387 N 2.48 1.44 4.00 7.32 0.00 -1.26 -2.15 105.19 117.02 1h2y n GLY 387 Ca -0.16 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 1h2y n GLY 387 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h2y s GLN 388 N 0.00 1.99 0.27 1.61 -0.21 -1.26 -4.48 119.66 117.57 1h2y s GLN 388 Ca 0.00 -1.23 -0.00 0.00 0.02 0.00 0.00 55.36 54.14 1h2y s GLN 388 Cb 0.00 -2.45 0.52 0.00 1.00 0.00 0.00 33.01 32.08 1h2y s GLN 388 CO 0.00 -1.16 1.80 -0.22 -2.12 0.00 0.00 175.29 173.59 1h2y h LYS 389 N -0.22 0.79 -0.00 2.91 3.64 -1.74 -1.00 116.57 120.95 1h2y h LYS 389 Ca -0.35 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1h2y h LYS 389 Cb 1.28 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1h2y h LYS 389 CO 0.42 0.52 -0.20 0.36 -2.27 0.00 0.00 179.45 178.28 1h2y n LYS 390 N -4.74 0.19 -2.36 1.90 2.85 -1.26 -0.41 118.16 114.33 1h2y n LYS 390 Ca 0.17 -0.07 -0.33 0.00 -1.05 0.00 0.00 58.31 57.04 1h2y n LYS 390 Cb 0.38 -1.50 -0.02 0.00 -0.65 0.00 0.00 35.03 33.23 1h2y n LYS 390 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1h2y s ASP 391 N -2.85 6.30 -0.15 -5.58 1.01 -0.38 -4.82 116.67 110.20 1h2y s ASP 391 Ca 0.17 1.76 0.17 0.00 0.71 0.00 0.00 52.55 55.37 1h2y s ASP 391 Cb 0.19 -2.53 0.42 0.00 1.01 0.00 0.00 42.92 42.00 1h2y s ASP 391 CO 0.57 -0.81 1.30 0.35 0.21 0.00 0.00 175.17 176.79 1h2y n THR 392 N -1.46 2.07 -3.62 -1.27 -2.24 -1.26 -0.53 114.28 105.97 1h2y n THR 392 Ca 0.08 -2.00 -0.10 0.00 -2.27 0.00 0.00 64.05 59.76 1h2y n THR 392 Cb 0.53 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.51 1h2y n THR 392 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1h2y s GLU 393 N -2.77 1.32 0.09 -0.78 -1.05 -1.26 -0.76 118.70 113.49 1h2y s GLU 393 Ca 0.37 -0.71 0.05 0.00 -0.15 0.00 0.00 54.97 54.52 1h2y s GLU 393 Cb 0.30 0.54 -0.03 0.00 -0.44 0.00 0.00 34.13 34.50 1h2y s GLU 393 CO 0.06 -0.56 -0.13 0.96 0.95 0.00 0.00 175.26 176.54 1h2y s ILE 394 N -3.82 1.09 0.02 1.83 -4.36 -0.57 -4.45 121.20 110.93 1h2y s ILE 394 Ca 0.05 -1.51 0.04 0.00 -0.26 0.00 0.00 60.65 58.97 1h2y s ILE 394 Cb -0.01 -1.27 -0.02 0.00 1.25 0.00 0.00 42.46 42.42 1h2y s ILE 394 CO -0.07 -0.39 -0.13 -0.36 0.24 0.00 0.00 174.94 174.22 1h2y s PHE 395 N -1.88 1.18 -0.08 1.37 0.40 -0.91 -1.29 117.98 116.76 1h2y s PHE 395 Ca 0.03 -0.29 -0.11 0.00 -0.60 0.00 0.00 56.93 55.96 1h2y s PHE 395 Cb -0.06 -0.73 0.03 0.00 0.51 0.00 0.00 43.02 42.77 1h2y s PHE 395 CO 0.02 0.01 0.29 1.52 0.70 0.00 0.00 175.22 177.76 1h2y s TYR 396 N -0.60 -0.28 -0.12 0.36 1.13 -0.70 -1.09 117.35 116.05 1h2y s TYR 396 Ca 0.03 0.63 -0.01 0.00 -1.41 0.00 0.00 57.07 56.31 1h2y s TYR 396 Cb -0.07 0.10 -0.03 0.00 -1.10 0.00 0.00 41.96 40.87 1h2y s TYR 396 CO 0.00 -0.22 -0.06 -1.14 -2.51 0.00 0.00 175.55 171.63 1h2y s GLN 397 N -0.25 3.26 0.01 -3.49 0.74 -0.28 -0.72 119.66 118.93 1h2y s GLN 397 Ca -0.04 -0.55 0.08 0.00 0.05 0.00 0.00 55.36 54.90 1h2y s GLN 397 Cb -0.03 -2.75 -0.03 0.00 1.10 0.00 0.00 33.01 31.30 1h2y s GLN 397 CO 0.01 0.41 -0.24 0.12 -0.55 0.00 0.00 175.29 175.05 1h2y s PHE 398 N -0.13 2.40 0.14 1.67 2.19 -0.07 -0.70 117.98 123.48 1h2y s PHE 398 Ca 0.02 -0.37 -0.04 0.00 0.33 0.00 0.00 56.93 56.87 1h2y s PHE 398 Cb -0.13 -1.47 -0.03 0.00 -1.31 0.00 0.00 43.02 40.08 1h2y s PHE 398 CO 0.03 0.08 0.12 -0.08 1.83 0.00 0.00 175.22 177.20 1h2y s THR 399 N -0.73 0.10 0.36 0.12 -1.32 -0.20 -1.32 115.64 112.64 1h2y s THR 399 Ca 0.11 -1.73 -0.10 0.00 -1.21 0.00 0.00 61.69 58.77 1h2y s THR 399 Cb -0.10 -1.94 0.03 0.00 -1.51 0.00 0.00 72.50 68.98 1h2y s THR 399 CO 0.01 -0.45 0.64 -0.94 -2.21 0.00 0.00 174.62 171.67 1h2y s SER 400 N -3.01 0.39 0.41 8.08 1.04 -1.16 -0.81 113.70 118.63 1h2y s SER 400 Ca 0.21 -1.26 0.09 0.00 0.48 0.00 0.00 55.95 55.46 1h2y s SER 400 Cb 0.06 0.76 0.85 0.00 0.10 0.00 0.00 66.02 67.79 1h2y s SER 400 CO 0.00 -1.49 1.99 -0.26 0.98 0.00 0.00 173.24 174.47 1h2y h PHE 401 N 2.06 0.35 -0.01 5.02 0.04 -1.86 -2.15 116.94 120.38 1h2y h PHE 401 Ca -0.30 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.46 1h2y h PHE 401 Cb 1.25 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 39.29 1h2y h PHE 401 CO 1.35 0.33 -0.29 1.28 -0.60 0.00 0.00 178.31 180.38 1h2y n LEU 402 N -4.38 1.26 -4.16 1.54 4.77 -1.26 -4.41 117.00 110.35 1h2y n LEU 402 Ca 0.01 -0.73 -0.29 0.00 -0.03 0.00 0.00 56.01 54.96 1h2y n LEU 402 Cb 0.17 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.09 1h2y n LEU 402 CO 0.37 0.25 -0.53 -0.94 -1.33 0.00 0.00 177.39 175.21 1h2y s SER 403 N -1.61 2.59 0.55 -1.43 1.04 -1.23 -4.64 113.70 108.98 1h2y s SER 403 Ca 0.09 -0.45 0.23 0.00 0.48 0.00 0.00 55.95 56.30 1h2y s SER 403 Cb 0.10 -1.04 1.53 0.00 0.10 0.00 0.00 66.02 66.70 1h2y s SER 403 CO 0.32 0.14 2.19 -0.65 0.98 0.00 0.00 173.24 176.22 1h2y h PRO 404 N 6.61 0.00 0.00 4.02 0.11 -1.85 -3.07 132.00 137.82 1h2y h PRO 404 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1h2y h PRO 404 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1h2y h PRO 404 CO 0.47 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.67 1h2y n GLY 405 N -1.44 3.75 3.13 -0.55 0.00 -1.26 -4.80 105.19 104.02 1h2y n GLY 405 Ca -0.02 -1.70 -0.23 0.00 0.00 0.00 0.00 46.02 44.07 1h2y n GLY 405 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h2y s ILE 406 N -2.35 1.22 -0.21 -0.61 1.01 -0.43 -3.70 121.20 116.14 1h2y s ILE 406 Ca 0.00 -0.66 -0.06 0.00 0.00 0.00 0.00 60.65 59.93 1h2y s ILE 406 Cb 0.00 -1.02 -0.03 0.00 0.01 0.00 0.00 42.46 41.42 1h2y s ILE 406 CO 0.00 0.35 0.02 -0.63 0.00 0.00 0.00 174.94 174.67 1h2y s ILE 407 N -0.36 4.10 0.21 2.92 1.01 0.27 -0.89 121.20 128.45 1h2y s ILE 407 Ca 0.06 -0.26 0.06 0.00 0.00 0.00 0.00 60.65 60.51 1h2y s ILE 407 Cb -0.06 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 1h2y s ILE 407 CO -0.01 0.42 0.15 -0.31 0.00 0.00 0.00 174.94 175.19 1h2y s TYR 408 N 1.03 3.10 0.01 3.97 2.02 0.10 0.04 117.35 127.62 1h2y s TYR 408 Ca 0.02 -0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.67 1h2y s TYR 408 Cb -0.14 -1.44 -0.01 0.00 -0.40 0.00 0.00 41.96 39.96 1h2y s TYR 408 CO 0.02 0.52 -0.07 -1.58 -1.57 0.00 0.00 175.55 172.88 1h2y s HIS 409 N -1.93 0.60 -0.09 2.71 5.65 0.22 -1.73 115.29 120.71 1h2y s HIS 409 Ca 0.32 -0.24 -0.03 0.00 0.25 0.00 0.00 55.06 55.35 1h2y s HIS 409 Cb -0.09 -0.37 0.05 0.00 -1.18 0.00 0.00 32.58 30.99 1h2y s HIS 409 CO 0.24 -0.03 0.16 0.00 -0.65 0.00 0.00 174.74 174.45 1h2y s ASP 411 N 2.29 6.73 0.00 0.00 -1.08 -1.26 -1.52 116.67 121.82 1h2y s ASP 411 Ca 0.03 0.65 0.28 0.00 -0.52 0.00 0.00 52.55 53.00 1h2y s ASP 411 Cb -0.12 -2.50 1.57 0.00 -1.46 0.00 0.00 42.92 40.40 1h2y s ASP 411 CO -0.06 -0.97 2.03 0.18 0.52 0.00 0.00 175.17 176.87 1h2y n LEU 412 N 7.06 0.33 0.03 -1.34 4.77 0.06 -3.29 117.00 124.63 1h2y n LEU 412 Ca 0.09 -0.12 0.13 0.00 -0.03 0.00 0.00 56.01 56.08 1h2y n LEU 412 Cb 0.48 -0.01 0.35 0.00 -2.33 0.00 0.00 43.42 41.92 1h2y n LEU 412 CO 0.62 0.06 0.62 0.35 -1.33 0.00 0.00 177.39 177.70 1h2y n THR 413 N -0.70 0.15 -2.88 -5.08 -2.24 -1.24 -4.85 114.28 97.44 1h2y n THR 413 Ca 0.21 -0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.49 1h2y n THR 413 Cb 0.15 -0.14 -0.05 0.00 -2.10 0.00 0.00 70.33 68.20 1h2y n THR 413 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1h2y s LYS 414 N -3.05 4.59 0.17 -0.78 -0.14 -1.21 -4.96 119.74 114.36 1h2y s LYS 414 Ca 0.11 1.23 -0.15 0.00 -1.36 0.00 0.00 55.97 55.80 1h2y s LYS 414 Cb 0.16 -3.36 0.13 0.00 -1.68 0.00 0.00 37.83 33.08 1h2y s LYS 414 CO 0.65 0.27 1.73 1.49 -0.76 0.00 0.00 175.35 178.73 1h2y h GLU 415 N 5.53 0.24 -4.67 1.68 4.57 -1.92 -3.32 114.58 116.70 1h2y h GLU 415 Ca -0.44 -0.01 -0.71 0.00 -1.18 0.00 0.00 59.36 57.02 1h2y h GLU 415 Cb 1.21 -0.06 -0.20 0.00 -0.16 0.00 0.00 28.75 29.54 1h2y h GLU 415 CO 0.71 0.16 -0.20 -1.21 -1.18 0.00 0.00 179.01 177.29 1h2y s GLU 416 N -6.15 3.05 -0.10 1.92 0.41 -1.26 -5.03 118.70 111.54 1h2y s GLU 416 Ca -0.13 -1.01 -0.30 0.00 -0.41 0.00 0.00 54.97 53.12 1h2y s GLU 416 Cb 0.14 -4.06 -0.02 0.00 -1.78 0.00 0.00 34.13 28.41 1h2y s GLU 416 CO 0.72 -1.00 1.16 -0.51 -0.49 0.00 0.00 175.26 175.14 1h2y s LEU 417 N 2.06 4.24 -0.29 1.80 1.43 -1.25 -5.00 118.68 121.67 1h2y s LEU 417 Ca 0.10 1.70 -0.03 0.00 -1.03 0.00 0.00 54.13 54.86 1h2y s LEU 417 Cb -0.20 -3.55 0.10 0.00 0.03 0.00 0.00 46.19 42.57 1h2y s LEU 417 CO 0.11 -0.60 0.12 -1.61 0.23 0.00 0.00 176.35 174.59 1h2y s GLU 418 N 2.53 0.31 0.37 1.70 2.02 -1.26 -5.12 118.70 119.25 1h2y s GLU 418 Ca 0.53 -0.65 -0.27 0.00 0.02 0.00 0.00 54.97 54.60 1h2y s GLU 418 Cb -0.22 -1.37 -0.10 0.00 0.10 0.00 0.00 34.13 32.54 1h2y s GLU 418 CO 0.18 -1.00 1.32 -1.25 0.02 0.00 0.00 175.26 174.53 1h2y s PRO 419 N 1.99 4.15 0.07 0.39 0.04 -1.26 -4.73 135.00 135.64 1h2y s PRO 419 Ca 0.09 2.22 0.05 0.00 0.04 0.00 0.00 61.00 63.40 1h2y s PRO 419 Cb -0.16 -2.91 -0.03 0.00 0.04 0.00 0.00 34.50 31.44 1h2y s PRO 419 CO -0.34 -0.37 -0.14 1.03 0.04 0.00 0.00 177.00 177.23 1h2y s ARG 420 N -2.04 0.81 0.07 4.56 0.52 0.12 -4.94 118.95 118.04 1h2y s ARG 420 Ca 0.53 -0.92 -0.31 0.00 -0.52 0.00 0.00 55.73 54.52 1h2y s ARG 420 Cb -0.40 -0.80 -0.08 0.00 0.52 0.00 0.00 34.95 34.20 1h2y s ARG 420 CO 0.52 0.18 1.59 0.08 0.02 0.00 0.00 175.30 177.69 1h2y s VAL 421 N -1.23 3.13 -0.22 3.52 1.01 -1.26 -0.61 120.40 124.74 1h2y s VAL 421 Ca -0.02 0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.62 1h2y s VAL 421 Cb -0.10 -3.39 -0.17 0.00 0.00 0.00 0.00 36.38 32.72 1h2y s VAL 421 CO 0.02 0.00 -0.12 0.33 0.00 0.00 0.00 175.10 175.33 1h2y n PHE 422 N 5.38 0.00 -3.74 5.22 7.35 0.11 -4.85 117.46 126.92 1h2y n PHE 422 Ca 0.15 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.71 1h2y n PHE 422 Cb 0.41 -0.90 -0.10 0.00 0.35 0.00 0.00 39.48 39.24 1h2y n PHE 422 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1h2y s ARG 423 N -2.46 0.52 -0.19 -4.13 6.06 -0.82 -5.00 118.95 112.93 1h2y s ARG 423 Ca -0.25 0.33 -0.17 0.00 -2.50 0.00 0.00 55.73 53.15 1h2y s ARG 423 Cb 0.07 0.24 0.05 0.00 0.06 0.00 0.00 34.95 35.38 1h2y s ARG 423 CO 0.60 -0.09 0.50 -2.00 -2.50 0.00 0.00 175.30 171.81 1h2y s GLU 424 N -0.23 0.58 -0.01 5.12 2.12 -1.26 -0.57 118.70 124.45 1h2y s GLU 424 Ca -0.04 0.70 0.01 0.00 0.36 0.00 0.00 54.97 56.00 1h2y s GLU 424 Cb -0.03 0.28 0.01 0.00 0.26 0.00 0.00 34.13 34.65 1h2y s GLU 424 CO 0.02 -0.07 -0.03 0.14 -0.54 0.00 0.00 175.26 174.78 1h2y s VAL 425 N 0.28 0.28 0.11 3.70 -7.23 -1.24 -5.08 120.40 111.22 1h2y s VAL 425 Ca -0.00 -0.09 0.08 0.00 -1.81 0.00 0.00 61.98 60.16 1h2y s VAL 425 Cb -0.04 -0.28 -0.04 0.00 0.56 0.00 0.00 36.38 36.59 1h2y s VAL 425 CO 0.00 0.11 -0.15 0.42 -0.31 0.00 0.00 175.10 175.18 1h2y s THR 426 N 0.30 3.07 -0.39 5.32 -4.23 -1.26 -4.39 115.64 114.07 1h2y s THR 426 Ca -0.03 -1.40 -0.18 0.00 -1.18 0.00 0.00 61.69 58.90 1h2y s THR 426 Cb -0.06 -2.42 0.01 0.00 1.34 0.00 0.00 72.50 71.37 1h2y s THR 426 CO -0.01 0.11 0.48 -0.69 -0.54 0.00 0.00 174.62 173.97 1h2y s VAL 427 N -1.17 5.03 -0.22 2.29 1.01 -1.26 -5.02 120.40 121.06 1h2y s VAL 427 Ca 0.19 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 1h2y s VAL 427 Cb -0.11 -4.02 -0.01 0.00 0.00 0.00 0.00 36.38 32.24 1h2y s VAL 427 CO 0.12 -0.36 1.40 -0.54 0.00 0.00 0.00 175.10 175.72 1h2y s LYS 428 N 2.30 4.00 0.00 2.72 1.02 -1.26 -2.86 119.74 125.66 1h2y s LYS 428 Ca 0.15 1.55 0.00 0.00 0.02 0.00 0.00 55.97 57.70 1h2y s LYS 428 Cb -0.16 -3.89 0.00 0.00 -0.52 0.00 0.00 37.83 33.26 1h2y s LYS 428 CO 0.14 -1.02 0.00 0.41 -0.92 0.00 0.00 175.35 173.96 1h2y n GLY 429 N 4.18 1.38 2.92 -3.33 0.00 -1.26 -4.89 105.19 104.18 1h2y n GLY 429 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1h2y n GLY 429 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h2y s ILE 430 N -0.71 1.90 -0.74 -0.61 -1.09 -1.14 -5.06 121.20 113.76 1h2y s ILE 430 Ca 0.00 -2.24 -0.26 0.00 -2.23 0.00 0.00 60.65 55.92 1h2y s ILE 430 Cb 0.00 -2.39 0.04 0.00 -1.58 0.00 0.00 42.46 38.52 1h2y s ILE 430 CO 0.00 -0.66 1.23 -0.62 -1.23 0.00 0.00 174.94 173.66 1h2y s ASP 431 N 0.90 6.18 0.57 3.58 2.15 -1.26 -4.76 116.67 124.03 1h2y s ASP 431 Ca 0.12 -0.59 0.30 0.00 0.43 0.00 0.00 52.55 52.81 1h2y s ASP 431 Cb -0.20 -2.54 1.45 0.00 -0.30 0.00 0.00 42.92 41.33 1h2y s ASP 431 CO -0.11 -1.75 1.84 0.00 -0.17 0.00 0.00 175.17 174.98 1h2y h ALA 432 N 9.93 2.52 0.00 3.66 0.00 -1.93 -0.70 119.26 132.74 1h2y h ALA 432 Ca -0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1h2y h ALA 432 Cb 1.05 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1h2y h ALA 432 CO 1.27 -0.98 0.00 -1.13 0.00 0.00 0.00 179.25 178.41 1h2y n SER 433 N -3.88 0.20 0.01 0.00 3.41 -1.26 -2.11 113.62 109.99 1h2y n SER 433 Ca 0.14 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.43 1h2y n SER 433 Cb 0.87 -0.59 0.48 0.00 -0.26 0.00 0.00 64.21 64.71 1h2y n SER 433 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1h2y n ASP 434 N -1.72 0.22 -4.53 4.04 8.00 -0.27 -4.90 116.55 117.40 1h2y n ASP 434 Ca 0.04 0.27 -0.25 0.00 0.71 0.00 0.00 54.79 55.56 1h2y n ASP 434 Cb 0.22 -0.27 -0.11 0.00 -0.02 0.00 0.00 41.12 40.95 1h2y n ASP 434 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1h2y s TYR 435 N -3.01 2.27 0.01 1.24 2.02 -0.90 -0.95 117.35 118.03 1h2y s TYR 435 Ca 0.13 -0.65 -0.04 0.00 -0.37 0.00 0.00 57.07 56.13 1h2y s TYR 435 Cb 0.18 -1.42 -0.01 0.00 -0.40 0.00 0.00 41.96 40.32 1h2y s TYR 435 CO 0.59 0.40 0.08 1.14 -1.57 0.00 0.00 175.55 176.19 1h2y s GLN 436 N -3.70 0.39 -0.13 -0.62 -2.07 -0.74 -4.80 119.66 107.98 1h2y s GLN 436 Ca 0.33 -0.42 0.01 0.00 -1.82 0.00 0.00 55.36 53.45 1h2y s GLN 436 Cb 0.06 0.16 -0.01 0.00 -1.09 0.00 0.00 33.01 32.12 1h2y s GLN 436 CO 0.16 -0.08 -0.15 0.99 -1.32 0.00 0.00 175.29 174.88 1h2y s THR 437 N -1.28 2.82 0.07 3.63 2.01 -1.26 -2.22 115.64 119.41 1h2y s THR 437 Ca -0.14 -0.74 0.07 0.00 0.31 0.00 0.00 61.69 61.20 1h2y s THR 437 Cb -0.08 -2.17 -0.03 0.00 0.01 0.00 0.00 72.50 70.23 1h2y s THR 437 CO 0.01 0.53 -0.20 0.68 -0.69 0.00 0.00 174.62 174.95 1h2y s VAL 438 N 0.45 1.58 -0.15 3.82 -7.23 -0.01 -4.96 120.40 113.91 1h2y s VAL 438 Ca -0.11 -1.33 0.01 0.00 -1.81 0.00 0.00 61.98 58.74 1h2y s VAL 438 Cb -0.16 -1.42 -0.00 0.00 0.56 0.00 0.00 36.38 35.36 1h2y s VAL 438 CO 0.05 0.04 -0.16 -1.58 -0.31 0.00 0.00 175.10 173.14 1h2y s GLN 439 N -1.52 3.22 0.29 4.82 0.74 -1.26 -0.56 119.66 125.38 1h2y s GLN 439 Ca 0.06 -0.75 0.07 0.00 0.05 0.00 0.00 55.36 54.78 1h2y s GLN 439 Cb -0.09 -2.60 -0.06 0.00 1.10 0.00 0.00 33.01 31.36 1h2y s GLN 439 CO 0.03 0.05 -0.06 0.96 -0.55 0.00 0.00 175.29 175.72 1h2y s ILE 440 N 0.73 1.70 -0.15 -2.34 -5.25 -0.44 -4.98 121.20 110.47 1h2y s ILE 440 Ca -0.07 -2.13 0.00 0.00 -0.99 0.00 0.00 60.65 57.47 1h2y s ILE 440 Cb -0.16 -2.50 0.03 0.00 2.95 0.00 0.00 42.46 42.79 1h2y s ILE 440 CO 0.01 -0.27 -0.10 -0.36 -1.79 0.00 0.00 174.94 172.43 1h2y s PHE 441 N -2.97 1.97 0.05 1.37 0.40 -1.26 -1.14 117.98 116.39 1h2y s PHE 441 Ca 0.30 -1.16 0.05 0.00 -0.60 0.00 0.00 56.93 55.53 1h2y s PHE 441 Cb 0.04 -1.47 -0.04 0.00 0.51 0.00 0.00 43.02 42.07 1h2y s PHE 441 CO 0.13 -0.64 -0.09 1.52 0.70 0.00 0.00 175.22 176.84 1h2y s TYR 442 N 1.55 2.81 0.11 0.36 -0.85 -0.25 -4.82 117.35 116.26 1h2y s TYR 442 Ca 0.03 -0.10 -0.29 0.00 -0.52 0.00 0.00 57.07 56.18 1h2y s TYR 442 Cb -0.14 -1.53 -0.06 0.00 0.38 0.00 0.00 41.96 40.61 1h2y s TYR 442 CO -0.09 0.38 0.94 -1.25 -1.52 0.00 0.00 175.55 174.01 1h2y s PRO 443 N -1.74 4.68 0.33 -3.49 0.04 -1.26 -0.41 135.00 133.14 1h2y s PRO 443 Ca 0.19 1.41 -0.04 0.00 0.04 0.00 0.00 61.00 62.59 1h2y s PRO 443 Cb -0.11 -3.37 0.07 0.00 0.04 0.00 0.00 34.50 31.13 1h2y s PRO 443 CO 0.10 0.23 0.45 0.45 0.04 0.00 0.00 177.00 178.27 1h2y n SER 444 N 2.76 0.16 -0.21 6.66 2.88 0.63 -4.86 113.62 121.64 1h2y n SER 444 Ca 0.02 -1.24 0.01 0.00 -1.33 0.00 0.00 58.87 56.33 1h2y n SER 444 Cb 0.49 -0.33 0.12 0.00 -0.75 0.00 0.00 64.21 63.75 1h2y n SER 444 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1h2y h LYS 445 N 0.00 0.30 -0.18 -1.46 1.57 -1.88 -0.50 116.57 114.43 1h2y h LYS 445 Ca -0.15 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1h2y h LYS 445 Cb 0.43 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1h2y h LYS 445 CO 0.11 0.20 0.00 -0.40 -0.57 0.00 0.00 179.45 178.80 1h2y n ASP 446 N -5.09 1.08 0.00 0.86 5.68 -1.26 -4.90 116.55 112.92 1h2y n ASP 446 Ca 0.10 -1.87 0.00 0.00 -0.50 0.00 0.00 54.79 52.52 1h2y n ASP 446 Cb 0.34 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 1h2y n ASP 446 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h2y n GLY 447 N 0.88 1.66 3.73 6.12 0.00 -0.20 -5.03 105.19 112.35 1h2y n GLY 447 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1h2y n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h2y s THR 448 N -2.36 2.20 -0.11 2.61 2.01 -1.26 -4.48 115.64 114.25 1h2y s THR 448 Ca 0.00 0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.86 1h2y s THR 448 Cb 0.00 -3.09 -0.01 0.00 0.01 0.00 0.00 72.50 69.40 1h2y s THR 448 CO 0.00 0.01 0.97 -0.54 -0.69 0.00 0.00 174.62 174.38 1h2y s LYS 449 N 0.85 4.41 -0.11 4.92 -0.14 -1.26 -0.27 119.74 128.14 1h2y s LYS 449 Ca 0.71 1.32 0.00 0.00 -1.36 0.00 0.00 55.97 56.65 1h2y s LYS 449 Cb -0.48 -3.54 -0.02 0.00 -1.68 0.00 0.00 37.83 32.11 1h2y s LYS 449 CO 0.35 -0.29 -0.12 0.42 -0.76 0.00 0.00 175.35 174.94 1h2y s ILE 450 N 1.95 3.17 0.49 2.17 -1.09 0.45 -4.89 121.20 123.45 1h2y s ILE 450 Ca 0.47 -0.64 -0.19 0.00 -2.23 0.00 0.00 60.65 58.06 1h2y s ILE 450 Cb -0.18 -2.31 -0.08 0.00 -1.58 0.00 0.00 42.46 38.30 1h2y s ILE 450 CO 0.18 0.54 1.02 -2.84 -1.23 0.00 0.00 174.94 172.61 1h2y s PRO 451 N 0.05 3.82 -0.18 2.79 0.02 -1.26 -1.09 135.00 139.15 1h2y s PRO 451 Ca -0.04 1.26 -0.11 0.00 0.02 0.00 0.00 61.00 62.13 1h2y s PRO 451 Cb -0.14 -2.10 0.06 0.00 0.02 0.00 0.00 34.50 32.33 1h2y s PRO 451 CO 0.04 -0.40 0.45 1.41 -0.33 0.00 0.00 177.00 178.17 1h2y s MET 452 N -3.41 0.44 0.01 5.54 1.75 -0.29 -0.69 119.30 122.65 1h2y s MET 452 Ca 0.65 0.83 -0.13 0.00 -1.25 0.00 0.00 55.69 55.79 1h2y s MET 452 Cb -0.14 0.02 -0.06 0.00 2.84 0.00 0.00 34.83 37.49 1h2y s MET 452 CO 0.22 -0.15 0.38 -0.06 -0.65 0.00 0.00 175.02 174.76 1h2y s PHE 453 N 1.32 3.68 -0.04 4.11 0.08 -0.57 -1.33 117.98 125.23 1h2y s PHE 453 Ca -0.09 0.89 0.02 0.00 0.12 0.00 0.00 56.93 57.87 1h2y s PHE 453 Cb -0.07 -2.21 0.01 0.00 -0.57 0.00 0.00 43.02 40.17 1h2y s PHE 453 CO -0.12 0.62 -0.08 0.42 -0.10 0.00 0.00 175.22 175.96 1h2y s ILE 454 N -1.16 0.77 -0.12 0.64 1.01 0.27 -1.58 121.20 121.03 1h2y s ILE 454 Ca 0.25 -0.30 0.03 0.00 0.00 0.00 0.00 60.65 60.63 1h2y s ILE 454 Cb -0.15 -0.73 0.01 0.00 0.01 0.00 0.00 42.46 41.60 1h2y s ILE 454 CO 0.14 0.26 -0.20 -0.69 0.00 0.00 0.00 174.94 174.45 1h2y s VAL 455 N 0.58 1.83 0.21 2.92 1.01 0.30 -0.83 120.40 126.42 1h2y s VAL 455 Ca -0.09 -0.86 -0.16 0.00 0.00 0.00 0.00 61.98 60.87 1h2y s VAL 455 Cb -0.13 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.64 1h2y s VAL 455 CO 0.01 0.51 0.52 -1.38 0.00 0.00 0.00 175.10 174.76 1h2y s HIS 456 N 0.75 0.01 0.31 5.22 -3.43 -0.94 -1.25 115.29 115.95 1h2y s HIS 456 Ca -0.10 -0.37 -0.29 0.00 -0.80 0.00 0.00 55.06 53.50 1h2y s HIS 456 Cb -0.16 0.36 -0.10 0.00 -1.43 0.00 0.00 32.58 31.25 1h2y s HIS 456 CO 0.01 -0.96 1.29 0.21 -2.00 0.00 0.00 174.74 173.29 1h2y s LYS 457 N -3.91 4.39 0.51 -0.38 2.20 -1.26 -1.79 119.74 119.48 1h2y s LYS 457 Ca 0.13 2.15 -0.23 0.00 -0.36 0.00 0.00 55.97 57.66 1h2y s LYS 457 Cb -0.01 -3.10 -0.06 0.00 -1.51 0.00 0.00 37.83 33.15 1h2y s LYS 457 CO 0.01 -0.16 1.36 0.15 -0.36 0.00 0.00 175.35 176.35 1h2y s LYS 458 N -1.47 3.38 -0.16 4.03 1.02 -0.13 -3.43 119.74 122.99 1h2y s LYS 458 Ca 0.50 2.24 0.00 0.00 0.02 0.00 0.00 55.97 58.73 1h2y s LYS 458 Cb -0.39 -2.40 0.00 0.00 -0.52 0.00 0.00 37.83 34.52 1h2y s LYS 458 CO 0.49 -1.00 0.00 0.41 -0.92 0.00 0.00 175.35 174.33 1h2y n GLY 459 N 0.66 0.51 3.79 -3.33 0.00 -1.26 -5.02 105.19 100.53 1h2y n GLY 459 Ca 0.08 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 1h2y n GLY 459 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h2y s ILE 460 N -1.91 3.54 -0.15 -0.61 -4.36 -1.22 -5.01 121.20 111.48 1h2y s ILE 460 Ca 0.00 0.76 -0.17 0.00 -0.26 0.00 0.00 60.65 60.99 1h2y s ILE 460 Cb 0.00 -3.28 -0.04 0.00 1.25 0.00 0.00 42.46 40.39 1h2y s ILE 460 CO 0.00 -0.40 0.43 -0.75 0.24 0.00 0.00 174.94 174.46 1h2y s LYS 461 N -3.93 4.28 -1.46 0.37 2.20 -1.26 -4.98 119.74 114.96 1h2y s LYS 461 Ca 0.66 0.32 -0.12 0.00 -0.36 0.00 0.00 55.97 56.47 1h2y s LYS 461 Cb -0.18 -3.46 0.04 0.00 -1.51 0.00 0.00 37.83 32.71 1h2y s LYS 461 CO 0.36 0.12 2.30 1.28 -0.36 0.00 0.00 175.35 179.05 1h2y n LEU 462 N 3.88 7.18 -1.03 5.43 4.77 -1.26 -4.54 117.00 131.43 1h2y n LEU 462 Ca -0.08 -4.27 0.09 0.00 -0.03 0.00 0.00 56.01 51.71 1h2y n LEU 462 Cb 0.51 -1.61 0.25 0.00 -2.33 0.00 0.00 43.42 40.24 1h2y n LEU 462 CO 0.42 1.33 0.71 -0.90 -1.33 0.00 0.00 177.39 177.62 1h2y n ASP 463 N 5.24 3.56 0.00 -1.43 5.68 -1.04 -4.44 116.55 124.11 1h2y n ASP 463 Ca 0.55 -2.08 0.00 0.00 -0.50 0.00 0.00 54.79 52.76 1h2y n ASP 463 Cb 0.36 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1h2y n ASP 463 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1h2y n GLY 464 N 1.00 0.41 0.27 6.12 0.00 0.76 -4.91 105.19 108.84 1h2y n GLY 464 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 1h2y n GLY 464 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1h2y n SER 465 N -0.25 0.97 -4.83 1.61 3.41 -1.26 -3.21 113.62 110.06 1h2y n SER 465 Ca 0.00 -0.99 -0.38 0.00 -0.26 0.00 0.00 58.87 57.24 1h2y n SER 465 Cb 0.12 0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 1h2y n SER 465 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1h2y s HIS 466 N -2.32 3.70 0.44 7.33 3.76 -1.25 -5.00 115.29 121.96 1h2y s HIS 466 Ca 0.31 0.94 -0.23 0.00 -0.15 0.00 0.00 55.06 55.93 1h2y s HIS 466 Cb 0.20 -2.29 -0.08 0.00 1.11 0.00 0.00 32.58 31.52 1h2y s HIS 466 CO 0.45 0.60 1.12 -1.25 -0.85 0.00 0.00 174.74 174.80 1h2y s PRO 467 N -0.90 3.89 0.07 8.40 0.04 -1.26 -4.31 135.00 140.94 1h2y s PRO 467 Ca 0.23 1.65 0.05 0.00 0.04 0.00 0.00 61.00 62.98 1h2y s PRO 467 Cb -0.16 -2.42 -0.03 0.00 0.04 0.00 0.00 34.50 31.92 1h2y s PRO 467 CO 0.12 -0.41 -0.15 0.00 0.04 0.00 0.00 177.00 176.61 1h2y s ALA 468 N -1.62 1.24 -0.26 8.56 0.00 -0.70 -0.95 121.76 128.02 1h2y s ALA 468 Ca 0.62 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 51.57 1h2y s ALA 468 Cb -0.25 -0.11 0.07 0.00 0.00 0.00 0.00 23.12 22.83 1h2y s ALA 468 CO 0.31 0.19 -0.01 0.12 0.00 0.00 0.00 175.76 176.37 1h2y s PHE 469 N -1.25 2.44 -0.23 0.00 2.19 0.32 -0.80 117.98 120.65 1h2y s PHE 469 Ca -0.01 -1.91 -0.08 0.00 0.33 0.00 0.00 56.93 55.26 1h2y s PHE 469 Cb -0.10 -1.79 -0.03 0.00 -1.31 0.00 0.00 43.02 39.79 1h2y s PHE 469 CO 0.02 -0.81 0.07 -1.17 1.83 0.00 0.00 175.22 175.17 1h2y s LEU 470 N 1.37 3.60 0.01 6.12 2.96 -0.06 -0.91 118.68 131.78 1h2y s LEU 470 Ca -0.01 -0.09 0.06 0.00 -0.22 0.00 0.00 54.13 53.87 1h2y s LEU 470 Cb -0.19 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1h2y s LEU 470 CO -0.10 0.04 -0.16 -0.47 -1.32 0.00 0.00 176.35 174.34 1h2y s TYR 471 N 1.17 2.63 0.19 5.38 5.04 0.19 -1.44 117.35 130.52 1h2y s TYR 471 Ca 0.05 -0.21 -0.19 0.00 -2.44 0.00 0.00 57.07 54.28 1h2y s TYR 471 Cb -0.14 -1.52 0.04 0.00 0.35 0.00 0.00 41.96 40.68 1h2y s TYR 471 CO 0.03 0.24 0.55 0.20 -1.34 0.00 0.00 175.55 175.24 1h2y s GLY 472 N -1.24 -0.21 0.00 8.97 0.00 -1.13 -1.71 107.32 112.00 1h2y s GLY 472 Ca 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.79 1h2y s GLY 472 CO 0.04 -0.16 0.00 0.33 0.00 0.00 0.00 173.10 173.31 1h2y n PHE 473 N -0.35 0.00 -1.57 1.90 7.35 -1.26 -4.47 117.46 119.05 1h2y n PHE 473 Ca -0.11 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.58 1h2y n PHE 473 Cb 0.63 0.02 0.00 0.00 0.35 0.00 0.00 39.48 40.48 1h2y n PHE 473 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1h2y n GLY 474 N 2.11 -0.21 0.00 7.13 0.00 -1.26 -4.29 105.19 108.67 1h2y n GLY 474 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1h2y n GLY 474 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2y n GLY 475 N -1.09 1.70 2.38 -0.02 0.00 -1.11 -4.60 105.19 102.46 1h2y n GLY 475 Ca -0.00 -1.02 -0.18 0.00 0.00 0.00 0.00 46.02 44.82 1h2y n GLY 475 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1h2y n PHE 476 N -0.76 -0.62 -2.04 1.61 3.72 -1.10 -1.87 117.46 116.40 1h2y n PHE 476 Ca 0.00 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.20 1h2y n PHE 476 Cb 0.00 -3.29 -0.04 0.00 -0.94 0.00 0.00 39.48 35.21 1h2y n PHE 476 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1h2y n ASN 477 N -1.43 -5.61 -4.65 4.37 5.15 -0.91 -4.93 115.26 107.25 1h2y n ASN 477 Ca -0.19 0.21 -0.38 0.00 -0.60 0.00 0.00 54.58 53.61 1h2y n ASN 477 Cb 0.62 -4.74 -0.08 0.00 -0.53 0.00 0.00 39.78 35.05 1h2y n ASN 477 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1h2y s ILE 478 N -2.89 5.19 -0.17 -1.44 1.01 -0.78 -3.47 121.20 118.64 1h2y s ILE 478 Ca 0.00 0.68 -0.17 0.00 0.00 0.00 0.00 60.65 61.15 1h2y s ILE 478 Cb 0.00 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1h2y s ILE 478 CO 0.00 0.22 0.44 -0.44 0.00 0.00 0.00 174.94 175.16 1h2y s SER 479 N 1.22 6.55 -0.80 3.58 0.01 -1.26 -2.59 113.70 120.42 1h2y s SER 479 Ca 0.18 0.65 -0.19 0.00 1.31 0.00 0.00 55.95 57.90 1h2y s SER 479 Cb -0.15 -2.26 0.13 0.00 0.21 0.00 0.00 66.02 63.95 1h2y s SER 479 CO 0.08 -0.06 0.95 -0.63 0.41 0.00 0.00 173.24 173.99 1h2y s ILE 480 N 1.11 4.82 0.32 1.44 -1.09 -1.26 -4.98 121.20 121.57 1h2y s ILE 480 Ca 0.22 -1.39 0.05 0.00 -2.23 0.00 0.00 60.65 57.30 1h2y s ILE 480 Cb -0.15 -4.65 -0.02 0.00 -1.58 0.00 0.00 42.46 36.06 1h2y s ILE 480 CO 0.09 -1.34 0.47 0.42 -1.23 0.00 0.00 174.94 173.34 1h2y s THR 481 N 2.52 4.43 0.29 2.92 -4.23 -1.26 -4.92 115.64 115.39 1h2y s THR 481 Ca 0.24 -0.91 -0.30 0.00 -1.18 0.00 0.00 61.69 59.54 1h2y s THR 481 Cb -0.12 -3.56 -0.13 0.00 1.34 0.00 0.00 72.50 70.04 1h2y s THR 481 CO -0.03 -0.24 1.37 -2.65 -0.54 0.00 0.00 174.62 172.53 1h2y n PRO 482 N -1.64 2.14 -3.73 3.99 -0.02 -1.26 -5.00 135.00 129.49 1h2y n PRO 482 Ca -0.03 0.76 -0.12 0.00 -2.02 0.00 0.00 63.50 62.09 1h2y n PRO 482 Cb 0.58 -2.39 -0.07 0.00 -0.02 0.00 0.00 33.50 31.59 1h2y n PRO 482 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1h2y s ASN 483 N 0.05 -0.18 -0.19 2.55 3.84 -1.26 -4.04 114.94 115.71 1h2y s ASN 483 Ca 0.62 -0.11 -0.27 0.00 0.21 0.00 0.00 52.86 53.32 1h2y s ASN 483 Cb -0.60 0.37 -0.01 0.00 -0.55 0.00 0.00 41.25 40.47 1h2y s ASN 483 CO 0.55 -0.62 0.90 -0.47 -2.79 0.00 0.00 177.10 174.67 1h2y s TYR 484 N -2.43 3.40 -0.24 0.43 5.04 -0.81 -3.88 117.35 118.86 1h2y s TYR 484 Ca -0.06 1.33 -0.01 0.00 -2.44 0.00 0.00 57.07 55.88 1h2y s TYR 484 Cb -0.01 -3.10 0.07 0.00 0.35 0.00 0.00 41.96 39.27 1h2y s TYR 484 CO -0.02 -0.32 0.03 0.45 -1.34 0.00 0.00 175.55 174.35 1h2y s SER 485 N 1.19 3.44 0.23 4.32 0.15 -1.26 -4.99 113.70 116.78 1h2y s SER 485 Ca 0.40 -1.14 -0.07 0.00 0.70 0.00 0.00 55.95 55.85 1h2y s SER 485 Cb -0.16 -0.80 0.22 0.00 -1.71 0.00 0.00 66.02 63.56 1h2y s SER 485 CO 0.11 -0.32 1.85 0.58 1.20 0.00 0.00 173.24 176.65 1h2y h VAL 486 N 6.54 1.26 -0.53 4.45 2.07 -1.95 -1.93 116.25 126.17 1h2y h VAL 486 Ca -0.16 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 66.70 1h2y h VAL 486 Cb 1.08 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 1h2y h VAL 486 CO 0.39 0.30 0.34 0.77 0.02 0.00 0.00 177.57 179.39 1h2y h SER 487 N 1.24 0.59 -0.08 0.57 4.64 -1.97 -0.57 113.55 117.97 1h2y h SER 487 Ca 0.31 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.46 1h2y h SER 487 Cb 0.06 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1h2y h SER 487 CO -0.05 0.42 -0.47 0.03 -0.87 0.00 0.00 176.83 175.89 1h2y h ARG 488 N 0.70 0.64 -0.10 4.77 3.08 -1.95 -2.92 114.38 118.60 1h2y h ARG 488 Ca 0.20 -0.37 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 1h2y h ARG 488 Cb -0.06 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1h2y h ARG 488 CO -0.05 0.97 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.56 1h2y h LEU 489 N 0.51 0.15 -0.95 3.04 3.38 -0.81 -1.20 115.31 119.43 1h2y h LEU 489 Ca 0.03 -0.03 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1h2y h LEU 489 Cb 1.02 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1h2y h LEU 489 CO 0.10 0.36 -0.23 0.40 0.09 0.00 0.00 178.44 179.15 1h2y h ILE 490 N 0.15 1.26 -0.62 1.22 2.04 -0.95 0.17 117.51 120.77 1h2y h ILE 490 Ca 0.03 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 64.63 1h2y h ILE 490 Cb 0.43 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 1h2y h ILE 490 CO 0.03 0.39 0.31 0.15 0.00 0.00 0.00 178.15 179.03 1h2y h PHE 491 N 0.44 0.89 0.47 1.37 3.57 -1.07 0.25 116.94 122.86 1h2y h PHE 491 Ca 0.07 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1h2y h PHE 491 Cb 0.64 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.11 1h2y h PHE 491 CO 0.02 0.67 -0.22 0.28 -2.23 0.00 0.00 178.31 176.83 1h2y h VAL 492 N 0.86 0.44 -0.07 1.41 2.07 -0.84 -1.69 116.25 118.43 1h2y h VAL 492 Ca 0.21 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.28 1h2y h VAL 492 Cb 0.11 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1h2y h VAL 492 CO -0.03 0.06 -0.05 -0.09 0.02 0.00 0.00 177.57 177.49 1h2y h ARG 493 N -0.92 0.15 -0.02 1.57 9.65 -0.94 -2.16 114.38 121.71 1h2y h ARG 493 Ca -0.06 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 1h2y h ARG 493 Cb 0.58 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.16 1h2y h ARG 493 CO 0.11 0.56 -0.32 0.72 2.80 0.00 0.00 179.97 183.84 1h2y n HIS 494 N -4.75 0.00 -0.43 2.20 8.25 0.88 -4.22 115.22 117.15 1h2y n HIS 494 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1h2y n HIS 494 Cb 0.28 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.37 1h2y n HIS 494 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1h2y n MET 495 N 0.18 1.17 -2.41 -0.41 2.81 -0.81 -0.53 117.12 117.12 1h2y n MET 495 Ca 0.11 -0.88 -0.20 0.00 -1.81 0.00 0.00 57.70 54.92 1h2y n MET 495 Cb 0.47 -0.78 -0.01 0.00 -0.71 0.00 0.00 33.22 32.19 1h2y n MET 495 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1h2y n GLY 496 N -0.22 -0.50 3.94 3.03 0.00 -0.83 -4.79 105.19 105.82 1h2y n GLY 496 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1h2y n GLY 496 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h2y s GLY 497 N -2.06 1.69 -0.11 -0.02 0.00 -0.70 -4.22 107.32 101.91 1h2y s GLY 497 Ca 0.00 -1.00 0.02 0.00 0.00 0.00 0.00 44.72 43.74 1h2y s GLY 497 CO 0.00 -0.69 -0.16 0.14 0.00 0.00 0.00 173.10 172.39 1h2y s VAL 498 N -2.96 2.77 -0.11 1.40 1.01 -0.13 -4.35 120.40 118.03 1h2y s VAL 498 Ca 0.56 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.72 1h2y s VAL 498 Cb -0.10 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1h2y s VAL 498 CO 0.42 0.54 0.09 -0.22 0.00 0.00 0.00 175.10 175.93 1h2y s LEU 499 N 0.14 4.08 -0.03 3.92 2.96 -0.38 -0.52 118.68 128.84 1h2y s LEU 499 Ca -0.09 0.34 -0.04 0.00 -0.22 0.00 0.00 54.13 54.13 1h2y s LEU 499 Cb -0.15 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.57 1h2y s LEU 499 CO 0.05 0.40 0.10 0.00 -1.32 0.00 0.00 176.35 175.58 1h2y s ALA 500 N -0.97 -0.24 -0.12 5.97 0.00 -0.09 -0.54 121.76 125.77 1h2y s ALA 500 Ca 0.14 0.25 -0.01 0.00 0.00 0.00 0.00 51.96 52.34 1h2y s ALA 500 Cb -0.12 -0.15 0.03 0.00 0.00 0.00 0.00 23.12 22.89 1h2y s ALA 500 CO 0.03 -0.06 -0.05 0.08 0.00 0.00 0.00 175.76 175.77 1h2y s VAL 501 N -0.03 0.86 -0.25 0.00 1.01 -0.62 -0.64 120.40 120.72 1h2y s VAL 501 Ca -0.01 -0.28 -0.11 0.00 0.00 0.00 0.00 61.98 61.59 1h2y s VAL 501 Cb -0.01 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1h2y s VAL 501 CO 0.00 0.26 0.17 0.00 0.00 0.00 0.00 175.10 175.53 1h2y s ALA 502 N 1.76 3.58 -1.39 5.51 0.00 -0.70 -1.51 121.76 129.01 1h2y s ALA 502 Ca 0.04 -0.96 -0.09 0.00 0.00 0.00 0.00 51.96 50.94 1h2y s ALA 502 Cb -0.13 -2.38 0.08 0.00 0.00 0.00 0.00 23.12 20.69 1h2y s ALA 502 CO -0.07 -0.33 2.31 0.09 0.00 0.00 0.00 175.76 177.76 1h2y n ASN 503 N 4.57 6.59 -4.73 0.00 4.13 0.13 -4.62 115.26 121.34 1h2y n ASN 503 Ca -0.15 -2.97 -0.31 0.00 1.68 0.00 0.00 54.58 52.83 1h2y n ASN 503 Cb 0.52 -1.48 0.12 0.00 -1.54 0.00 0.00 39.78 37.40 1h2y n ASN 503 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1h2y s ILE 504 N 0.66 2.82 0.90 2.41 -4.36 -1.26 -4.41 121.20 117.96 1h2y s ILE 504 Ca 0.51 0.27 -0.11 0.00 -0.26 0.00 0.00 60.65 61.07 1h2y s ILE 504 Cb 0.15 -2.57 0.14 0.00 1.25 0.00 0.00 42.46 41.43 1h2y s ILE 504 CO -0.06 -0.35 1.14 0.54 0.24 0.00 0.00 174.94 176.45 1h2y n ARG 505 N -3.79 -0.37 0.00 0.37 1.74 -1.26 -3.26 116.66 110.08 1h2y n ARG 505 Ca 0.10 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1h2y n ARG 505 Cb 0.53 -2.37 0.00 0.00 -1.02 0.00 0.00 32.46 29.59 1h2y n ARG 505 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h2y n GLY 506 N 0.34 2.74 2.47 -0.13 0.00 -0.04 -4.18 105.19 106.39 1h2y n GLY 506 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1h2y n GLY 506 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2y n GLY 507 N -0.13 -1.89 0.95 -0.02 0.00 -1.20 -2.14 105.19 100.76 1h2y n GLY 507 Ca 0.00 -1.61 0.08 0.00 0.00 0.00 0.00 46.02 44.48 1h2y n GLY 507 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2y n GLY 508 N -1.40 3.17 0.33 -0.02 0.00 -1.07 -1.99 105.19 104.22 1h2y n GLY 508 Ca 0.11 -0.71 0.07 0.00 0.00 0.00 0.00 46.02 45.49 1h2y n GLY 508 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1h2y h GLU 509 N 2.47 0.79 -1.10 1.61 3.07 -1.88 -1.90 114.58 117.63 1h2y h GLU 509 Ca 0.00 -0.05 -0.59 0.00 -0.50 0.00 0.00 59.36 58.23 1h2y h GLU 509 Cb 1.13 -0.18 -0.41 0.00 -0.84 0.00 0.00 28.75 28.46 1h2y h GLU 509 CO 0.13 0.52 -0.54 0.66 -1.40 0.00 0.00 179.01 178.37 1h2y n TYR 510 N -4.74 3.03 -4.47 4.33 4.01 -1.26 -4.74 117.16 113.33 1h2y n TYR 510 Ca 0.18 -2.60 0.00 0.00 -0.16 0.00 0.00 57.90 55.32 1h2y n TYR 510 Cb 0.40 -0.39 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1h2y n TYR 510 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h2y n GLY 511 N -0.64 -1.19 0.28 2.72 0.00 -0.72 -3.44 105.19 102.21 1h2y n GLY 511 Ca 0.44 -1.18 0.13 0.00 0.00 0.00 0.00 46.02 45.41 1h2y n GLY 511 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1h2y h GLU 512 N 0.00 0.00 -0.24 1.61 4.57 -1.43 -0.41 114.58 118.68 1h2y h GLU 512 Ca 0.00 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.06 1h2y h GLU 512 Cb 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.58 1h2y h GLU 512 CO 0.00 0.02 -0.34 1.79 -1.18 0.00 0.00 179.01 179.30 1h2y h THR 513 N 0.00 1.29 -0.35 0.32 1.35 -1.82 0.13 112.91 113.83 1h2y h THR 513 Ca -0.00 -1.45 -0.09 0.00 -0.55 0.00 0.00 66.41 64.32 1h2y h THR 513 Cb 0.05 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 1h2y h THR 513 CO 0.00 0.46 -0.13 -0.25 -0.25 0.00 0.00 175.52 175.35 1h2y h TRP 514 N 0.43 0.80 0.39 4.73 2.91 -1.12 -1.61 115.95 122.48 1h2y h TRP 514 Ca 0.05 -0.19 -0.02 0.00 1.13 0.00 0.00 58.89 59.86 1h2y h TRP 514 Cb 0.81 -0.19 0.00 0.00 -0.51 0.00 0.00 29.16 29.27 1h2y h TRP 514 CO 0.03 0.88 -0.19 1.25 -1.03 0.00 0.00 178.44 179.38 1h2y h HIS 515 N 0.48 -0.49 -0.03 2.65 2.76 -0.77 0.02 115.15 119.78 1h2y h HIS 515 Ca 0.08 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 1h2y h HIS 515 Cb 0.65 0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.77 1h2y h HIS 515 CO 0.06 -0.30 0.03 0.87 -1.30 0.00 0.00 177.93 177.29 1h2y h LYS 516 N -0.54 0.00 0.00 5.26 1.57 -0.70 -1.01 116.57 121.15 1h2y h LYS 516 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1h2y h LYS 516 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1h2y h LYS 516 CO 0.09 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.38 1h2y n GLY 517 N -1.29 -0.89 1.70 3.86 0.00 -0.61 -3.55 105.19 104.40 1h2y n GLY 517 Ca -0.02 -0.11 0.01 0.00 0.00 0.00 0.00 46.02 45.90 1h2y n GLY 517 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2y n GLY 518 N 0.45 2.23 3.23 -0.02 0.00 -0.39 -4.59 105.19 106.11 1h2y n GLY 518 Ca 0.12 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 1h2y n GLY 518 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h2y s ILE 519 N -1.72 0.58 0.00 -0.61 -4.36 -1.23 -4.46 121.20 109.39 1h2y s ILE 519 Ca 0.34 -1.97 0.00 0.00 -0.26 0.00 0.00 60.65 58.76 1h2y s ILE 519 Cb 0.37 -2.13 0.00 0.00 1.25 0.00 0.00 42.46 41.95 1h2y s ILE 519 CO -0.11 -0.45 0.00 0.18 0.24 0.00 0.00 174.94 174.80 1h2y n LEU 520 N -0.23 0.00 0.30 0.37 4.77 0.11 -1.24 117.00 121.08 1h2y n LEU 520 Ca -0.06 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.08 1h2y n LEU 520 Cb 0.63 0.00 0.95 0.00 -2.33 0.00 0.00 43.42 42.68 1h2y n LEU 520 CO 0.33 0.00 1.13 0.00 -1.33 0.00 0.00 177.39 177.53 1h2y h ALA 521 N -0.68 1.48 -0.59 -1.18 0.00 -1.91 -2.33 119.26 114.05 1h2y h ALA 521 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1h2y h ALA 521 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1h2y h ALA 521 CO 0.00 -0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.33 1h2y n ASN 522 N -3.76 3.23 -0.20 0.00 3.02 -0.37 -4.51 115.26 112.67 1h2y n ASN 522 Ca -0.03 -2.03 0.16 0.00 -0.03 0.00 0.00 54.58 52.65 1h2y n ASN 522 Cb 0.09 -0.41 0.49 0.00 -0.61 0.00 0.00 39.78 39.35 1h2y n ASN 522 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1h2y h LYS 523 N 3.44 0.43 -0.07 3.52 1.63 -1.35 -0.23 116.57 123.94 1h2y h LYS 523 Ca 0.00 -0.03 0.02 0.00 -0.85 0.00 0.00 60.65 59.80 1h2y h LYS 523 Cb 0.83 -0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 32.36 1h2y h LYS 523 CO 0.02 0.28 0.15 0.37 -3.45 0.00 0.00 179.45 176.82 1h2y h GLN 524 N 0.44 0.00 -0.61 1.90 5.75 -1.85 -0.08 115.11 120.66 1h2y h GLN 524 Ca 0.41 0.00 0.01 0.00 -0.15 0.00 0.00 58.65 58.92 1h2y h GLN 524 Cb 0.93 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.45 1h2y h GLN 524 CO -0.14 0.00 0.40 -0.91 -2.65 0.00 0.00 178.83 175.53 1h2y h ASN 525 N 0.00 0.68 -0.35 -0.69 2.35 -1.29 -0.18 115.58 116.09 1h2y h ASN 525 Ca 0.03 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 1h2y h ASN 525 Cb 0.34 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1h2y h ASN 525 CO -0.00 0.48 0.16 0.00 -1.65 0.00 0.00 177.43 176.43 1h2y h PHE 527 N 0.43 1.03 -0.20 0.00 0.04 -1.49 -1.50 116.94 115.24 1h2y h PHE 527 Ca 0.12 -0.23 -0.02 0.00 2.80 0.00 0.00 57.97 60.65 1h2y h PHE 527 Cb 0.13 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.03 1h2y h PHE 527 CO -0.01 1.01 0.06 -0.44 -0.60 0.00 0.00 178.31 178.33 1h2y h ASP 528 N 0.75 0.29 -0.47 2.17 3.32 -0.85 -0.85 116.42 120.78 1h2y h ASP 528 Ca 0.11 -0.20 0.06 0.00 0.02 0.00 0.00 57.03 57.03 1h2y h ASP 528 Cb 0.69 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.11 1h2y h ASP 528 CO 0.05 0.41 0.16 0.44 -1.72 0.00 0.00 179.24 178.58 1h2y h ASP 529 N 0.15 0.15 -0.47 6.45 3.32 -0.65 -0.20 116.42 125.17 1h2y h ASP 529 Ca 0.06 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.08 1h2y h ASP 529 Cb 0.22 0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 1h2y h ASP 529 CO -0.00 0.12 -0.08 0.15 -1.72 0.00 0.00 179.24 177.70 1h2y h PHE 530 N 0.33 0.99 -0.62 4.55 3.57 -1.12 -1.36 116.94 123.28 1h2y h PHE 530 Ca 0.22 -0.20 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1h2y h PHE 530 Cb 0.23 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1h2y h PHE 530 CO -0.16 0.96 0.18 1.96 -2.23 0.00 0.00 178.31 179.02 1h2y h GLN 531 N 0.74 0.95 -0.05 1.11 4.20 -0.85 -1.82 115.11 119.39 1h2y h GLN 531 Ca 0.12 -0.19 -0.08 0.00 0.06 0.00 0.00 58.65 58.57 1h2y h GLN 531 Cb 0.62 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1h2y h GLN 531 CO 0.04 0.82 -0.34 0.00 -0.67 0.00 0.00 178.83 178.68 1h2y h ALA 533 N 1.58 0.46 -0.24 0.00 0.00 -0.44 0.28 119.26 120.89 1h2y h ALA 533 Ca 0.01 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1h2y h ALA 533 Cb 0.65 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1h2y h ALA 533 CO 0.05 0.12 0.15 0.00 0.00 0.00 0.00 179.25 179.57 1h2y h ALA 534 N 0.93 0.30 -0.39 0.00 0.00 -0.99 -1.72 119.26 117.39 1h2y h ALA 534 Ca 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1h2y h ALA 534 Cb 0.29 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1h2y h ALA 534 CO 0.00 -0.23 0.21 0.93 0.00 0.00 0.00 179.25 180.15 1h2y h GLU 535 N 0.31 0.52 -0.12 0.00 5.08 -1.04 -1.28 114.58 118.06 1h2y h GLU 535 Ca 0.09 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1h2y h GLU 535 Cb -0.02 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1h2y h GLU 535 CO -0.03 0.39 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.44 1h2y h TYR 536 N 0.53 0.24 -0.65 4.33 5.03 -0.42 0.60 116.97 126.64 1h2y h TYR 536 Ca 0.14 -0.05 0.01 0.00 2.58 0.00 0.00 58.73 61.41 1h2y h TYR 536 Cb 0.02 -0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.21 1h2y h TYR 536 CO 0.00 0.48 0.43 -0.07 -1.32 0.00 0.00 178.16 177.68 1h2y h LEU 537 N -0.06 0.73 0.01 2.82 3.38 -0.83 0.41 115.31 121.76 1h2y h LEU 537 Ca 0.03 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1h2y h LEU 537 Cb 0.39 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1h2y h LEU 537 CO 0.01 0.52 -0.00 0.40 0.09 0.00 0.00 178.44 179.46 1h2y h ILE 538 N 0.86 1.49 -0.93 1.22 2.04 -1.12 -0.33 117.51 120.74 1h2y h ILE 538 Ca 0.24 -1.51 -0.01 0.00 1.00 0.00 0.00 64.86 64.58 1h2y h ILE 538 Cb -0.08 2.51 -0.04 0.00 -0.74 0.00 0.00 36.82 38.47 1h2y h ILE 538 CO -0.05 0.39 0.53 0.50 0.00 0.00 0.00 178.15 179.51 1h2y h LYS 539 N -0.66 1.28 0.00 2.37 3.11 -0.66 -2.04 116.57 119.96 1h2y h LYS 539 Ca -0.00 -0.13 0.00 0.00 -2.81 0.00 0.00 60.65 57.71 1h2y h LYS 539 Cb 0.64 -0.26 0.00 0.00 -1.00 0.00 0.00 32.23 31.62 1h2y h LYS 539 CO 0.00 0.91 0.00 0.39 -2.81 0.00 0.00 179.45 177.94 1h2y n GLU 540 N -4.34 0.92 -0.82 1.90 -0.58 0.12 -4.92 120.64 112.92 1h2y n GLU 540 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1h2y n GLU 540 Cb 0.08 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 1h2y n GLU 540 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1h2y n GLY 541 N 0.99 0.56 0.13 0.62 0.00 -0.77 -4.86 105.19 101.86 1h2y n GLY 541 Ca 0.23 -0.31 -0.01 0.00 0.00 0.00 0.00 46.02 45.93 1h2y n GLY 541 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1h2y h TYR 542 N 0.00 0.00 -2.19 1.61 0.05 -1.28 0.22 116.97 115.38 1h2y h TYR 542 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1h2y h TYR 542 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1h2y h TYR 542 CO 0.00 0.65 0.09 -2.37 -1.05 0.00 0.00 178.16 175.49 1h2y n THR 543 N -3.54 0.00 -4.13 -2.88 5.66 -1.11 -3.75 114.28 104.53 1h2y n THR 543 Ca -0.00 -0.25 -0.09 0.00 -3.05 0.00 0.00 64.05 60.65 1h2y n THR 543 Cb 0.70 0.26 -0.10 0.00 -1.55 0.00 0.00 70.33 69.64 1h2y n THR 543 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1h2y s SER 544 N -1.59 0.88 0.20 1.09 0.01 -1.20 -4.33 113.70 108.76 1h2y s SER 544 Ca 0.05 -0.97 -0.12 0.00 1.31 0.00 0.00 55.95 56.22 1h2y s SER 544 Cb -0.01 0.13 0.25 0.00 0.21 0.00 0.00 66.02 66.59 1h2y s SER 544 CO 0.03 -0.49 1.68 -0.65 0.41 0.00 0.00 173.24 174.22 1h2y h PRO 545 N 3.16 0.14 0.00 12.44 0.11 -1.90 -0.00 132.00 145.95 1h2y h PRO 545 Ca -0.35 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1h2y h PRO 545 Cb 1.16 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1h2y h PRO 545 CO 0.63 0.10 0.00 0.36 -0.21 0.00 0.00 178.00 178.88 1h2y n LYS 546 N -5.22 0.14 0.00 1.05 2.85 -1.26 -1.25 118.16 114.47 1h2y n LYS 546 Ca 0.07 0.48 0.07 0.00 -1.05 0.00 0.00 58.31 57.89 1h2y n LYS 546 Cb 0.31 -1.84 0.03 0.00 -0.65 0.00 0.00 35.03 32.89 1h2y n LYS 546 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1h2y n ARG 547 N -2.12 1.30 -3.34 -1.58 1.74 -0.08 -4.59 116.66 107.99 1h2y n ARG 547 Ca 0.01 -1.08 -0.38 0.00 -0.77 0.00 0.00 57.85 55.63 1h2y n ARG 547 Cb 0.14 -1.23 -0.06 0.00 -1.02 0.00 0.00 32.46 30.29 1h2y n ARG 547 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1h2y s LEU 548 N -1.42 4.30 -0.04 0.55 2.96 -0.78 -1.72 118.68 122.53 1h2y s LEU 548 Ca 0.14 0.82 0.06 0.00 -0.22 0.00 0.00 54.13 54.93 1h2y s LEU 548 Cb 0.11 -2.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.11 1h2y s LEU 548 CO 0.23 0.04 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.20 1h2y s THR 549 N 0.41 2.36 0.03 3.68 2.01 0.02 -0.54 115.64 123.60 1h2y s THR 549 Ca 0.25 -0.98 0.08 0.00 0.31 0.00 0.00 61.69 61.36 1h2y s THR 549 Cb -0.15 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 1h2y s THR 549 CO 0.10 0.58 -0.24 0.27 -0.69 0.00 0.00 174.62 174.64 1h2y s ILE 550 N -0.48 2.29 0.02 1.82 -4.36 -0.58 -0.88 121.20 119.02 1h2y s ILE 550 Ca 0.06 -1.28 -0.01 0.00 -0.26 0.00 0.00 60.65 59.16 1h2y s ILE 550 Cb -0.11 -1.89 -0.02 0.00 1.25 0.00 0.00 42.46 41.69 1h2y s ILE 550 CO 0.01 0.40 -0.01 0.21 0.24 0.00 0.00 174.94 175.79 1h2y s ASN 551 N -1.16 0.20 -0.12 4.36 3.84 -0.52 -1.28 114.94 120.28 1h2y s ASN 551 Ca 0.12 -0.44 -0.30 0.00 0.21 0.00 0.00 52.86 52.45 1h2y s ASN 551 Cb -0.10 0.10 0.12 0.00 -0.55 0.00 0.00 41.25 40.83 1h2y s ASN 551 CO 0.02 -0.28 1.01 -0.83 -2.79 0.00 0.00 177.10 174.23 1h2y s GLY 552 N -1.34 -0.33 0.03 1.21 0.00 -1.16 -2.82 107.32 102.91 1h2y s GLY 552 Ca -0.15 1.64 0.07 0.00 0.00 0.00 0.00 44.72 46.28 1h2y s GLY 552 CO -0.01 0.71 -0.20 -0.32 0.00 0.00 0.00 173.10 173.28 1h2y s GLY 553 N -1.76 1.08 0.00 0.20 0.00 -1.26 -1.41 107.32 104.18 1h2y s GLY 553 Ca 0.03 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.74 1h2y s GLY 553 CO -0.04 -0.92 0.00 -1.26 0.00 0.00 0.00 173.10 170.88 1h2y n SER 554 N 2.00 0.00 0.27 1.64 2.88 0.45 0.64 113.62 121.50 1h2y n SER 554 Ca -0.17 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.49 1h2y n SER 554 Cb 0.53 0.00 0.77 0.00 -0.75 0.00 0.00 64.21 64.76 1h2y n SER 554 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 1h2y h ASN 555 N 0.00 0.00 1.34 -3.46 -1.24 -1.90 0.31 115.58 110.63 1h2y h ASN 555 Ca 0.00 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.94 1h2y h ASN 555 Cb 0.00 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.04 1h2y h ASN 555 CO 0.00 0.05 -0.33 1.23 -1.29 0.00 0.00 177.43 177.10 1h2y h GLY 556 N 0.27 0.00 1.05 1.57 0.00 0.02 -1.56 103.07 104.43 1h2y h GLY 556 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 1h2y h GLY 556 CO 0.01 0.00 -0.43 -1.33 0.00 0.00 0.00 176.54 174.78 1h2y h GLY 557 N 3.00 0.85 1.01 4.60 0.00 -0.40 -1.87 103.07 110.26 1h2y h GLY 557 Ca -0.00 -0.96 -0.00 0.00 0.00 0.00 0.00 47.33 46.36 1h2y h GLY 557 CO 0.04 0.86 0.46 -2.00 0.00 0.00 0.00 176.54 175.90 1h2y h LEU 558 N 0.54 0.88 0.20 3.11 5.85 -1.12 -1.45 115.31 123.32 1h2y h LEU 558 Ca 0.02 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1h2y h LEU 558 Cb 1.03 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 1h2y h LEU 558 CO 0.10 0.68 -0.32 0.25 -0.34 0.00 0.00 178.44 178.80 1h2y h LEU 559 N 1.01 -0.91 -0.87 2.25 5.85 -0.93 -1.41 115.31 120.30 1h2y h LEU 559 Ca 0.27 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.96 1h2y h LEU 559 Cb -0.05 0.33 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1h2y h LEU 559 CO -0.05 -0.43 -0.50 -0.37 -0.34 0.00 0.00 178.44 176.75 1h2y h VAL 560 N -0.59 1.35 -0.33 1.05 -1.51 -1.25 -1.97 116.25 112.99 1h2y h VAL 560 Ca 0.01 -1.74 -0.06 0.00 -1.23 0.00 0.00 66.70 63.68 1h2y h VAL 560 Cb 0.59 1.87 -0.01 0.00 -2.13 0.00 0.00 31.29 31.61 1h2y h VAL 560 CO -0.14 0.51 -0.02 0.00 -1.23 0.00 0.00 177.57 176.69 1h2y h ALA 561 N 1.37 0.45 -0.64 5.19 0.00 -1.10 -1.62 119.26 122.91 1h2y h ALA 561 Ca 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1h2y h ALA 561 Cb 0.93 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1h2y h ALA 561 CO 0.07 0.24 0.21 1.15 0.00 0.00 0.00 179.25 180.92 1h2y h THR 562 N 0.40 1.25 -0.22 0.00 2.02 -1.18 -2.47 112.91 112.72 1h2y h THR 562 Ca 0.09 -0.83 -0.04 0.00 0.77 0.00 0.00 66.41 66.40 1h2y h THR 562 Cb 0.49 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 1h2y h THR 562 CO 0.02 0.32 -0.04 0.00 0.37 0.00 0.00 175.52 176.19 1h2y h ALA 564 N 1.65 0.49 -0.30 0.00 0.00 -0.99 0.15 119.26 120.25 1h2y h ALA 564 Ca 0.07 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1h2y h ALA 564 Cb 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1h2y h ALA 564 CO 0.01 0.24 -0.01 -0.91 0.00 0.00 0.00 179.25 178.57 1h2y h ASN 565 N 0.45 0.53 0.09 0.00 2.35 -0.90 -2.45 115.58 115.64 1h2y h ASN 565 Ca 0.10 -0.32 -0.24 0.00 -0.55 0.00 0.00 56.30 55.29 1h2y h ASN 565 Cb 0.44 -0.14 0.01 0.00 0.05 0.00 0.00 38.32 38.67 1h2y h ASN 565 CO 0.02 0.72 -0.95 1.56 -1.65 0.00 0.00 177.43 177.13 1h2y h GLN 566 N 0.33 0.62 -2.03 0.81 4.20 -0.76 -3.40 115.11 114.87 1h2y h GLN 566 Ca 0.08 -0.63 -0.54 0.00 0.06 0.00 0.00 58.65 57.62 1h2y h GLN 566 Cb 0.46 0.17 -0.40 0.00 0.30 0.00 0.00 27.48 28.01 1h2y h GLN 566 CO 0.02 1.23 -1.06 0.54 -0.67 0.00 0.00 178.83 178.89 1h2y n ARG 567 N -3.84 1.08 0.28 1.46 5.12 0.50 -4.95 116.66 116.32 1h2y n ARG 567 Ca -0.09 -3.48 0.14 0.00 -1.93 0.00 0.00 57.85 52.49 1h2y n ARG 567 Cb 0.84 -1.49 0.82 0.00 -1.16 0.00 0.00 32.46 31.47 1h2y n ARG 567 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1h2y h PRO 568 N 3.70 0.00 0.00 5.56 0.13 -1.57 -1.71 132.00 138.12 1h2y h PRO 568 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1h2y h PRO 568 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1h2y h PRO 568 CO 0.52 0.05 0.00 0.38 -0.23 0.00 0.00 178.00 178.73 1h2y h ASP 569 N 0.00 0.00 1.10 1.44 2.03 -1.88 -3.20 116.42 115.91 1h2y h ASP 569 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1h2y h ASP 569 Cb 0.13 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 1h2y h ASP 569 CO 0.01 0.00 -0.79 0.25 -1.03 0.00 0.00 179.24 177.68 1h2y h LEU 570 N 0.00 0.00 -8.69 0.15 5.85 -1.67 -3.47 115.31 107.48 1h2y h LEU 570 Ca 0.00 -0.05 -0.55 0.00 0.84 0.00 0.00 57.88 58.12 1h2y h LEU 570 Cb 0.43 0.00 -0.21 0.00 0.37 0.00 0.00 40.66 41.25 1h2y h LEU 570 CO 0.00 0.02 -0.82 -0.36 -0.34 0.00 0.00 178.44 176.95 1h2y s PHE 571 N -3.30 1.77 -0.16 1.25 0.08 -1.21 -4.48 117.98 111.94 1h2y s PHE 571 Ca 0.02 -0.43 0.13 0.00 0.12 0.00 0.00 56.93 56.77 1h2y s PHE 571 Cb 0.10 -0.96 -0.23 0.00 -0.57 0.00 0.00 43.02 41.35 1h2y s PHE 571 CO 0.76 0.22 0.20 0.41 -0.10 0.00 0.00 175.22 176.71 1h2y n GLY 572 N 0.97 -0.88 3.17 4.36 0.00 0.30 -4.46 105.19 108.64 1h2y n GLY 572 Ca -0.19 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 1h2y n GLY 572 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2y s VAL 574 N -0.69 0.37 -0.27 0.00 1.01 0.24 -1.53 120.40 119.52 1h2y s VAL 574 Ca -0.08 0.05 0.01 0.00 0.00 0.00 0.00 61.98 61.96 1h2y s VAL 574 Cb -0.04 -0.47 0.05 0.00 0.00 0.00 0.00 36.38 35.92 1h2y s VAL 574 CO 0.02 0.22 -0.07 -0.63 0.00 0.00 0.00 175.10 174.64 1h2y s ILE 575 N 1.43 2.51 -0.28 2.22 1.01 -0.40 -1.09 121.20 126.59 1h2y s ILE 575 Ca -0.03 -1.51 -0.08 0.00 0.00 0.00 0.00 60.65 59.03 1h2y s ILE 575 Cb -0.13 -2.45 -0.01 0.00 0.01 0.00 0.00 42.46 39.88 1h2y s ILE 575 CO -0.03 -0.04 0.10 0.00 0.00 0.00 0.00 174.94 174.97 1h2y s ALA 576 N 1.17 3.17 -0.17 9.38 0.00 -0.47 -2.98 121.76 131.86 1h2y s ALA 576 Ca -0.07 -1.32 -0.09 0.00 0.00 0.00 0.00 51.96 50.48 1h2y s ALA 576 Cb -0.20 -2.20 -0.05 0.00 0.00 0.00 0.00 23.12 20.67 1h2y s ALA 576 CO -0.04 -0.77 0.13 -0.65 0.00 0.00 0.00 175.76 174.44 1h2y s GLN 577 N 1.58 3.86 -1.03 0.00 -0.21 -0.50 -1.40 119.66 121.96 1h2y s GLN 577 Ca 0.05 -0.18 -0.02 0.00 0.02 0.00 0.00 55.36 55.23 1h2y s GLN 577 Cb -0.16 -3.32 0.00 0.00 1.00 0.00 0.00 33.01 30.53 1h2y s GLN 577 CO 0.04 0.51 0.03 1.33 -2.12 0.00 0.00 175.29 175.08 1h2y n VAL 578 N 2.85 -0.75 -3.10 1.09 0.24 0.93 -0.42 118.33 119.16 1h2y n VAL 578 Ca -0.18 -0.34 -0.31 0.00 -2.04 0.00 0.00 64.34 61.47 1h2y n VAL 578 Cb 0.53 -0.74 -0.04 0.00 -1.47 0.00 0.00 33.84 32.12 1h2y n VAL 578 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1h2y s GLY 579 N -3.95 2.11 -0.47 7.63 0.00 -1.26 -2.88 107.32 108.50 1h2y s GLY 579 Ca 0.02 -0.19 -0.26 0.00 0.00 0.00 0.00 44.72 44.30 1h2y s GLY 579 CO 0.68 -0.02 0.94 0.14 0.00 0.00 0.00 173.10 174.83 1h2y s VAL 580 N -2.12 4.46 -0.11 1.40 1.01 -1.20 -4.42 120.40 119.42 1h2y s VAL 580 Ca 0.50 0.75 0.11 0.00 0.00 0.00 0.00 61.98 63.34 1h2y s VAL 580 Cb -0.10 -4.45 -0.16 0.00 0.00 0.00 0.00 36.38 31.67 1h2y s VAL 580 CO 0.25 -0.86 0.07 0.23 0.00 0.00 0.00 175.10 174.79 1h2y n MET 581 N 7.21 1.83 -3.23 2.72 2.81 -1.26 -4.23 117.12 122.97 1h2y n MET 581 Ca 0.06 -0.02 -0.46 0.00 -1.81 0.00 0.00 57.70 55.47 1h2y n MET 581 Cb 0.48 -1.32 -0.02 0.00 -0.71 0.00 0.00 33.22 31.65 1h2y n MET 581 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1h2y s ASP 582 N -4.44 6.69 0.00 7.83 -1.08 -1.26 -1.49 116.67 122.92 1h2y s ASP 582 Ca -0.06 -2.46 0.19 0.00 -0.52 0.00 0.00 52.55 49.69 1h2y s ASP 582 Cb 0.04 -2.26 0.80 0.00 -1.46 0.00 0.00 42.92 40.05 1h2y s ASP 582 CO 0.51 -0.72 1.60 0.23 0.52 0.00 0.00 175.17 177.32 1h2y n MET 583 N 4.69 0.00 0.07 4.34 2.81 -1.26 -1.88 117.12 125.89 1h2y n MET 583 Ca 0.14 0.18 0.05 0.00 -1.81 0.00 0.00 57.70 56.26 1h2y n MET 583 Cb 0.47 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.44 1h2y n MET 583 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1h2y h LEU 584 N 0.00 0.00 -1.49 4.03 3.38 -1.93 -3.40 115.31 115.91 1h2y h LEU 584 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h2y h LEU 584 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1h2y h LEU 584 CO 0.00 0.32 0.00 0.29 0.09 0.00 0.00 178.44 179.14 1h2y n LYS 585 N -2.83 0.20 -0.26 1.13 5.02 -1.13 -4.59 118.16 115.69 1h2y n LYS 585 Ca -0.05 -0.75 0.12 0.00 -2.02 0.00 0.00 58.31 55.62 1h2y n LYS 585 Cb 0.71 -0.96 0.38 0.00 -0.02 0.00 0.00 35.03 35.14 1h2y n LYS 585 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1h2y h PHE 586 N 0.00 0.80 0.00 2.13 -5.15 -1.59 -1.49 116.94 111.65 1h2y h PHE 586 Ca 0.00 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 1h2y h PHE 586 Cb 0.20 -0.25 0.00 0.00 0.22 0.00 0.00 35.95 36.11 1h2y h PHE 586 CO 0.00 0.30 0.00 1.12 -2.00 0.00 0.00 178.31 177.73 1h2y h HIS 587 N 0.69 0.00 0.00 6.09 2.07 -1.86 -3.19 115.15 118.95 1h2y h HIS 587 Ca 0.44 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.96 1h2y h HIS 587 Cb 0.70 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.68 1h2y h HIS 587 CO -0.00 0.00 0.00 0.87 -3.07 0.00 0.00 177.93 175.73 1h2y h LYS 588 N 0.00 0.00 -6.63 5.12 1.57 -1.61 -3.20 116.57 111.82 1h2y h LYS 588 Ca 0.00 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 1h2y h LYS 588 Cb 0.26 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 32.37 1h2y h LYS 588 CO 0.00 0.00 -0.79 0.71 -0.57 0.00 0.00 179.45 178.80 1h2y s TYR 589 N -3.16 2.58 0.00 -1.35 2.02 -1.20 -4.24 117.35 111.99 1h2y s TYR 589 Ca 0.09 -0.24 0.00 0.00 -0.37 0.00 0.00 57.07 56.55 1h2y s TYR 589 Cb 0.11 -1.41 0.00 0.00 -0.40 0.00 0.00 41.96 40.26 1h2y s TYR 589 CO 0.55 0.34 0.00 0.25 -1.57 0.00 0.00 175.55 175.12 1h2y n THR 590 N 1.11 0.00 -0.39 -0.71 -2.24 0.11 -0.35 114.28 111.82 1h2y n THR 590 Ca -0.16 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.74 1h2y n THR 590 Cb 0.52 0.00 0.33 0.00 -2.10 0.00 0.00 70.33 69.08 1h2y n THR 590 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h2y n ILE 591 N 0.00 1.04 0.09 2.28 0.13 -1.26 -1.17 119.36 120.47 1h2y n ILE 591 Ca 0.00 -1.01 0.18 0.00 -1.10 0.00 0.00 62.75 60.82 1h2y n ILE 591 Cb 0.00 0.48 0.73 0.00 -0.84 0.00 0.00 39.64 40.01 1h2y n ILE 591 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1h2y h GLY 592 N 4.29 0.00 1.74 4.50 0.00 -0.89 -0.53 103.07 112.18 1h2y h GLY 592 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.37 1h2y h GLY 592 CO 0.01 0.00 0.10 1.12 0.00 0.00 0.00 176.54 177.77 1h2y h HIS 593 N 0.00 0.00 0.00 5.60 2.07 -1.74 -1.51 115.15 119.57 1h2y h HIS 593 Ca 0.18 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.70 1h2y h HIS 593 Cb 0.81 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.79 1h2y h HIS 593 CO 0.00 0.00 -0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1h2y h ALA 594 N 1.92 1.00 -0.00 6.11 0.00 -1.44 -3.08 119.26 123.77 1h2y h ALA 594 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1h2y h ALA 594 Cb 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1h2y h ALA 594 CO -0.00 0.00 -0.07 0.91 0.00 0.00 0.00 179.25 180.09 1h2y n TRP 595 N -3.09 0.00 0.32 0.00 8.01 -0.57 -1.64 117.44 120.47 1h2y n TRP 595 Ca -0.00 0.00 0.20 0.00 -1.31 0.00 0.00 57.50 56.39 1h2y n TRP 595 Cb 0.24 -0.18 1.06 0.00 -2.01 0.00 0.00 31.31 30.42 1h2y n TRP 595 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.69 178.47 1h2y h THR 596 N 0.46 0.10 0.00 -0.99 1.35 -1.69 -1.49 112.91 110.64 1h2y h THR 596 Ca 0.00 -0.13 -0.04 0.00 -0.55 0.00 0.00 66.41 65.68 1h2y h THR 596 Cb 0.31 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 67.85 1h2y h THR 596 CO 0.00 0.01 -0.19 0.71 -0.25 0.00 0.00 175.52 175.80 1h2y h THR 597 N 0.00 0.58 0.04 6.82 1.35 -1.85 0.67 112.91 120.52 1h2y h THR 597 Ca -0.00 -0.91 -0.38 0.00 -0.55 0.00 0.00 66.41 64.57 1h2y h THR 597 Cb 0.12 1.60 -0.05 0.00 -1.73 0.00 0.00 68.15 68.09 1h2y h THR 597 CO 0.00 0.19 -2.33 0.47 -0.25 0.00 0.00 175.52 173.60 1h2y n ASP 598 N -3.50 2.02 -0.07 5.36 9.92 -0.62 -4.75 116.55 124.91 1h2y n ASP 598 Ca -0.01 -0.01 -0.03 0.00 -0.53 0.00 0.00 54.79 54.22 1h2y n ASP 598 Cb 0.36 -0.57 -0.16 0.00 -0.64 0.00 0.00 41.12 40.11 1h2y n ASP 598 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1h2y n TYR 599 N -3.39 0.00 -0.49 1.24 4.01 -0.82 0.04 117.16 117.76 1h2y n TYR 599 Ca -0.42 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.32 1h2y n TYR 599 Cb 1.00 -0.81 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 1h2y n TYR 599 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h2y n GLY 600 N 1.60 -2.45 2.89 2.72 0.00 0.23 -4.55 105.19 105.61 1h2y n GLY 600 Ca -0.23 -1.97 -0.14 0.00 0.00 0.00 0.00 46.02 43.69 1h2y n GLY 600 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2y h SER 602 N 6.97 0.00 0.34 0.00 4.64 -1.83 -0.99 113.55 122.68 1h2y h SER 602 Ca -0.40 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.90 1h2y h SER 602 Cb 1.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1h2y h SER 602 CO 0.45 0.00 -0.09 0.44 -0.87 0.00 0.00 176.83 176.75 1h2y h ASP 603 N 0.00 0.00 -3.29 4.97 3.32 -1.96 -3.41 116.42 116.05 1h2y h ASP 603 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1h2y h ASP 603 Cb 0.09 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.57 1h2y h ASP 603 CO 0.00 0.09 -0.16 -0.55 -1.72 0.00 0.00 179.24 176.90 1h2y s SER 604 N -6.07 6.68 0.21 6.45 0.15 -0.38 -4.98 113.70 115.75 1h2y s SER 604 Ca -0.03 0.81 -0.10 0.00 0.70 0.00 0.00 55.95 57.32 1h2y s SER 604 Cb 0.13 -2.27 0.17 0.00 -1.71 0.00 0.00 66.02 62.34 1h2y s SER 604 CO 0.57 0.05 1.87 0.50 1.20 0.00 0.00 173.24 177.43 1h2y h LYS 605 N 6.45 0.95 -0.35 5.44 3.64 -1.86 0.86 116.57 131.71 1h2y h LYS 605 Ca -0.42 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 1h2y h LYS 605 Cb 1.18 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1h2y h LYS 605 CO 0.74 0.63 0.14 0.37 -2.27 0.00 0.00 179.45 179.06 1h2y h GLN 606 N 0.98 0.53 -0.48 1.90 4.15 -1.93 -2.52 115.11 117.73 1h2y h GLN 606 Ca 0.28 -0.10 -0.06 0.00 0.77 0.00 0.00 58.65 59.54 1h2y h GLN 606 Cb -0.08 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 1h2y h GLN 606 CO -0.07 0.52 0.06 0.45 -1.93 0.00 0.00 178.83 177.86 1h2y h HIS 607 N 0.42 0.87 -0.99 3.99 3.86 -1.71 -2.73 115.15 118.87 1h2y h HIS 607 Ca 0.12 -0.13 0.12 0.00 -1.16 0.00 0.00 60.37 59.32 1h2y h HIS 607 Cb 0.19 -0.24 -0.09 0.00 1.06 0.00 0.00 27.41 28.34 1h2y h HIS 607 CO -0.00 0.81 0.61 0.35 0.86 0.00 0.00 177.93 180.56 1h2y h PHE 608 N 0.68 1.11 -0.14 2.45 3.57 -0.70 -0.44 116.94 123.48 1h2y h PHE 608 Ca 0.14 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1h2y h PHE 608 Cb 0.42 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1h2y h PHE 608 CO 0.03 0.42 0.07 0.93 -2.23 0.00 0.00 178.31 177.53 1h2y h GLU 609 N 0.95 0.19 0.01 1.11 4.39 -1.13 -0.61 114.58 119.49 1h2y h GLU 609 Ca 0.50 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 60.17 1h2y h GLU 609 Cb 0.52 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1h2y h GLU 609 CO -0.28 0.16 -0.07 -1.49 -1.16 0.00 0.00 179.01 176.17 1h2y h TRP 610 N 0.20 0.05 -0.64 4.33 6.55 -1.09 -3.37 115.95 121.97 1h2y h TRP 610 Ca 0.05 -0.03 0.03 0.00 0.95 0.00 0.00 58.89 59.89 1h2y h TRP 610 Cb 0.03 -0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.28 1h2y h TRP 610 CO 0.00 0.98 0.38 -0.07 -1.05 0.00 0.00 178.44 178.69 1h2y h LEU 611 N -0.90 0.61 -2.15 -4.49 3.38 -1.07 -2.76 115.31 107.93 1h2y h LEU 611 Ca -0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1h2y h LEU 611 Cb 1.01 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 1h2y h LEU 611 CO 0.01 0.42 -0.06 -0.29 0.09 0.00 0.00 178.44 178.61 1h2y h ILE 612 N 0.74 0.66 0.00 1.22 6.09 -1.29 0.35 117.51 125.28 1h2y h ILE 612 Ca 0.26 -0.24 -0.05 0.00 -1.37 0.00 0.00 64.86 63.46 1h2y h ILE 612 Cb 0.06 1.15 -0.01 0.00 0.47 0.00 0.00 36.82 38.49 1h2y h ILE 612 CO -0.12 0.06 -0.26 0.11 -3.07 0.00 0.00 178.15 174.87 1h2y h LYS 613 N 0.00 0.00 0.00 2.19 1.57 -1.65 -3.37 116.57 115.31 1h2y h LYS 613 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h2y h LYS 613 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1h2y h LYS 613 CO 0.01 0.26 -0.26 2.48 -0.57 0.00 0.00 179.45 181.37 1h2y n TYR 614 N -3.34 0.00 -1.64 -1.35 0.18 -0.87 -4.99 117.16 105.15 1h2y n TYR 614 Ca 0.01 0.00 -0.59 0.00 1.88 0.00 0.00 57.90 59.19 1h2y n TYR 614 Cb 0.49 0.00 -0.08 0.00 -0.38 0.00 0.00 39.34 39.37 1h2y n TYR 614 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1h2y n SER 615 N -0.87 1.94 -0.15 9.48 2.88 0.06 -4.78 113.62 122.18 1h2y n SER 615 Ca 0.00 0.99 -0.03 0.00 -1.33 0.00 0.00 58.87 58.50 1h2y n SER 615 Cb 0.00 -1.07 0.05 0.00 -0.75 0.00 0.00 64.21 62.44 1h2y n SER 615 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1h2y h PRO 616 N 7.50 0.08 -0.05 -1.46 0.11 -1.86 -1.47 132.00 134.85 1h2y h PRO 616 Ca -0.40 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.72 1h2y h PRO 616 Cb 1.34 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.43 1h2y h PRO 616 CO 0.99 0.06 0.05 1.25 -0.21 0.00 0.00 178.00 180.13 1h2y h LEU 617 N 0.09 0.00 -2.90 2.35 5.85 -1.58 -2.60 115.31 116.51 1h2y h LEU 617 Ca 0.24 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1h2y h LEU 617 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1h2y h LEU 617 CO -0.42 0.00 0.00 1.41 -0.34 0.00 0.00 178.44 179.09 1h2y n HIS 618 N -4.04 0.87 -1.74 1.25 8.25 -0.59 -4.46 115.22 114.76 1h2y n HIS 618 Ca -0.02 -0.54 0.05 0.00 -0.26 0.00 0.00 57.72 56.95 1h2y n HIS 618 Cb 0.14 -0.07 0.08 0.00 1.12 0.00 0.00 29.99 31.26 1h2y n HIS 618 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1h2y n ASN 619 N 0.99 1.15 -4.68 0.41 3.02 -0.98 -4.97 115.26 110.20 1h2y n ASN 619 Ca 0.20 -2.61 -0.43 0.00 -0.03 0.00 0.00 54.58 51.71 1h2y n ASN 619 Cb 0.61 -0.34 -0.02 0.00 -0.61 0.00 0.00 39.78 39.42 1h2y n ASN 619 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1h2y s VAL 620 N -1.36 4.60 -0.22 2.41 1.01 -1.24 -4.84 120.40 120.75 1h2y s VAL 620 Ca 0.21 1.89 -0.17 0.00 0.00 0.00 0.00 61.98 63.92 1h2y s VAL 620 Cb 0.21 -4.22 0.06 0.00 0.00 0.00 0.00 36.38 32.43 1h2y s VAL 620 CO -0.03 -0.03 0.57 -0.75 0.00 0.00 0.00 175.10 174.85 1h2y s LYS 621 N 2.33 0.62 0.20 2.72 2.20 -1.26 -5.03 119.74 121.52 1h2y s LYS 621 Ca 0.50 0.90 -0.33 0.00 -0.36 0.00 0.00 55.97 56.69 1h2y s LYS 621 Cb -0.20 0.21 -0.13 0.00 -1.51 0.00 0.00 37.83 36.20 1h2y s LYS 621 CO 0.17 -0.11 1.61 1.28 -0.36 0.00 0.00 175.35 177.94 1h2y n LEU 622 N 3.46 3.56 -4.78 5.43 4.77 -1.26 -4.91 117.00 123.27 1h2y n LEU 622 Ca -0.17 1.09 -0.41 0.00 -0.03 0.00 0.00 56.01 56.49 1h2y n LEU 622 Cb 0.57 -1.50 -0.00 0.00 -2.33 0.00 0.00 43.42 40.16 1h2y n LEU 622 CO 0.05 -0.09 1.14 -2.65 -1.33 0.00 0.00 177.39 174.51 1h2y n PRO 623 N 3.33 2.69 0.02 3.23 -0.02 -1.26 -4.91 135.00 138.07 1h2y n PRO 623 Ca 0.15 0.94 -0.11 0.00 -2.02 0.00 0.00 63.50 62.47 1h2y n PRO 623 Cb 0.32 -2.68 -0.05 0.00 -0.02 0.00 0.00 33.50 31.07 1h2y n PRO 623 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1h2y h GLU 624 N 3.02 -0.04 -6.75 -0.52 4.57 -1.91 -3.44 114.58 109.51 1h2y h GLU 624 Ca -0.51 0.00 -0.52 0.00 -1.18 0.00 0.00 59.36 57.16 1h2y h GLU 624 Cb 1.24 0.01 0.04 0.00 -0.16 0.00 0.00 28.75 29.88 1h2y h GLU 624 CO 0.64 -0.03 0.63 0.00 -1.18 0.00 0.00 179.01 179.07 1h2y s ALA 625 N -6.19 3.50 0.44 2.92 0.00 -1.26 -4.94 121.76 116.23 1h2y s ALA 625 Ca -0.13 1.12 0.09 0.00 0.00 0.00 0.00 51.96 53.04 1h2y s ALA 625 Cb 0.08 -3.46 0.96 0.00 0.00 0.00 0.00 23.12 20.70 1h2y s ALA 625 CO 0.67 -0.51 2.08 -0.44 0.00 0.00 0.00 175.76 177.55 1h2y h ASP 626 N 4.65 0.35 -0.23 0.00 3.32 -2.03 -2.07 116.42 120.41 1h2y h ASP 626 Ca -0.46 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1h2y h ASP 626 Cb 1.22 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1h2y h ASP 626 CO 0.73 0.26 0.00 -0.90 -1.72 0.00 0.00 179.24 177.60 1h2y n ASP 627 N -4.49 1.36 -4.13 6.45 5.75 -1.26 -4.81 116.55 115.42 1h2y n ASP 627 Ca 0.01 -2.03 -0.28 0.00 -0.01 0.00 0.00 54.79 52.49 1h2y n ASP 627 Cb 0.07 -0.19 -0.17 0.00 -1.03 0.00 0.00 41.12 39.80 1h2y n ASP 627 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1h2y s ILE 628 N -1.68 1.60 0.39 2.12 1.01 -0.78 -5.13 121.20 118.74 1h2y s ILE 628 Ca 0.16 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 60.08 1h2y s ILE 628 Cb 0.09 -1.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.12 1h2y s ILE 628 CO 0.10 0.46 0.10 0.00 0.00 0.00 0.00 174.94 175.60 1h2y s GLN 629 N 0.39 1.86 0.47 2.79 -2.07 -1.26 -4.56 119.66 117.29 1h2y s GLN 629 Ca -0.14 -2.11 -0.20 0.00 -1.82 0.00 0.00 55.36 51.09 1h2y s GLN 629 Cb -0.16 -0.71 -0.09 0.00 -1.09 0.00 0.00 33.01 30.96 1h2y s GLN 629 CO 0.06 -0.40 1.00 0.71 -1.32 0.00 0.00 175.29 175.34 1h2y s TYR 630 N -3.23 3.15 0.98 9.60 1.51 -1.26 -4.60 117.35 123.48 1h2y s TYR 630 Ca 0.26 1.58 -0.12 0.00 -1.01 0.00 0.00 57.07 57.78 1h2y s TYR 630 Cb 0.04 -2.96 0.18 0.00 -0.11 0.00 0.00 41.96 39.11 1h2y s TYR 630 CO 0.14 -0.55 1.09 -1.25 -1.11 0.00 0.00 175.55 173.87 1h2y s PRO 631 N -3.34 0.61 0.33 -1.71 0.04 -1.26 -4.64 135.00 125.03 1h2y s PRO 631 Ca 0.64 0.66 -0.29 0.00 0.04 0.00 0.00 61.00 62.06 1h2y s PRO 631 Cb -0.13 -1.75 -0.10 0.00 0.04 0.00 0.00 34.50 32.56 1h2y s PRO 631 CO 0.19 -2.65 1.32 -1.12 0.04 0.00 0.00 177.00 174.79 1h2y s SER 632 N -3.35 6.74 -0.01 6.66 0.01 -0.75 -4.81 113.70 118.18 1h2y s SER 632 Ca 0.65 2.71 0.02 0.00 1.31 0.00 0.00 55.95 60.64 1h2y s SER 632 Cb -0.19 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.39 1h2y s SER 632 CO 0.58 -0.56 -0.06 -0.04 0.41 0.00 0.00 173.24 173.57 1h2y s MET 633 N -1.78 0.54 -0.09 12.44 -1.94 -0.05 -0.59 119.30 127.83 1h2y s MET 633 Ca 0.49 -0.20 0.00 0.00 -1.71 0.00 0.00 55.69 54.28 1h2y s MET 633 Cb -0.40 -0.53 0.02 0.00 2.01 0.00 0.00 34.83 35.93 1h2y s MET 633 CO 0.53 0.10 -0.07 -1.17 -0.01 0.00 0.00 175.02 174.39 1h2y s LEU 634 N 0.04 1.22 -0.17 -0.03 2.96 -0.25 -0.71 118.68 121.74 1h2y s LEU 634 Ca -0.00 -0.27 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 1h2y s LEU 634 Cb -0.04 -0.77 -0.04 0.00 0.50 0.00 0.00 46.19 45.84 1h2y s LEU 634 CO -0.00 -0.09 0.06 -0.76 -1.32 0.00 0.00 176.35 174.23 1h2y s LEU 635 N 1.48 3.83 -0.17 -0.68 1.43 0.26 -1.37 118.68 123.46 1h2y s LEU 635 Ca 0.00 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1h2y s LEU 635 Cb -0.13 -1.95 0.01 0.00 0.03 0.00 0.00 46.19 44.14 1h2y s LEU 635 CO -0.05 0.22 -0.17 -0.76 0.23 0.00 0.00 176.35 175.82 1h2y s LEU 636 N 0.12 2.34 0.00 1.79 1.43 -0.49 -0.96 118.68 122.90 1h2y s LEU 636 Ca 0.05 -0.55 0.03 0.00 -1.03 0.00 0.00 54.13 52.63 1h2y s LEU 636 Cb -0.12 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 1h2y s LEU 636 CO 0.01 0.03 0.28 1.07 0.23 0.00 0.00 176.35 177.97 1h2y n THR 637 N 4.41 0.00 -3.81 5.49 5.66 -0.60 -0.05 114.28 125.37 1h2y n THR 637 Ca -0.20 -1.70 -0.12 0.00 -3.05 0.00 0.00 64.05 58.98 1h2y n THR 637 Cb 0.51 0.91 -0.09 0.00 -1.55 0.00 0.00 70.33 70.10 1h2y n THR 637 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1h2y s ALA 638 N -2.85 -0.55 -0.33 1.79 0.00 -1.26 -0.92 121.76 117.63 1h2y s ALA 638 Ca 0.28 0.08 0.24 0.00 0.00 0.00 0.00 51.96 52.56 1h2y s ALA 638 Cb 0.01 0.11 1.10 0.00 0.00 0.00 0.00 23.12 24.33 1h2y s ALA 638 CO 0.20 -0.24 1.74 0.38 0.00 0.00 0.00 175.76 177.83 1h2y h ASP 639 N 4.01 0.00 -0.35 0.00 3.04 -1.29 -2.20 116.42 119.63 1h2y h ASP 639 Ca -0.30 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.49 1h2y h ASP 639 Cb 1.19 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.48 1h2y h ASP 639 CO 0.41 0.00 0.00 1.41 -2.04 0.00 0.00 179.24 179.02 1h2y n HIS 640 N -2.33 1.01 -2.37 4.15 8.25 -0.14 -4.31 115.22 119.47 1h2y n HIS 640 Ca 0.01 -0.75 -0.37 0.00 -0.26 0.00 0.00 57.72 56.34 1h2y n HIS 640 Cb 0.18 -0.27 -0.03 0.00 1.12 0.00 0.00 29.99 30.99 1h2y n HIS 640 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1h2y s ASP 641 N -1.52 5.95 0.00 0.41 -1.08 -0.83 -4.07 116.67 115.53 1h2y s ASP 641 Ca 0.40 -0.81 0.23 0.00 -0.52 0.00 0.00 52.55 51.85 1h2y s ASP 641 Cb 0.30 -2.56 0.63 0.00 -1.46 0.00 0.00 42.92 39.83 1h2y s ASP 641 CO 0.13 -1.98 1.50 -0.90 0.52 0.00 0.00 175.17 174.43 1h2y n ASP 642 N 10.67 2.30 -0.06 -0.34 5.75 -1.25 -3.36 116.55 130.27 1h2y n ASP 642 Ca 0.26 -1.80 -0.06 0.00 -0.01 0.00 0.00 54.79 53.19 1h2y n ASP 642 Cb 0.50 -0.12 -0.04 0.00 -1.03 0.00 0.00 41.12 40.42 1h2y n ASP 642 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1h2y h ARG 643 N 3.17 0.00 -4.41 0.11 9.65 -1.93 -3.41 114.38 117.56 1h2y h ARG 643 Ca 0.00 0.00 -0.65 0.00 -1.10 0.00 0.00 59.98 58.23 1h2y h ARG 643 Cb 0.69 0.00 -0.40 0.00 -1.39 0.00 0.00 29.97 28.87 1h2y h ARG 643 CO 0.00 0.33 -0.71 0.08 2.80 0.00 0.00 179.97 182.48 1h2y s VAL 644 N -1.87 2.25 0.17 0.20 1.01 -1.26 -4.63 120.40 116.28 1h2y s VAL 644 Ca -0.09 -2.46 -0.33 0.00 0.00 0.00 0.00 61.98 59.10 1h2y s VAL 644 Cb -0.00 -2.65 -0.15 0.00 0.00 0.00 0.00 36.38 33.58 1h2y s VAL 644 CO 0.25 -0.64 1.35 1.33 0.00 0.00 0.00 175.10 177.39 1h2y n VAL 645 N 4.09 0.58 0.30 2.92 0.24 -1.21 -4.80 118.33 120.45 1h2y n VAL 645 Ca 0.04 -0.14 0.14 0.00 -2.04 0.00 0.00 64.34 62.34 1h2y n VAL 645 Cb 0.40 -1.16 0.77 0.00 -1.47 0.00 0.00 33.84 32.39 1h2y n VAL 645 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1h2y h PRO 646 N 4.32 0.00 -0.35 7.34 0.13 -1.82 -2.22 132.00 139.39 1h2y h PRO 646 Ca -0.45 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.78 1h2y h PRO 646 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1h2y h PRO 646 CO 0.77 0.00 0.32 1.37 -0.23 0.00 0.00 178.00 180.22 1h2y h LEU 647 N 0.00 0.00 0.23 1.56 8.10 -1.88 -0.46 115.31 122.85 1h2y h LEU 647 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.98 1h2y h LEU 647 Cb 0.57 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.79 1h2y h LEU 647 CO 0.00 0.00 -0.15 0.45 -4.11 0.00 0.00 178.44 174.63 1h2y h HIS 648 N 0.00 -0.38 -0.13 0.17 3.86 -1.71 -0.81 115.15 116.15 1h2y h HIS 648 Ca 0.17 -0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.23 1h2y h HIS 648 Cb 0.80 0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 1h2y h HIS 648 CO 0.00 -0.23 -0.52 0.77 0.86 0.00 0.00 177.93 178.81 1h2y h SER 649 N -0.37 0.39 -0.09 2.45 0.02 -1.39 -2.46 113.55 112.10 1h2y h SER 649 Ca -0.02 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.72 1h2y h SER 649 Cb 0.31 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 1h2y h SER 649 CO 0.01 0.84 0.02 -0.07 -1.14 0.00 0.00 176.83 176.50 1h2y h LEU 650 N 0.28 0.14 -0.72 5.07 3.38 -0.91 -1.16 115.31 121.38 1h2y h LEU 650 Ca 0.01 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.65 1h2y h LEU 650 Cb 1.01 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1h2y h LEU 650 CO 0.09 0.32 -0.16 0.11 0.09 0.00 0.00 178.44 178.89 1h2y h LYS 651 N -0.06 0.82 -0.24 1.13 1.57 -1.21 -2.20 116.57 116.37 1h2y h LYS 651 Ca 0.03 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 1h2y h LYS 651 Cb 0.24 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1h2y h LYS 651 CO -0.00 0.92 0.08 0.35 -0.57 0.00 0.00 179.45 180.23 1h2y h PHE 652 N 0.72 0.39 -0.31 -1.35 3.57 -1.34 -1.62 116.94 117.00 1h2y h PHE 652 Ca 0.11 -0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.46 1h2y h PHE 652 Cb 0.67 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 1h2y h PHE 652 CO 0.04 0.44 -0.26 0.97 -2.23 0.00 0.00 178.31 177.27 1h2y h ILE 653 N 0.23 1.27 -0.79 1.41 6.09 -1.13 -0.23 117.51 124.35 1h2y h ILE 653 Ca 0.08 -1.34 0.01 0.00 -1.37 0.00 0.00 64.86 62.25 1h2y h ILE 653 Cb 0.23 1.31 -0.04 0.00 0.47 0.00 0.00 36.82 38.79 1h2y h ILE 653 CO -0.00 0.43 0.52 0.00 -3.07 0.00 0.00 178.15 176.03 1h2y h ALA 654 N 1.18 1.02 -0.15 0.18 0.00 -1.21 0.04 119.26 120.31 1h2y h ALA 654 Ca 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1h2y h ALA 654 Cb 0.73 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1h2y h ALA 654 CO 0.06 0.39 -0.01 1.15 0.00 0.00 0.00 179.25 180.84 1h2y h THR 655 N 1.05 1.26 -0.37 0.00 2.02 -0.88 -1.39 112.91 114.60 1h2y h THR 655 Ca 0.30 -0.87 0.03 0.00 0.77 0.00 0.00 66.41 66.64 1h2y h THR 655 Cb -0.09 1.54 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1h2y h THR 655 CO -0.08 0.26 0.18 -0.07 0.37 0.00 0.00 175.52 176.18 1h2y h LEU 656 N 0.01 0.25 -1.09 2.58 3.38 -0.79 -0.33 115.31 119.32 1h2y h LEU 656 Ca 0.04 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1h2y h LEU 656 Cb 0.39 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1h2y h LEU 656 CO 0.01 0.19 -0.16 1.56 0.09 0.00 0.00 178.44 180.12 1h2y h GLN 657 N 0.37 0.45 0.07 1.13 4.20 -0.88 0.67 115.11 121.11 1h2y h GLN 657 Ca 0.16 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1h2y h GLN 657 Cb 0.08 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1h2y h GLN 657 CO -0.12 0.60 -0.03 -0.92 -0.67 0.00 0.00 178.83 177.69 1h2y h TYR 658 N 0.41 -0.09 -0.09 2.96 3.20 -0.84 -2.21 116.97 120.31 1h2y h TYR 658 Ca 0.07 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.90 1h2y h TYR 658 Cb 0.53 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 1h2y h TYR 658 CO 0.02 0.40 -0.09 0.82 -1.64 0.00 0.00 178.16 177.66 1h2y h ILE 659 N -0.94 1.37 0.00 1.81 1.08 -1.12 -3.28 117.51 116.42 1h2y h ILE 659 Ca -0.01 -1.26 -0.42 0.00 -0.39 0.00 0.00 64.86 62.79 1h2y h ILE 659 Cb 0.53 2.00 -0.07 0.00 -3.07 0.00 0.00 36.82 36.21 1h2y h ILE 659 CO 0.02 0.35 -2.48 0.52 -0.69 0.00 0.00 178.15 175.87 1h2y n VAL 660 N -4.67 1.51 -0.16 1.67 0.31 -0.41 -4.46 118.33 112.12 1h2y n VAL 660 Ca -0.07 -0.50 0.10 0.00 -0.01 0.00 0.00 64.34 63.87 1h2y n VAL 660 Cb 0.32 -1.61 0.42 0.00 -0.91 0.00 0.00 33.84 32.07 1h2y n VAL 660 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1h2y h GLY 661 N 0.81 0.85 2.00 2.92 0.00 -0.50 -1.91 103.07 107.23 1h2y h GLY 661 Ca -0.62 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.46 1h2y h GLY 661 CO -0.21 0.14 0.00 0.54 0.00 0.00 0.00 176.54 177.01 1h2y n ARG 662 N -4.49 0.17 -2.43 4.80 1.74 -0.87 -4.85 116.66 110.73 1h2y n ARG 662 Ca 0.12 0.29 -0.39 0.00 -0.77 0.00 0.00 57.85 57.10 1h2y n ARG 662 Cb 0.35 -1.76 -0.04 0.00 -1.02 0.00 0.00 32.46 30.00 1h2y n ARG 662 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1h2y s SER 663 N -4.03 6.98 0.28 0.55 1.04 -0.72 -4.96 113.70 112.85 1h2y s SER 663 Ca 0.08 2.27 -0.03 0.00 0.48 0.00 0.00 55.95 58.75 1h2y s SER 663 Cb 0.11 -2.62 0.41 0.00 0.10 0.00 0.00 66.02 64.02 1h2y s SER 663 CO 0.45 -0.35 1.94 0.03 0.98 0.00 0.00 173.24 176.30 1h2y h ARG 664 N 3.28 1.14 0.00 4.02 2.47 -1.88 -2.53 114.38 120.88 1h2y h ARG 664 Ca -0.48 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 1h2y h ARG 664 Cb 1.22 -0.26 0.00 0.00 -1.65 0.00 0.00 29.97 29.28 1h2y h ARG 664 CO 0.65 0.76 0.00 0.36 0.56 0.00 0.00 179.97 182.30 1h2y n LYS 665 N -4.42 0.12 -2.65 0.04 2.85 -1.26 -4.66 118.16 108.18 1h2y n LYS 665 Ca 0.11 0.23 -0.42 0.00 -1.05 0.00 0.00 58.31 57.18 1h2y n LYS 665 Cb 0.07 -1.68 -0.03 0.00 -0.65 0.00 0.00 35.03 32.74 1h2y n LYS 665 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1h2y s GLN 666 N -3.11 3.37 -0.06 -1.58 2.00 -0.96 -4.79 119.66 114.53 1h2y s GLN 666 Ca 0.09 -0.05 0.15 0.00 -2.00 0.00 0.00 55.36 53.55 1h2y s GLN 666 Cb 0.12 -4.08 -0.23 0.00 0.80 0.00 0.00 33.01 29.62 1h2y s GLN 666 CO 0.44 -1.77 0.26 0.09 -0.50 0.00 0.00 175.29 173.82 1h2y n ASN 667 N 8.42 1.34 -4.74 6.67 3.02 -1.26 -4.90 115.26 123.80 1h2y n ASN 667 Ca 0.05 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.19 1h2y n ASN 667 Cb 0.48 1.48 -0.04 0.00 -0.61 0.00 0.00 39.78 41.10 1h2y n ASN 667 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1h2y s ASN 668 N -4.13 7.22 0.51 6.41 0.01 -1.26 -4.69 114.94 119.01 1h2y s ASN 668 Ca -0.06 2.11 -0.21 0.00 -0.71 0.00 0.00 52.86 53.99 1h2y s ASN 668 Cb 0.09 -2.60 -0.07 0.00 0.41 0.00 0.00 41.25 39.07 1h2y s ASN 668 CO 0.65 -0.26 1.11 -2.16 -1.51 0.00 0.00 177.10 174.93 1h2y s PRO 669 N -0.28 3.58 -0.32 -0.60 0.04 -1.26 -4.80 135.00 131.36 1h2y s PRO 669 Ca 0.50 1.58 0.01 0.00 0.04 0.00 0.00 61.00 63.13 1h2y s PRO 669 Cb -0.30 -2.13 0.10 0.00 0.04 0.00 0.00 34.50 32.21 1h2y s PRO 669 CO 0.35 -0.66 0.08 -0.51 0.04 0.00 0.00 177.00 176.31 1h2y s LEU 670 N -3.52 3.12 0.25 -3.56 1.43 -1.26 -0.87 118.68 114.28 1h2y s LEU 670 Ca 0.69 -1.83 0.06 0.00 -1.03 0.00 0.00 54.13 52.02 1h2y s LEU 670 Cb -0.23 -1.13 -0.05 0.00 0.03 0.00 0.00 46.19 44.81 1h2y s LEU 670 CO 0.27 -0.40 -0.06 -0.76 0.23 0.00 0.00 176.35 175.63 1h2y s LEU 671 N 1.35 2.43 0.02 1.79 1.43 0.11 -4.87 118.68 120.94 1h2y s LEU 671 Ca 0.10 -1.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.06 1h2y s LEU 671 Cb -0.18 -0.54 -0.01 0.00 0.03 0.00 0.00 46.19 45.49 1h2y s LEU 671 CO -0.19 -0.36 -0.06 -0.51 0.23 0.00 0.00 176.35 175.46 1h2y s ILE 672 N -3.12 0.43 -0.11 -0.59 2.07 -1.26 -0.57 121.20 118.06 1h2y s ILE 672 Ca 0.28 -0.61 0.00 0.00 -1.41 0.00 0.00 60.65 58.91 1h2y s ILE 672 Cb 0.03 -0.44 0.02 0.00 0.13 0.00 0.00 42.46 42.21 1h2y s ILE 672 CO 0.10 -0.13 -0.10 -2.28 -1.91 0.00 0.00 174.94 170.62 1h2y s HIS 673 N -0.71 1.60 -0.31 3.50 5.65 -0.14 -4.40 115.29 120.49 1h2y s HIS 673 Ca -0.04 -0.78 -0.06 0.00 0.25 0.00 0.00 55.06 54.43 1h2y s HIS 673 Cb -0.06 -1.26 0.02 0.00 -1.18 0.00 0.00 32.58 30.10 1h2y s HIS 673 CO 0.00 -0.49 0.08 0.08 -0.65 0.00 0.00 174.74 173.76 1h2y s VAL 674 N 1.43 3.84 0.57 0.89 1.01 -1.26 -1.56 120.40 125.33 1h2y s VAL 674 Ca 0.01 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 1h2y s VAL 674 Cb -0.13 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 1h2y s VAL 674 CO -0.06 0.01 0.92 -0.62 0.00 0.00 0.00 175.10 175.35 1h2y s ASP 675 N 1.46 5.98 0.22 3.32 2.15 -0.10 -4.87 116.67 124.84 1h2y s ASP 675 Ca 0.01 1.03 0.07 0.00 0.43 0.00 0.00 52.55 54.10 1h2y s ASP 675 Cb -0.18 -2.13 -0.04 0.00 -0.30 0.00 0.00 42.92 40.27 1h2y s ASP 675 CO 0.02 -0.87 0.10 0.42 -0.17 0.00 0.00 175.17 174.67 1h2y s THR 676 N -3.00 4.09 -1.42 1.71 -4.23 -1.26 -1.27 115.64 110.27 1h2y s THR 676 Ca 0.52 -1.45 -0.11 0.00 -1.18 0.00 0.00 61.69 59.47 1h2y s THR 676 Cb -0.11 -3.15 0.08 0.00 1.34 0.00 0.00 72.50 70.66 1h2y s THR 676 CO 0.48 -0.26 0.65 0.29 -0.54 0.00 0.00 174.62 175.25 1h2y n LYS 677 N -0.73 -4.04 -3.99 3.99 5.02 -1.26 -4.93 118.16 112.22 1h2y n LYS 677 Ca -0.08 0.54 -0.09 0.00 -2.02 0.00 0.00 58.31 56.65 1h2y n LYS 677 Cb 0.57 -5.31 -0.08 0.00 -0.02 0.00 0.00 35.03 30.19 1h2y n LYS 677 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1h2y s ALA 678 N -3.08 0.17 0.00 7.82 0.00 -1.03 -4.42 121.76 121.22 1h2y s ALA 678 Ca 0.49 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1h2y s ALA 678 Cb -0.25 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.64 1h2y s ALA 678 CO 0.61 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.20 1h2y n GLY 679 N -0.15 5.60 0.37 0.00 0.00 -1.14 -0.97 105.19 108.89 1h2y n GLY 679 Ca -0.08 -1.05 0.07 0.00 0.00 0.00 0.00 46.02 44.96 1h2y n GLY 679 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1h2y h HIS 680 N 0.00 0.99 0.00 1.61 2.76 -1.78 -3.42 115.15 115.31 1h2y h HIS 680 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1h2y h HIS 680 Cb 0.00 -0.32 0.00 0.00 1.55 0.00 0.00 27.41 28.64 1h2y h HIS 680 CO 0.00 0.45 0.00 0.41 -1.30 0.00 0.00 177.93 177.49 1h2y n GLY 681 N -1.40 2.68 3.76 5.26 0.00 -1.26 -4.94 105.19 109.29 1h2y n GLY 681 Ca 0.16 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1h2y n GLY 681 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2y s ALA 682 N 0.00 3.68 0.00 4.61 0.00 -1.26 -1.97 121.76 126.82 1h2y s ALA 682 Ca 0.00 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1h2y s ALA 682 Cb 0.00 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1h2y s ALA 682 CO 0.00 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.21 1h2y n GLY 683 N 1.74 0.94 3.70 0.00 0.00 -1.26 -4.76 105.19 105.55 1h2y n GLY 683 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1h2y n GLY 683 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h2y s LYS 684 N -0.02 4.16 0.60 1.61 2.20 -0.83 -4.74 119.74 122.71 1h2y s LYS 684 Ca 0.00 2.50 -0.19 0.00 -0.36 0.00 0.00 55.97 57.92 1h2y s LYS 684 Cb 0.00 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.89 1h2y s LYS 684 CO 0.00 -0.76 1.26 -1.25 -0.36 0.00 0.00 175.35 174.24 1h2y s PRO 685 N 2.07 2.90 0.28 4.03 0.04 -1.26 -4.78 135.00 138.28 1h2y s PRO 685 Ca 0.76 1.96 0.02 0.00 0.04 0.00 0.00 61.00 63.79 1h2y s PRO 685 Cb -0.45 -1.97 0.67 0.00 0.04 0.00 0.00 34.50 32.79 1h2y s PRO 685 CO 0.34 -1.30 1.70 1.15 0.04 0.00 0.00 177.00 178.93 1h2y h THR 686 N 0.91 0.50 -0.73 1.26 2.02 -1.56 -0.60 112.91 114.72 1h2y h THR 686 Ca -0.51 -0.14 0.06 0.00 0.77 0.00 0.00 66.41 66.59 1h2y h THR 686 Cb 1.31 0.06 -0.06 0.00 -1.74 0.00 0.00 68.15 67.73 1h2y h THR 686 CO 0.55 0.07 0.43 0.00 0.37 0.00 0.00 175.52 176.94 1h2y h ALA 687 N 1.68 0.98 -0.29 6.16 0.00 -1.87 -0.61 119.26 125.31 1h2y h ALA 687 Ca 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.29 1h2y h ALA 687 Cb 0.98 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1h2y h ALA 687 CO -0.51 0.13 -0.44 0.87 0.00 0.00 0.00 179.25 179.30 1h2y h LYS 688 N 0.79 0.73 -0.51 0.00 1.57 -1.50 -2.28 116.57 115.36 1h2y h LYS 688 Ca 0.32 -0.40 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1h2y h LYS 688 Cb 0.16 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1h2y h LYS 688 CO -0.17 1.02 0.33 0.28 -0.57 0.00 0.00 179.45 180.35 1h2y h VAL 689 N 0.59 1.12 -0.56 0.50 2.07 -0.61 0.22 116.25 119.58 1h2y h VAL 689 Ca 0.04 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1h2y h VAL 689 Cb 1.00 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 1h2y h VAL 689 CO 0.09 0.12 0.29 0.40 0.02 0.00 0.00 177.57 178.50 1h2y h ILE 690 N 0.68 1.20 -0.69 4.57 2.04 -0.97 -1.72 117.51 122.62 1h2y h ILE 690 Ca 0.19 -0.53 -0.05 0.00 1.00 0.00 0.00 64.86 65.47 1h2y h ILE 690 Cb -0.06 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 1h2y h ILE 690 CO -0.05 0.22 0.22 -0.33 0.00 0.00 0.00 178.15 178.21 1h2y h GLU 691 N 0.76 1.07 -0.07 2.37 4.39 -1.03 -1.69 114.58 120.38 1h2y h GLU 691 Ca 0.20 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 1h2y h GLU 691 Cb 0.09 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1h2y h GLU 691 CO -0.03 0.92 0.04 1.49 -1.16 0.00 0.00 179.01 180.27 1h2y h GLU 692 N 1.01 0.09 -0.14 2.33 4.81 -0.55 -0.64 114.58 121.49 1h2y h GLU 692 Ca 0.22 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.35 1h2y h GLU 692 Cb 0.29 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1h2y h GLU 692 CO -0.01 0.15 -0.34 -0.39 -0.73 0.00 0.00 179.01 177.69 1h2y h VAL 693 N 0.01 1.28 -0.68 0.32 -1.51 -1.26 -1.34 116.25 113.08 1h2y h VAL 693 Ca 0.02 -1.36 -0.06 0.00 -1.23 0.00 0.00 66.70 64.07 1h2y h VAL 693 Cb 0.08 1.55 -0.03 0.00 -2.13 0.00 0.00 31.29 30.77 1h2y h VAL 693 CO -0.00 0.41 0.19 0.28 -1.23 0.00 0.00 177.57 177.22 1h2y h SER 694 N 0.24 0.99 -0.26 4.19 0.02 -1.06 -1.08 113.55 116.59 1h2y h SER 694 Ca 0.03 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.77 1h2y h SER 694 Cb 0.72 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 1h2y h SER 694 CO 0.05 0.94 0.07 0.44 -1.14 0.00 0.00 176.83 177.19 1h2y h ASP 695 N 1.01 0.39 0.21 3.07 3.32 -0.52 -1.44 116.42 122.47 1h2y h ASP 695 Ca 0.22 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 1h2y h ASP 695 Cb 0.32 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1h2y h ASP 695 CO -0.00 0.52 -0.15 0.24 -1.72 0.00 0.00 179.24 178.12 1h2y h MET 696 N 0.25 -0.35 0.00 3.56 2.86 -0.86 -0.82 114.93 119.57 1h2y h MET 696 Ca 0.08 0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.69 1h2y h MET 696 Cb 0.27 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1h2y h MET 696 CO 0.00 -0.23 -0.26 0.74 1.06 0.00 0.00 176.91 178.22 1h2y h PHE 697 N -0.36 0.00 -0.22 -0.22 0.04 -1.22 -1.62 116.94 113.33 1h2y h PHE 697 Ca -0.01 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.56 1h2y h PHE 697 Cb 0.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.47 1h2y h PHE 697 CO -0.10 0.26 -0.62 0.00 -0.60 0.00 0.00 178.31 177.25 1h2y h ALA 698 N 1.74 0.37 -0.14 2.45 0.00 -1.11 0.49 119.26 123.06 1h2y h ALA 698 Ca -0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1h2y h ALA 698 Cb 0.88 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1h2y h ALA 698 CO 0.03 0.64 0.09 0.35 0.00 0.00 0.00 179.25 180.36 1h2y h PHE 699 N 0.56 0.18 -0.15 0.00 3.57 -0.75 0.38 116.94 120.73 1h2y h PHE 699 Ca -0.01 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1h2y h PHE 699 Cb 1.24 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 1h2y h PHE 699 CO 0.08 0.13 0.06 0.82 -2.23 0.00 0.00 178.31 177.18 1h2y h ILE 700 N 0.17 0.98 -0.52 1.41 2.04 -1.20 -0.69 117.51 119.71 1h2y h ILE 700 Ca 0.05 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.92 1h2y h ILE 700 Cb 0.00 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 1h2y h ILE 700 CO -0.01 0.03 0.23 0.00 0.00 0.00 0.00 178.15 178.40 1h2y h ALA 701 N 1.08 0.66 -0.09 1.87 0.00 -0.66 -0.38 119.26 121.73 1h2y h ALA 701 Ca 0.06 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1h2y h ALA 701 Cb 0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1h2y h ALA 701 CO -0.05 -0.14 -0.10 -0.09 0.00 0.00 0.00 179.25 178.87 1h2y h ARG 702 N 0.45 0.22 -0.47 0.00 2.43 -0.67 0.46 114.38 116.80 1h2y h ARG 702 Ca 0.24 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 1h2y h ARG 702 Cb 0.20 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 1h2y h ARG 702 CO -0.20 0.66 0.01 0.00 -1.51 0.00 0.00 179.97 178.93 1h2y n LEU 704 N -4.23 2.62 -3.51 0.00 4.77 -0.17 -5.00 117.00 111.49 1h2y n LEU 704 Ca 0.03 -0.89 -0.24 0.00 -0.03 0.00 0.00 56.01 54.88 1h2y n LEU 704 Cb 0.29 -0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.43 1h2y n LEU 704 CO 0.41 0.44 -0.03 -3.20 -1.33 0.00 0.00 177.39 173.69 1h2y n ASN 705 N 0.93 -5.54 -4.77 -1.43 5.15 -0.00 -4.98 115.26 104.61 1h2y n ASN 705 Ca 0.14 -0.88 -0.36 0.00 -0.60 0.00 0.00 54.58 52.87 1h2y n ASN 705 Cb 0.54 -4.17 -0.07 0.00 -0.53 0.00 0.00 39.78 35.55 1h2y n ASN 705 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1h2y s ILE 706 N -3.45 5.34 0.25 -1.44 1.01 -0.30 -5.04 121.20 117.58 1h2y s ILE 706 Ca 0.43 0.42 -0.21 0.00 0.00 0.00 0.00 60.65 61.29 1h2y s ILE 706 Cb -0.11 -3.55 -0.09 0.00 0.01 0.00 0.00 42.46 38.72 1h2y s ILE 706 CO 0.81 0.47 0.78 -1.81 0.00 0.00 0.00 174.94 175.19 1h2y s ASP 707 N -0.02 7.12 0.23 3.58 1.01 -1.26 -4.85 116.67 122.49 1h2y s ASP 707 Ca 0.15 1.52 -0.30 0.00 0.71 0.00 0.00 52.55 54.63 1h2y s ASP 707 Cb -0.13 -2.46 -0.09 0.00 1.01 0.00 0.00 42.92 41.26 1h2y s ASP 707 CO 0.03 -0.00 1.08 0.86 0.21 0.00 0.00 175.17 177.36 1h2y s TRP 708 N -1.56 3.63 -0.36 4.23 -0.11 -1.26 -4.72 118.94 118.78 1h2y s TRP 708 Ca 0.45 1.68 -0.05 0.00 1.22 0.00 0.00 56.10 59.39 1h2y s TRP 708 Cb -0.17 -3.25 0.06 0.00 -1.50 0.00 0.00 33.47 28.61 1h2y s TRP 708 CO 0.21 -0.48 0.14 0.42 -4.62 0.00 0.00 176.95 172.62 1h2y s ILE 709 N -0.76 3.64 -0.77 5.86 1.01 0.31 -5.02 121.20 125.47 1h2y s ILE 709 Ca 0.46 -1.40 0.00 0.00 0.00 0.00 0.00 60.65 59.71 1h2y s ILE 709 Cb -0.30 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 38.99 1h2y s ILE 709 CO 0.37 -0.32 0.19 -2.65 0.00 0.00 0.00 174.94 172.53