#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d5a s ILE 2 N 0.00 4.32 -0.20 1.12 -1.09 -1.26 -1.49 121.20 122.59 1d5a s ILE 2 Ca 0.00 1.65 0.06 0.00 -2.23 0.00 0.00 60.65 60.13 1d5a s ILE 2 Cb 0.00 -4.06 -0.21 0.00 -1.58 0.00 0.00 42.46 36.61 1d5a s ILE 2 CO 0.00 0.04 0.02 0.18 -1.23 0.00 0.00 174.94 173.95 1d5a n LEU 3 N 4.75 1.92 0.00 2.97 4.77 0.11 -1.65 117.00 129.87 1d5a n LEU 3 Ca 0.10 -0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.06 1d5a n LEU 3 Cb 0.47 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1d5a n LEU 3 CO 0.55 0.76 0.72 -0.67 -1.33 0.00 0.00 177.39 177.41 1d5a n ASP 4 N -3.13 -1.27 -3.58 -1.43 4.64 -1.19 -4.54 116.55 106.06 1d5a n ASP 4 Ca -0.38 -1.57 -0.16 0.00 -1.38 0.00 0.00 54.79 51.30 1d5a n ASP 4 Cb 1.05 2.04 -0.07 0.00 -1.04 0.00 0.00 41.12 43.10 1d5a n ASP 4 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1d5a s ALA 5 N -1.82 -1.78 0.00 -1.67 0.00 -1.26 -1.09 121.76 114.14 1d5a s ALA 5 Ca 0.20 1.68 0.00 0.00 0.00 0.00 0.00 51.96 53.84 1d5a s ALA 5 Cb -0.02 -0.61 0.00 0.00 0.00 0.00 0.00 23.12 22.49 1d5a s ALA 5 CO 0.03 -0.35 0.00 -0.40 0.00 0.00 0.00 175.76 175.04 1d5a n ASP 6 N 1.82 0.00 -3.99 0.00 5.68 -0.56 -4.88 116.55 114.62 1d5a n ASP 6 Ca -0.16 -0.61 -0.09 0.00 -0.50 0.00 0.00 54.79 53.42 1d5a n ASP 6 Cb 0.56 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.46 1d5a n ASP 6 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 1d5a s TYR 7 N -5.82 0.43 0.18 2.11 -0.85 -1.26 -0.39 117.35 111.75 1d5a s TYR 7 Ca 0.00 -0.86 0.01 0.00 -0.52 0.00 0.00 57.07 55.70 1d5a s TYR 7 Cb 0.00 -0.21 -0.05 0.00 0.38 0.00 0.00 41.96 42.08 1d5a s TYR 7 CO 0.00 -0.55 0.04 0.96 -1.52 0.00 0.00 175.55 174.48 1d5a s ILE 8 N -3.94 0.49 -0.08 -3.49 -4.36 -0.47 -4.95 121.20 104.41 1d5a s ILE 8 Ca 0.12 -1.97 0.05 0.00 -0.26 0.00 0.00 60.65 58.59 1d5a s ILE 8 Cb 0.06 -2.22 -0.01 0.00 1.25 0.00 0.00 42.46 41.53 1d5a s ILE 8 CO -0.06 -0.36 -0.23 -0.89 0.24 0.00 0.00 174.94 173.65 1d5a s THR 9 N -3.79 2.22 -0.13 8.37 2.01 -1.26 -1.05 115.64 122.01 1d5a s THR 9 Ca 0.27 -0.99 -0.00 0.00 0.31 0.00 0.00 61.69 61.28 1d5a s THR 9 Cb 0.07 -1.83 0.03 0.00 0.01 0.00 0.00 72.50 70.77 1d5a s THR 9 CO 0.06 0.56 -0.07 -0.70 -0.69 0.00 0.00 174.62 173.78 1d5a s GLU 10 N -0.02 1.56 -1.45 4.92 2.12 -0.79 -4.77 118.70 120.27 1d5a s GLU 10 Ca -0.07 -0.36 -0.12 0.00 0.36 0.00 0.00 54.97 54.79 1d5a s GLU 10 Cb -0.15 -1.75 0.08 0.00 0.26 0.00 0.00 34.13 32.57 1d5a s GLU 10 CO 0.05 -0.31 0.72 -0.25 -0.54 0.00 0.00 175.26 174.93 1d5a n ASP 11 N 4.91 -4.38 0.00 -1.70 10.43 -1.26 -1.19 116.55 123.36 1d5a n ASP 11 Ca -0.13 -0.59 0.00 0.00 2.57 0.00 0.00 54.79 56.65 1d5a n ASP 11 Cb 0.49 -3.55 0.00 0.00 1.84 0.00 0.00 41.12 39.90 1d5a n ASP 11 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1d5a n GLY 12 N -1.43 0.82 3.52 0.44 0.00 -1.26 -5.04 105.19 102.24 1d5a n GLY 12 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1d5a n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5a s LYS 13 N -0.05 2.64 0.17 1.61 1.02 -0.34 -4.71 119.74 120.09 1d5a s LYS 13 Ca 0.00 -0.63 -0.30 0.00 0.02 0.00 0.00 55.97 55.06 1d5a s LYS 13 Cb 0.00 -2.48 -0.08 0.00 -0.52 0.00 0.00 37.83 34.75 1d5a s LYS 13 CO 0.00 0.63 1.21 -2.14 -0.92 0.00 0.00 175.35 174.13 1d5a s PRO 14 N -0.73 4.48 -0.13 -1.68 0.02 -1.26 -1.88 135.00 133.81 1d5a s PRO 14 Ca 0.11 1.88 -0.01 0.00 0.02 0.00 0.00 61.00 63.00 1d5a s PRO 14 Cb -0.11 -3.25 0.04 0.00 0.02 0.00 0.00 34.50 31.20 1d5a s PRO 14 CO 0.01 -0.12 -0.02 0.08 -0.33 0.00 0.00 177.00 176.61 1d5a s VAL 15 N 0.11 0.75 0.23 3.83 1.01 -0.22 -4.72 120.40 121.39 1d5a s VAL 15 Ca 0.54 -0.31 -0.30 0.00 0.00 0.00 0.00 61.98 61.92 1d5a s VAL 15 Cb -0.33 -0.95 -0.09 0.00 0.00 0.00 0.00 36.38 35.02 1d5a s VAL 15 CO 0.36 0.16 1.11 -0.63 0.00 0.00 0.00 175.10 176.09 1d5a s ILE 16 N 1.80 3.63 -0.16 2.22 -1.09 -0.35 -1.36 121.20 125.90 1d5a s ILE 16 Ca 0.03 1.53 0.01 0.00 -2.23 0.00 0.00 60.65 59.98 1d5a s ILE 16 Cb -0.14 -3.97 0.02 0.00 -1.58 0.00 0.00 42.46 36.78 1d5a s ILE 16 CO -0.07 0.32 -0.17 -0.13 -1.23 0.00 0.00 174.94 173.65 1d5a s ARG 17 N -0.94 2.64 -0.28 2.79 0.52 0.48 -1.94 118.95 122.21 1d5a s ARG 17 Ca 0.47 -0.69 -0.06 0.00 -0.52 0.00 0.00 55.73 54.93 1d5a s ARG 17 Cb -0.31 -2.30 0.01 0.00 0.52 0.00 0.00 34.95 32.87 1d5a s ARG 17 CO 0.38 -0.19 0.04 0.08 0.02 0.00 0.00 175.30 175.64 1d5a s VAL 18 N 1.29 3.71 -0.22 3.52 1.01 -0.38 -1.50 120.40 127.83 1d5a s VAL 18 Ca 0.03 -0.75 -0.24 0.00 0.00 0.00 0.00 61.98 61.02 1d5a s VAL 18 Cb -0.13 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 1d5a s VAL 18 CO -0.10 0.12 0.79 -0.36 0.00 0.00 0.00 175.10 175.55 1d5a s PHE 19 N 1.46 3.33 0.34 5.22 0.40 -0.25 -2.02 117.98 126.47 1d5a s PHE 19 Ca 0.02 1.10 0.09 0.00 -0.60 0.00 0.00 56.93 57.54 1d5a s PHE 19 Cb -0.17 -2.99 -0.06 0.00 0.51 0.00 0.00 43.02 40.30 1d5a s PHE 19 CO 0.01 -0.34 -0.08 0.15 0.70 0.00 0.00 175.22 175.66 1d5a s LYS 20 N 2.58 1.77 -0.30 0.44 1.02 -1.02 0.09 119.74 124.31 1d5a s LYS 20 Ca 0.34 -1.92 -0.03 0.00 0.02 0.00 0.00 55.97 54.38 1d5a s LYS 20 Cb -0.16 -1.57 0.11 0.00 -0.52 0.00 0.00 37.83 35.70 1d5a s LYS 20 CO 0.09 0.10 0.16 0.21 -0.92 0.00 0.00 175.35 174.98 1d5a s LYS 21 N -3.65 0.27 -0.18 1.68 2.47 -0.56 -1.58 119.74 118.19 1d5a s LYS 21 Ca 0.32 -0.66 0.01 0.00 -1.56 0.00 0.00 55.97 54.08 1d5a s LYS 21 Cb 0.03 -1.15 0.03 0.00 -1.46 0.00 0.00 37.83 35.29 1d5a s LYS 21 CO 0.16 -1.06 -0.17 -1.21 0.16 0.00 0.00 175.35 173.23 1d5a s GLU 22 N 1.92 2.65 -0.88 4.03 2.02 -0.09 -2.05 118.70 126.29 1d5a s GLU 22 Ca 0.11 -0.82 -0.06 0.00 0.02 0.00 0.00 54.97 54.22 1d5a s GLU 22 Cb -0.17 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1d5a s GLU 22 CO -0.29 -0.28 0.66 1.63 0.02 0.00 0.00 175.26 177.01 1d5a n LYS 23 N 4.64 -1.34 -1.32 1.61 4.01 -1.26 -1.67 118.16 122.83 1d5a n LYS 23 Ca -0.19 0.85 -0.12 0.00 -0.51 0.00 0.00 58.31 58.34 1d5a n LYS 23 Cb 0.49 -3.49 -0.05 0.00 -0.51 0.00 0.00 35.03 31.47 1d5a n LYS 23 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1d5a n GLY 24 N -1.72 1.17 3.01 0.72 0.00 -1.26 -4.95 105.19 102.16 1d5a n GLY 24 Ca -0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 1d5a n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d5a s GLU 25 N -2.98 2.14 0.19 1.61 0.41 -0.67 -5.11 118.70 114.29 1d5a s GLU 25 Ca 0.00 -0.51 -0.30 0.00 -0.41 0.00 0.00 54.97 53.76 1d5a s GLU 25 Cb 0.00 -1.95 -0.08 0.00 -1.78 0.00 0.00 34.13 30.32 1d5a s GLU 25 CO 0.00 -0.19 0.97 0.12 -0.49 0.00 0.00 175.26 175.67 1d5a s PHE 26 N 1.38 3.87 0.27 1.61 5.36 -1.26 -0.92 117.98 128.29 1d5a s PHE 26 Ca 0.02 1.84 -0.01 0.00 -0.96 0.00 0.00 56.93 57.82 1d5a s PHE 26 Cb -0.13 -3.05 -0.03 0.00 -0.34 0.00 0.00 43.02 39.47 1d5a s PHE 26 CO -0.08 0.23 0.28 0.15 -1.46 0.00 0.00 175.22 174.34 1d5a s LYS 27 N -0.70 1.53 -0.23 10.12 1.02 -0.62 -4.97 119.74 125.89 1d5a s LYS 27 Ca 0.44 -1.71 -0.03 0.00 0.02 0.00 0.00 55.97 54.69 1d5a s LYS 27 Cb -0.26 0.34 0.11 0.00 -0.52 0.00 0.00 37.83 37.50 1d5a s LYS 27 CO 0.32 -0.57 0.25 0.42 -0.92 0.00 0.00 175.35 174.85 1d5a s ILE 28 N -3.75 -0.37 -0.14 2.17 1.01 -1.26 -2.45 121.20 116.42 1d5a s ILE 28 Ca 0.36 -0.20 -0.21 0.00 0.00 0.00 0.00 60.65 60.59 1d5a s ILE 28 Cb 0.03 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 1d5a s ILE 28 CO 0.17 -0.26 0.62 -1.81 0.00 0.00 0.00 174.94 173.66 1d5a s ASP 29 N 2.35 6.79 0.01 3.58 1.01 -0.86 -4.90 116.67 124.66 1d5a s ASP 29 Ca 0.08 0.95 -0.01 0.00 0.71 0.00 0.00 52.55 54.28 1d5a s ASP 29 Cb -0.15 -2.36 -0.04 0.00 1.01 0.00 0.00 42.92 41.38 1d5a s ASP 29 CO -0.17 -0.16 0.16 -0.31 0.21 0.00 0.00 175.17 174.89 1d5a s TYR 30 N 1.26 3.46 -0.07 4.23 1.51 -1.26 -1.25 117.35 125.24 1d5a s TYR 30 Ca 0.31 0.29 -0.02 0.00 -1.01 0.00 0.00 57.07 56.64 1d5a s TYR 30 Cb -0.16 -1.79 0.03 0.00 -0.11 0.00 0.00 41.96 39.94 1d5a s TYR 30 CO 0.13 0.61 0.05 0.34 -1.11 0.00 0.00 175.55 175.57 1d5a s ASP 31 N -1.99 1.41 0.00 2.29 -1.08 -0.82 -4.99 116.67 111.50 1d5a s ASP 31 Ca 0.27 -0.06 0.19 0.00 -0.52 0.00 0.00 52.55 52.43 1d5a s ASP 31 Cb -0.12 -0.22 -0.18 0.00 -1.46 0.00 0.00 42.92 40.94 1d5a s ASP 31 CO 0.19 -0.25 0.81 0.54 0.52 0.00 0.00 175.17 176.98 1d5a n ARG 32 N 5.27 0.91 -0.92 4.34 1.74 -1.26 -1.21 116.66 125.54 1d5a n ARG 32 Ca -0.04 -0.10 0.05 0.00 -0.77 0.00 0.00 57.85 56.98 1d5a n ARG 32 Cb 0.50 -1.38 0.39 0.00 -1.02 0.00 0.00 32.46 30.95 1d5a n ARG 32 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1d5a n ASP 33 N -1.28 5.59 -4.75 0.55 8.00 -1.26 -4.91 116.55 118.49 1d5a n ASP 33 Ca 0.04 -2.99 -0.36 0.00 0.71 0.00 0.00 54.79 52.19 1d5a n ASP 33 Cb 0.30 -0.69 -0.07 0.00 -0.02 0.00 0.00 41.12 40.64 1d5a n ASP 33 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1d5a s PHE 34 N -2.82 3.47 -0.01 1.24 5.36 -1.26 -5.09 117.98 118.87 1d5a s PHE 34 Ca 0.55 0.52 0.07 0.00 -0.96 0.00 0.00 56.93 57.11 1d5a s PHE 34 Cb 0.42 -2.24 -0.02 0.00 -0.34 0.00 0.00 43.02 40.83 1d5a s PHE 34 CO 0.15 0.31 -0.23 -1.83 -1.46 0.00 0.00 175.22 172.17 1d5a s GLU 35 N 0.24 2.13 0.78 10.12 -1.05 -1.26 -4.94 118.70 124.73 1d5a s GLU 35 Ca 0.14 -0.92 -0.11 0.00 -0.15 0.00 0.00 54.97 53.93 1d5a s GLU 35 Cb -0.12 -2.11 0.06 0.00 -0.44 0.00 0.00 34.13 31.52 1d5a s GLU 35 CO 0.02 0.56 1.11 -2.14 0.95 0.00 0.00 175.26 175.76 1d5a s PRO 36 N -0.82 2.10 0.16 -4.83 0.02 -1.26 -4.92 135.00 125.46 1d5a s PRO 36 Ca 0.11 1.28 -0.23 0.00 0.02 0.00 0.00 61.00 62.17 1d5a s PRO 36 Cb -0.10 -1.87 0.08 0.00 0.02 0.00 0.00 34.50 32.62 1d5a s PRO 36 CO 0.00 -1.77 1.04 1.52 -0.33 0.00 0.00 177.00 177.46 1d5a s TYR 37 N -2.77 0.01 0.33 6.54 -0.85 -1.26 -2.19 117.35 117.16 1d5a s TYR 37 Ca 0.63 -0.37 -0.12 0.00 -0.52 0.00 0.00 57.07 56.69 1d5a s TYR 37 Cb -0.19 0.67 0.02 0.00 0.38 0.00 0.00 41.96 42.85 1d5a s TYR 37 CO 0.54 -0.85 0.62 0.96 -1.52 0.00 0.00 175.55 175.30 1d5a s ILE 38 N -2.46 0.00 0.09 -3.49 -4.36 -0.97 -4.75 121.20 105.26 1d5a s ILE 38 Ca 0.19 -1.26 0.08 0.00 -0.26 0.00 0.00 60.65 59.40 1d5a s ILE 38 Cb -0.02 -2.54 -0.03 0.00 1.25 0.00 0.00 42.46 41.12 1d5a s ILE 38 CO 0.04 0.00 -0.21 -0.31 0.24 0.00 0.00 174.94 174.70 1d5a s TYR 39 N -3.13 1.77 -0.00 1.37 1.51 -0.89 -1.68 117.35 116.29 1d5a s TYR 39 Ca 0.21 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.88 1d5a s TYR 39 Cb -0.03 -0.99 -0.01 0.00 -0.11 0.00 0.00 41.96 40.82 1d5a s TYR 39 CO 0.13 0.17 -0.07 0.00 -1.11 0.00 0.00 175.55 174.67 1d5a s ALA 40 N -1.07 0.61 -0.33 3.71 0.00 -0.48 -0.29 121.76 123.90 1d5a s ALA 40 Ca 0.06 -0.35 -0.09 0.00 0.00 0.00 0.00 51.96 51.59 1d5a s ALA 40 Cb -0.10 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.89 1d5a s ALA 40 CO 0.04 0.14 0.15 -1.17 0.00 0.00 0.00 175.76 174.92 1d5a s LEU 41 N -0.26 4.30 0.05 0.00 2.96 -0.53 -1.28 118.68 123.92 1d5a s LEU 41 Ca 0.02 -0.81 0.01 0.00 -0.22 0.00 0.00 54.13 53.13 1d5a s LEU 41 Cb -0.03 -1.97 -0.04 0.00 0.50 0.00 0.00 46.19 44.65 1d5a s LEU 41 CO -0.00 -0.28 0.10 -0.76 -1.32 0.00 0.00 176.35 174.09 1d5a s LEU 42 N 1.54 3.92 0.16 -0.68 1.02 -1.26 -1.83 118.68 121.55 1d5a s LEU 42 Ca 0.02 0.09 -0.09 0.00 0.02 0.00 0.00 54.13 54.17 1d5a s LEU 42 Cb -0.18 -2.48 0.01 0.00 0.02 0.00 0.00 46.19 43.56 1d5a s LEU 42 CO 0.05 0.21 1.50 0.11 0.02 0.00 0.00 176.35 178.24 1d5a h LYS 43 N 3.56 0.87 -4.54 1.70 1.57 -1.86 -3.42 116.57 114.44 1d5a h LYS 43 Ca -0.47 -0.46 -0.58 0.00 -1.87 0.00 0.00 60.65 57.28 1d5a h LYS 43 Cb 1.17 0.02 -0.36 0.00 0.08 0.00 0.00 32.23 33.14 1d5a h LYS 43 CO 0.66 1.10 -0.82 0.34 -0.57 0.00 0.00 179.45 180.16 1d5a s ASP 44 N -6.85 2.48 0.00 0.86 2.15 -1.26 -5.01 116.67 109.04 1d5a s ASP 44 Ca -0.10 -0.42 0.01 0.00 0.43 0.00 0.00 52.55 52.47 1d5a s ASP 44 Cb 0.11 -1.06 0.05 0.00 -0.30 0.00 0.00 42.92 41.73 1d5a s ASP 44 CO 0.87 -0.07 0.25 -0.67 -0.17 0.00 0.00 175.17 175.39 1d5a n ASP 45 N 4.74 0.00 0.00 -0.34 -0.08 -1.26 -0.99 116.55 118.62 1d5a n ASP 45 Ca -0.16 -0.26 0.00 0.00 -1.51 0.00 0.00 54.79 52.86 1d5a n ASP 45 Cb 0.50 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.96 1d5a n ASP 45 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1d5a n SER 46 N -0.59 1.11 -0.95 1.67 3.41 -1.26 -4.61 113.62 112.39 1d5a n SER 46 Ca 0.01 -1.36 0.05 0.00 -0.26 0.00 0.00 58.87 57.30 1d5a n SER 46 Cb 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.14 1d5a n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1d5a n ALA 47 N -0.18 2.85 0.10 7.33 0.00 -0.16 -4.22 120.51 126.23 1d5a n ALA 47 Ca 0.00 -0.80 -0.23 0.00 0.00 0.00 0.00 53.44 52.40 1d5a n ALA 47 Cb 0.19 -1.02 -0.15 0.00 0.00 0.00 0.00 19.45 18.46 1d5a n ALA 47 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 1d5a h ILE 48 N 2.04 1.26 -0.23 0.00 -0.00 -1.82 -3.23 117.51 115.53 1d5a h ILE 48 Ca 0.00 -2.61 0.07 0.00 -0.00 0.00 0.00 64.86 62.32 1d5a h ILE 48 Cb 0.90 3.01 -0.01 0.00 -0.00 0.00 0.00 36.82 40.72 1d5a h ILE 48 CO 0.13 0.79 0.19 -0.33 -0.00 0.00 0.00 178.15 178.94 1d5a h GLU 49 N -0.01 0.00 0.00 0.16 4.39 -1.95 0.38 114.58 117.55 1d5a h GLU 49 Ca -0.25 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.33 1d5a h GLU 49 Cb 2.01 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.64 1d5a h GLU 49 CO 0.22 0.00 -0.58 0.22 -1.16 0.00 0.00 179.01 177.71 1d5a h ASP 50 N 0.00 0.00 0.50 1.42 3.58 -1.85 -3.26 116.42 116.81 1d5a h ASP 50 Ca 0.11 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.26 1d5a h ASP 50 Cb 0.50 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.54 1d5a h ASP 50 CO -0.00 0.58 -1.48 0.40 -2.88 0.00 0.00 179.24 175.86 1d5a h ILE 51 N 0.00 1.21 0.00 2.25 2.04 -0.37 -3.24 117.51 119.40 1d5a h ILE 51 Ca -0.01 -2.85 0.00 0.00 1.00 0.00 0.00 64.86 63.00 1d5a h ILE 51 Cb 1.33 2.77 0.00 0.00 -0.74 0.00 0.00 36.82 40.18 1d5a h ILE 51 CO 0.08 0.82 0.00 0.29 0.00 0.00 0.00 178.15 179.34 1d5a n LYS 52 N -3.44 0.05 0.00 2.37 5.02 0.01 -0.72 118.16 121.46 1d5a n LYS 52 Ca -0.15 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.20 1d5a n LYS 52 Cb 1.04 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 34.72 1d5a n LYS 52 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1d5a n LYS 53 N -0.85 1.27 -2.17 1.97 5.02 -1.22 -4.54 118.16 117.63 1d5a n LYS 53 Ca 0.01 -0.90 -0.40 0.00 -2.02 0.00 0.00 58.31 55.00 1d5a n LYS 53 Cb 0.00 -1.16 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1d5a n LYS 53 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1d5a s ILE 54 N -1.15 2.84 0.22 -0.18 -1.09 0.10 -5.02 121.20 116.92 1d5a s ILE 54 Ca 0.11 0.80 -0.00 0.00 -2.23 0.00 0.00 60.65 59.33 1d5a s ILE 54 Cb 0.09 -3.49 -0.04 0.00 -1.58 0.00 0.00 42.46 37.43 1d5a s ILE 54 CO 0.20 0.16 0.12 0.42 -1.23 0.00 0.00 174.94 174.60 1d5a s THR 55 N -1.21 0.19 0.36 2.92 -4.23 -1.26 -4.37 115.64 108.04 1d5a s THR 55 Ca 0.51 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.90 1d5a s THR 55 Cb -0.37 -2.53 0.04 0.00 1.34 0.00 0.00 72.50 70.98 1d5a s THR 55 CO 0.49 -0.02 0.69 0.00 -0.54 0.00 0.00 174.62 175.24 1d5a s ALA 56 N -4.02 -0.42 -0.03 3.99 0.00 -1.01 -4.95 121.76 115.32 1d5a s ALA 56 Ca 0.38 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.47 1d5a s ALA 56 Cb 0.07 0.82 0.01 0.00 0.00 0.00 0.00 23.12 24.03 1d5a s ALA 56 CO 0.12 -0.94 -0.07 -1.83 0.00 0.00 0.00 175.76 173.05 1d5a s GLU 57 N -2.74 0.82 -0.20 0.00 -1.05 -1.26 -0.25 118.70 114.02 1d5a s GLU 57 Ca 0.19 -0.20 -0.04 0.00 -0.15 0.00 0.00 54.97 54.77 1d5a s GLU 57 Cb -0.04 -0.79 0.10 0.00 -0.44 0.00 0.00 34.13 32.96 1d5a s GLU 57 CO 0.13 0.03 0.29 -0.98 0.95 0.00 0.00 175.26 175.68 1d5a s ARG 58 N 0.43 0.24 -1.18 -4.83 1.04 -0.99 -4.93 118.95 108.73 1d5a s ARG 58 Ca -0.06 0.43 -0.03 0.00 -1.04 0.00 0.00 55.73 55.03 1d5a s ARG 58 Cb -0.10 -0.72 0.00 0.00 -2.04 0.00 0.00 34.95 32.09 1d5a s ARG 58 CO 0.00 -0.57 1.01 0.72 -0.04 0.00 0.00 175.30 176.42 1d5a n HIS 59 N 5.34 -2.30 -0.95 5.89 8.25 -1.26 -2.78 115.22 127.41 1d5a n HIS 59 Ca -0.05 0.91 0.00 0.00 -0.26 0.00 0.00 57.72 58.32 1d5a n HIS 59 Cb 0.50 -4.88 0.00 0.00 1.12 0.00 0.00 29.99 26.73 1d5a n HIS 59 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d5a n GLY 60 N -1.41 0.64 3.69 -1.41 0.00 -1.26 -5.02 105.19 100.43 1d5a n GLY 60 Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 1d5a n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d5a s THR 61 N -2.74 3.90 -0.22 2.61 2.01 -1.12 -5.11 115.64 114.96 1d5a s THR 61 Ca 0.00 -1.35 -0.11 0.00 0.31 0.00 0.00 61.69 60.54 1d5a s THR 61 Cb 0.00 -2.97 -0.05 0.00 0.01 0.00 0.00 72.50 69.49 1d5a s THR 61 CO 0.00 -0.11 0.18 -0.89 -0.69 0.00 0.00 174.62 173.10 1d5a s THR 62 N -1.74 5.36 -0.17 -0.82 2.01 -1.26 -2.34 115.64 116.67 1d5a s THR 62 Ca 0.28 0.24 -0.13 0.00 0.31 0.00 0.00 61.69 62.39 1d5a s THR 62 Cb -0.09 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 68.85 1d5a s THR 62 CO 0.20 0.37 0.26 -0.69 -0.69 0.00 0.00 174.62 174.07 1d5a s VAL 63 N 0.86 5.32 0.14 3.82 1.01 0.65 -4.96 120.40 127.24 1d5a s VAL 63 Ca 0.09 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.55 1d5a s VAL 63 Cb -0.13 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1d5a s VAL 63 CO 0.03 0.39 0.01 -0.13 0.00 0.00 0.00 175.10 175.40 1d5a s ARG 64 N 0.52 0.96 -0.42 2.72 0.52 -1.26 -2.40 118.95 119.59 1d5a s ARG 64 Ca 0.15 -1.44 -0.27 0.00 -0.52 0.00 0.00 55.73 53.65 1d5a s ARG 64 Cb -0.13 -0.02 0.02 0.00 0.52 0.00 0.00 34.95 35.34 1d5a s ARG 64 CO 0.03 -0.16 0.99 0.08 0.02 0.00 0.00 175.30 176.26 1d5a s VAL 65 N -3.82 4.45 0.14 3.52 1.01 -1.26 -4.50 120.40 119.93 1d5a s VAL 65 Ca 0.21 1.12 -0.15 0.00 0.00 0.00 0.00 61.98 63.17 1d5a s VAL 65 Cb 0.07 -4.44 0.01 0.00 0.00 0.00 0.00 36.38 32.02 1d5a s VAL 65 CO 0.01 -0.74 1.67 0.74 0.00 0.00 0.00 175.10 176.78 1d5a h THR 66 N 5.99 1.22 -1.95 3.92 2.02 -1.23 -3.48 112.91 119.40 1d5a h THR 66 Ca -0.23 -0.72 0.20 0.00 0.77 0.00 0.00 66.41 66.43 1d5a h THR 66 Cb 1.07 0.83 -0.14 0.00 -1.74 0.00 0.00 68.15 68.18 1d5a h THR 66 CO 1.04 0.26 0.63 0.00 0.37 0.00 0.00 175.52 177.81 1d5a s ARG 67 N -5.44 0.71 0.08 6.66 1.70 -1.25 -5.00 118.95 116.41 1d5a s ARG 67 Ca -0.13 -0.33 0.03 0.00 -0.47 0.00 0.00 55.73 54.83 1d5a s ARG 67 Cb 0.11 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.74 1d5a s ARG 67 CO 0.77 -0.32 -0.08 0.00 -1.08 0.00 0.00 175.30 174.59 1d5a s ALA 68 N -2.87 0.94 -0.07 7.88 0.00 -1.26 -1.42 121.76 124.95 1d5a s ALA 68 Ca 0.09 -1.14 -0.07 0.00 0.00 0.00 0.00 51.96 50.85 1d5a s ALA 68 Cb -0.00 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.22 1d5a s ALA 68 CO -0.04 -0.10 0.20 -1.21 0.00 0.00 0.00 175.76 174.60 1d5a s GLU 69 N -2.85 0.22 -0.05 0.00 2.02 -0.81 -4.97 118.70 112.27 1d5a s GLU 69 Ca 0.04 0.29 -0.24 0.00 0.02 0.00 0.00 54.97 55.08 1d5a s GLU 69 Cb -0.02 0.09 -0.04 0.00 0.10 0.00 0.00 34.13 34.26 1d5a s GLU 69 CO -0.02 -0.04 0.71 0.50 0.02 0.00 0.00 175.26 176.43 1d5a s ARG 70 N 0.21 4.44 0.03 1.61 3.52 -1.26 -0.24 118.95 127.26 1d5a s ARG 70 Ca -0.01 0.90 0.05 0.00 -0.13 0.00 0.00 55.73 56.54 1d5a s ARG 70 Cb -0.02 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.92 1d5a s ARG 70 CO -0.00 0.11 -0.14 0.08 -0.81 0.00 0.00 175.30 174.54 1d5a s VAL 71 N 0.64 1.08 -0.25 7.11 1.01 0.57 -4.95 120.40 125.61 1d5a s VAL 71 Ca 0.38 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 1d5a s VAL 71 Cb -0.18 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 1d5a s VAL 71 CO 0.19 0.03 0.19 -0.54 0.00 0.00 0.00 175.10 174.97 1d5a s LYS 72 N -1.04 4.05 0.00 2.72 1.02 -1.26 -2.21 119.74 123.03 1d5a s LYS 72 Ca 0.02 -0.23 0.00 0.00 0.02 0.00 0.00 55.97 55.77 1d5a s LYS 72 Cb -0.07 -3.57 0.00 0.00 -0.52 0.00 0.00 37.83 33.67 1d5a s LYS 72 CO 0.01 -0.00 0.00 1.63 -0.92 0.00 0.00 175.35 176.07 1d5a n LYS 73 N 4.48 0.39 -3.90 1.68 5.02 -1.01 -5.03 118.16 119.78 1d5a n LYS 73 Ca -0.14 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.03 1d5a n LYS 73 Cb 0.52 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 35.39 1d5a n LYS 73 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1d5a s LYS 74 N -0.05 0.06 -0.09 1.97 1.02 -1.12 -2.14 119.74 119.39 1d5a s LYS 74 Ca 0.00 -0.09 -0.01 0.00 0.02 0.00 0.00 55.97 55.89 1d5a s LYS 74 Cb 0.00 -0.01 0.03 0.00 -0.52 0.00 0.00 37.83 37.32 1d5a s LYS 74 CO 0.00 0.00 -0.03 0.12 -0.92 0.00 0.00 175.35 174.52 1d5a s PHE 75 N -0.18 1.06 -1.57 3.18 5.36 -0.36 -0.54 117.98 124.93 1d5a s PHE 75 Ca -0.02 -0.45 -0.07 0.00 -0.96 0.00 0.00 56.93 55.43 1d5a s PHE 75 Cb -0.01 -1.01 0.07 0.00 -0.34 0.00 0.00 43.02 41.72 1d5a s PHE 75 CO -0.00 -0.42 0.43 1.28 -1.46 0.00 0.00 175.22 175.05 1d5a n LEU 76 N 5.05 -1.65 0.00 6.12 4.32 -1.26 -2.49 117.00 127.09 1d5a n LEU 76 Ca -0.10 -1.10 0.00 0.00 -0.02 0.00 0.00 56.01 54.80 1d5a n LEU 76 Cb 0.50 -1.97 0.00 0.00 -1.62 0.00 0.00 43.42 40.32 1d5a n LEU 76 CO 0.13 0.37 0.00 0.61 -1.22 0.00 0.00 177.39 177.29 1d5a n GLY 77 N -1.89 1.95 3.68 -0.72 0.00 -1.26 -4.68 105.19 102.27 1d5a n GLY 77 Ca -0.17 -0.47 -0.47 0.00 0.00 0.00 0.00 46.02 44.91 1d5a n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5a n ARG 78 N 0.00 2.21 -2.05 1.61 1.74 -1.04 -4.89 116.66 114.25 1d5a n ARG 78 Ca 0.00 0.81 -0.36 0.00 -0.77 0.00 0.00 57.85 57.52 1d5a n ARG 78 Cb 0.00 -2.63 0.03 0.00 -1.02 0.00 0.00 32.46 28.84 1d5a n ARG 78 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1d5a s PRO 79 N 2.80 3.10 0.08 5.56 0.04 -1.26 -1.22 135.00 144.09 1d5a s PRO 79 Ca 0.87 1.83 -0.08 0.00 0.04 0.00 0.00 61.00 63.65 1d5a s PRO 79 Cb -0.67 -2.00 -0.00 0.00 0.04 0.00 0.00 34.50 31.86 1d5a s PRO 79 CO 0.45 -1.11 0.18 0.54 0.04 0.00 0.00 177.00 177.11 1d5a s VAL 80 N -1.58 0.14 -0.15 -0.36 0.11 -0.91 -4.82 120.40 112.82 1d5a s VAL 80 Ca 0.75 -1.16 -0.06 0.00 -2.93 0.00 0.00 61.98 58.59 1d5a s VAL 80 Cb -0.30 -1.27 -0.04 0.00 -1.53 0.00 0.00 36.38 33.24 1d5a s VAL 80 CO 0.33 -0.64 0.04 -1.61 -3.33 0.00 0.00 175.10 169.89 1d5a s GLU 81 N -3.64 3.70 0.09 1.54 0.41 -1.26 -2.41 118.70 117.12 1d5a s GLU 81 Ca 0.03 -0.38 -0.09 0.00 -0.41 0.00 0.00 54.97 54.12 1d5a s GLU 81 Cb 0.04 -3.07 0.00 0.00 -1.78 0.00 0.00 34.13 29.32 1d5a s GLU 81 CO -0.10 0.38 0.21 0.14 -0.49 0.00 0.00 175.26 175.40 1d5a s VAL 82 N 0.05 0.14 -0.12 2.63 -7.23 -0.94 -4.72 120.40 110.20 1d5a s VAL 82 Ca 0.04 -1.12 -0.04 0.00 -1.81 0.00 0.00 61.98 59.05 1d5a s VAL 82 Cb -0.12 -1.32 -0.04 0.00 0.56 0.00 0.00 36.38 35.46 1d5a s VAL 82 CO 0.01 -0.62 0.05 0.26 -0.31 0.00 0.00 175.10 174.49 1d5a s TRP 83 N -3.83 3.28 -0.30 2.82 0.52 -0.40 -0.31 118.94 120.71 1d5a s TRP 83 Ca 0.05 0.22 -0.13 0.00 0.02 0.00 0.00 56.10 56.25 1d5a s TRP 83 Cb 0.04 -1.90 -0.03 0.00 -1.15 0.00 0.00 33.47 30.43 1d5a s TRP 83 CO -0.11 0.43 0.29 0.21 0.02 0.00 0.00 176.95 177.79 1d5a s LYS 84 N -0.55 3.79 -0.27 4.98 2.20 0.66 -1.38 119.74 129.16 1d5a s LYS 84 Ca 0.10 -0.31 -0.07 0.00 -0.36 0.00 0.00 55.97 55.33 1d5a s LYS 84 Cb -0.12 -3.72 -0.01 0.00 -1.51 0.00 0.00 37.83 32.47 1d5a s LYS 84 CO 0.02 -0.34 0.07 -0.51 -0.36 0.00 0.00 175.35 174.23 1d5a s LEU 85 N 1.90 3.64 0.32 5.43 1.43 -0.68 -1.92 118.68 128.80 1d5a s LEU 85 Ca 0.10 -0.49 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1d5a s LEU 85 Cb -0.16 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1d5a s LEU 85 CO 0.11 -0.12 0.56 -0.31 0.23 0.00 0.00 176.35 176.82 1d5a s TYR 86 N 1.55 3.49 0.36 0.29 1.51 -0.51 -2.28 117.35 121.75 1d5a s TYR 86 Ca 0.04 0.56 0.05 0.00 -1.01 0.00 0.00 57.07 56.71 1d5a s TYR 86 Cb -0.16 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.62 1d5a s TYR 86 CO 0.03 0.13 0.18 1.19 -1.11 0.00 0.00 175.55 175.96 1d5a n PHE 87 N -1.29 -0.15 -0.10 2.71 3.01 -0.93 -0.70 117.46 120.01 1d5a n PHE 87 Ca -0.03 -2.50 -0.21 0.00 1.01 0.00 0.00 57.45 55.72 1d5a n PHE 87 Cb 0.55 0.08 -0.12 0.00 -0.01 0.00 0.00 39.48 39.98 1d5a n PHE 87 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1d5a h THR 88 N 1.75 0.95 -4.48 4.37 2.02 -1.89 -3.36 112.91 112.27 1d5a h THR 88 Ca -0.27 -2.19 -0.68 0.00 0.77 0.00 0.00 66.41 64.03 1d5a h THR 88 Cb 1.13 2.29 -0.30 0.00 -1.74 0.00 0.00 68.15 69.52 1d5a h THR 88 CO 0.42 0.34 -0.88 -2.28 0.37 0.00 0.00 175.52 173.49 1d5a s HIS 89 N -2.36 2.27 0.55 3.16 5.65 -1.26 -4.48 115.29 118.82 1d5a s HIS 89 Ca -0.28 -0.47 0.24 0.00 0.25 0.00 0.00 55.06 54.80 1d5a s HIS 89 Cb 0.05 -1.47 1.46 0.00 -1.18 0.00 0.00 32.58 31.44 1d5a s HIS 89 CO 0.60 -0.07 2.07 -1.00 -0.65 0.00 0.00 174.74 175.69 1d5a h PRO 90 N 5.61 0.00 0.00 2.88 0.13 -1.96 -0.43 132.00 138.22 1d5a h PRO 90 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1d5a h PRO 90 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1d5a h PRO 90 CO 0.47 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.20 1d5a h GLN 91 N 0.00 0.00 -0.55 0.86 1.08 -2.01 -2.93 115.11 111.56 1d5a h GLN 91 Ca 0.13 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.26 1d5a h GLN 91 Cb 0.58 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.99 1d5a h GLN 91 CO -0.00 0.00 0.06 -0.44 -0.95 0.00 0.00 178.83 177.50 1d5a h ASP 92 N 0.00 0.89 -0.59 1.46 3.32 -1.49 -3.30 116.42 116.71 1d5a h ASP 92 Ca 0.00 -0.27 0.12 0.00 0.02 0.00 0.00 57.03 56.89 1d5a h ASP 92 Cb 0.40 -0.24 -0.12 0.00 0.22 0.00 0.00 39.33 39.59 1d5a h ASP 92 CO 0.00 0.94 -0.23 0.58 -1.72 0.00 0.00 179.24 178.81 1d5a h VAL 93 N 0.81 0.29 0.00 -1.35 2.07 -1.66 0.89 116.25 117.30 1d5a h VAL 93 Ca 0.16 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.67 1d5a h VAL 93 Cb 0.45 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1d5a h VAL 93 CO 0.02 0.00 -0.05 -0.65 0.02 0.00 0.00 177.57 176.90 1d5a h PRO 94 N -0.08 0.00 0.15 1.57 0.11 -1.76 -1.75 132.00 130.25 1d5a h PRO 94 Ca 0.27 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 66.11 1d5a h PRO 94 Cb 0.50 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.62 1d5a h PRO 94 CO -0.65 0.05 -1.28 0.00 -0.21 0.00 0.00 178.00 175.92 1d5a h ALA 95 N 1.95 0.04 -0.39 -0.75 0.00 -1.00 -3.39 119.26 115.71 1d5a h ALA 95 Ca -0.00 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.97 1d5a h ALA 95 Cb 0.19 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1d5a h ALA 95 CO 0.01 0.69 0.00 1.51 0.00 0.00 0.00 179.25 181.46 1d5a n ILE 96 N -3.91 0.60 0.12 0.00 3.06 -0.50 -4.57 119.36 114.15 1d5a n ILE 96 Ca -0.20 -0.80 -0.23 0.00 -2.50 0.00 0.00 62.75 59.01 1d5a n ILE 96 Cb 0.93 0.87 -0.15 0.00 0.54 0.00 0.00 39.64 41.82 1d5a n ILE 96 CO 0.00 0.00 0.00 0.08 -2.50 0.00 0.00 176.55 174.13 1d5a h ARG 97 N 3.78 0.47 -0.12 9.51 0.11 -1.51 -3.04 114.38 123.57 1d5a h ARG 97 Ca 0.00 -0.80 -0.01 0.00 0.10 0.00 0.00 59.98 59.27 1d5a h ARG 97 Cb 0.89 0.30 -0.01 0.00 1.11 0.00 0.00 29.97 32.26 1d5a h ARG 97 CO 0.00 1.38 0.02 -0.44 0.10 0.00 0.00 179.97 181.02 1d5a h ASP 98 N 0.13 0.14 1.62 0.08 3.32 -1.82 -1.42 116.42 118.47 1d5a h ASP 98 Ca -0.29 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.71 1d5a h ASP 98 Cb 2.13 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 41.64 1d5a h ASP 98 CO 0.23 0.16 -0.39 0.11 -1.72 0.00 0.00 179.24 177.64 1d5a h LYS 99 N 0.16 0.00 0.00 3.56 1.57 -1.85 -3.23 116.57 116.79 1d5a h LYS 99 Ca 0.04 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.65 1d5a h LYS 99 Cb 0.09 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1d5a h LYS 99 CO -0.00 0.17 -0.82 0.82 -0.57 0.00 0.00 179.45 179.05 1d5a h ILE 100 N 0.00 1.48 -0.57 1.86 2.04 -1.14 -3.17 117.51 118.00 1d5a h ILE 100 Ca -0.01 -2.92 0.00 0.00 1.00 0.00 0.00 64.86 62.93 1d5a h ILE 100 Cb 1.16 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 39.86 1d5a h ILE 100 CO 0.02 0.80 0.00 -2.11 0.00 0.00 0.00 178.15 176.87 1d5a n ARG 101 N -3.40 4.27 -0.02 2.37 1.85 -1.03 -3.80 116.66 116.90 1d5a n ARG 101 Ca 0.00 -3.02 0.06 0.00 -1.00 0.00 0.00 57.85 53.89 1d5a n ARG 101 Cb 0.83 -2.08 -0.14 0.00 -1.05 0.00 0.00 32.46 30.02 1d5a n ARG 101 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1d5a n GLU 102 N 0.71 0.66 -1.92 2.89 4.07 -1.20 -4.92 120.64 120.93 1d5a n GLU 102 Ca 0.26 -0.14 -0.39 0.00 -0.06 0.00 0.00 57.16 56.83 1d5a n GLU 102 Cb 1.05 -1.43 0.01 0.00 -0.06 0.00 0.00 31.44 31.00 1d5a n GLU 102 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1d5a s HIS 103 N -3.13 2.61 0.36 4.31 2.46 -1.23 -4.95 115.29 115.72 1d5a s HIS 103 Ca -0.07 1.35 0.03 0.00 0.47 0.00 0.00 55.06 56.84 1d5a s HIS 103 Cb 0.11 -3.78 0.68 0.00 -0.13 0.00 0.00 32.58 29.45 1d5a s HIS 103 CO 0.75 -2.52 2.01 -1.00 -2.47 0.00 0.00 174.74 171.51 1d5a h PRO 104 N 2.36 0.78 -0.94 2.88 0.13 -1.93 -2.96 132.00 132.32 1d5a h PRO 104 Ca -0.50 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 64.47 1d5a h PRO 104 Cb 1.26 -0.18 -0.06 0.00 0.13 0.00 0.00 31.00 32.15 1d5a h PRO 104 CO 0.61 0.52 0.13 0.00 -0.23 0.00 0.00 178.00 179.03 1d5a n ALA 105 N -2.45 3.33 -3.70 -0.56 0.00 -1.26 -4.74 120.51 111.13 1d5a n ALA 105 Ca 0.06 -0.85 -0.24 0.00 0.00 0.00 0.00 53.44 52.41 1d5a n ALA 105 Cb 0.06 -1.11 -0.17 0.00 0.00 0.00 0.00 19.45 18.22 1d5a n ALA 105 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1d5a s VAL 106 N -1.32 0.15 0.02 0.00 1.01 -1.12 -2.65 120.40 116.49 1d5a s VAL 106 Ca 0.19 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 1d5a s VAL 106 Cb 0.16 -0.51 -0.33 0.00 0.00 0.00 0.00 36.38 35.69 1d5a s VAL 106 CO 0.04 0.03 0.96 -0.37 0.00 0.00 0.00 175.10 175.76 1d5a h VAL 107 N 6.41 1.25 -1.95 2.92 -1.51 -1.65 -3.45 116.25 118.27 1d5a h VAL 107 Ca -0.16 -2.73 0.13 0.00 -1.23 0.00 0.00 66.70 62.71 1d5a h VAL 107 Cb 1.13 2.96 -0.18 0.00 -2.13 0.00 0.00 31.29 33.07 1d5a h VAL 107 CO 0.25 0.83 0.57 -0.62 -1.23 0.00 0.00 177.57 177.37 1d5a s ASP 108 N -7.43 -0.32 0.08 4.19 -1.08 -1.25 -5.04 116.67 105.81 1d5a s ASP 108 Ca -0.09 0.10 0.08 0.00 -0.52 0.00 0.00 52.55 52.12 1d5a s ASP 108 Cb 0.05 0.32 -0.04 0.00 -1.46 0.00 0.00 42.92 41.79 1d5a s ASP 108 CO 0.92 -0.48 -0.19 0.27 0.52 0.00 0.00 175.17 176.21 1d5a s ILE 109 N -2.48 2.76 0.26 4.11 -4.36 -1.26 -1.45 121.20 118.78 1d5a s ILE 109 Ca 0.04 -1.36 0.05 0.00 -0.26 0.00 0.00 60.65 59.12 1d5a s ILE 109 Cb -0.01 -2.21 -0.06 0.00 1.25 0.00 0.00 42.46 41.44 1d5a s ILE 109 CO -0.06 0.22 -0.02 -0.31 0.24 0.00 0.00 174.94 175.02 1d5a s TYR 110 N -1.02 1.75 -1.14 1.37 1.51 0.60 -4.89 117.35 115.53 1d5a s TYR 110 Ca 0.16 -0.85 -0.28 0.00 -1.01 0.00 0.00 57.07 55.09 1d5a s TYR 110 Cb -0.10 -1.03 0.04 0.00 -0.11 0.00 0.00 41.96 40.75 1d5a s TYR 110 CO 0.07 0.08 0.68 0.39 -1.11 0.00 0.00 175.55 175.66 1d5a n GLU 111 N -0.51 -0.52 -0.04 -0.62 1.02 -1.26 -2.10 120.64 116.61 1d5a n GLU 111 Ca -0.05 0.22 0.03 0.00 -0.02 0.00 0.00 57.16 57.34 1d5a n GLU 111 Cb 0.64 -2.59 0.05 0.00 -0.02 0.00 0.00 31.44 29.52 1d5a n GLU 111 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 1d5a n TYR 112 N -4.58 0.07 -2.61 -0.32 4.11 -1.26 -4.41 117.16 108.15 1d5a n TYR 112 Ca -0.14 -0.61 0.03 0.00 -0.00 0.00 0.00 57.90 57.17 1d5a n TYR 112 Cb 0.59 -0.08 0.03 0.00 -0.00 0.00 0.00 39.34 39.88 1d5a n TYR 112 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.86 176.46 1d5a n ASP 113 N -0.61 1.19 -4.48 9.48 3.85 -1.26 -4.82 116.55 119.90 1d5a n ASP 113 Ca 0.05 -2.01 -0.43 0.00 -0.71 0.00 0.00 54.79 51.69 1d5a n ASP 113 Cb 0.36 -0.36 -0.09 0.00 -1.35 0.00 0.00 41.12 39.68 1d5a n ASP 113 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1d5a s ILE 114 N -1.24 5.16 0.18 2.12 -1.09 -1.26 -5.03 121.20 120.03 1d5a s ILE 114 Ca 0.32 -0.39 -0.31 0.00 -2.23 0.00 0.00 60.65 58.03 1d5a s ILE 114 Cb 0.37 -3.97 -0.16 0.00 -1.58 0.00 0.00 42.46 37.11 1d5a s ILE 114 CO -0.13 -0.34 0.88 -2.65 -1.23 0.00 0.00 174.94 171.48 1d5a n PRO 115 N 5.42 0.63 -0.21 2.79 -0.02 -1.26 -4.66 135.00 137.69 1d5a n PRO 115 Ca -0.09 0.22 0.02 0.00 -2.02 0.00 0.00 63.50 61.63 1d5a n PRO 115 Cb 0.48 -1.51 0.11 0.00 -0.02 0.00 0.00 33.50 32.56 1d5a n PRO 115 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1d5a h PHE 116 N 2.16 0.04 -0.09 6.00 3.57 -1.97 -0.73 116.94 125.93 1d5a h PHE 116 Ca -0.38 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.08 1d5a h PHE 116 Cb 1.39 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.20 1d5a h PHE 116 CO 0.49 -0.13 -0.35 0.00 -2.23 0.00 0.00 178.31 176.08 1d5a h ALA 117 N 1.56 1.25 0.00 2.41 0.00 -1.90 -1.42 119.26 121.16 1d5a h ALA 117 Ca 0.33 -0.36 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1d5a h ALA 117 Cb 0.54 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1d5a h ALA 117 CO -0.50 0.52 -0.91 0.87 0.00 0.00 0.00 179.25 179.22 1d5a h LYS 118 N 0.15 0.00 -0.15 0.00 1.57 -1.78 -2.42 116.57 113.93 1d5a h LYS 118 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 1d5a h LYS 118 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1d5a h LYS 118 CO 0.05 0.87 -0.32 -0.09 -0.57 0.00 0.00 179.45 179.39 1d5a h ARG 119 N 0.00 0.30 -0.03 3.15 9.65 -0.90 -1.59 114.38 124.96 1d5a h ARG 119 Ca -0.02 -0.12 -0.01 0.00 -1.10 0.00 0.00 59.98 58.73 1d5a h ARG 119 Cb 1.69 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 30.25 1d5a h ARG 119 CO 0.11 0.59 -0.02 -0.92 2.80 0.00 0.00 179.97 182.54 1d5a h TYR 120 N 0.27 0.08 -0.77 2.20 3.20 -1.09 0.73 116.97 121.59 1d5a h TYR 120 Ca 0.04 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.89 1d5a h TYR 120 Cb 0.69 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.91 1d5a h TYR 120 CO 0.01 0.49 0.51 -0.07 -1.64 0.00 0.00 178.16 177.46 1d5a h LEU 121 N -0.35 0.88 0.82 2.82 3.38 -1.29 -0.71 115.31 120.87 1d5a h LEU 121 Ca 0.01 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1d5a h LEU 121 Cb 0.47 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.00 1d5a h LEU 121 CO 0.01 0.64 -0.39 0.40 0.09 0.00 0.00 178.44 179.18 1d5a h ILE 122 N 1.04 0.01 -0.76 1.22 2.04 -1.27 0.06 117.51 119.87 1d5a h ILE 122 Ca 0.28 -0.19 0.06 0.00 1.00 0.00 0.00 64.86 66.01 1d5a h ILE 122 Cb -0.12 0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 35.92 1d5a h ILE 122 CO -0.06 0.00 0.45 0.44 0.00 0.00 0.00 178.15 178.98 1d5a h ASP 123 N -1.29 0.69 0.10 1.72 5.19 -0.82 -1.23 116.42 120.78 1d5a h ASP 123 Ca -0.11 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1d5a h ASP 123 Cb 0.84 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 40.24 1d5a h ASP 123 CO 0.18 0.44 -0.00 0.54 -3.12 0.00 0.00 179.24 177.28 1d5a n ARG 124 N -4.71 0.93 -1.63 3.56 5.12 -0.28 -4.91 116.66 114.74 1d5a n ARG 124 Ca 0.10 -0.06 -0.16 0.00 -1.93 0.00 0.00 57.85 55.80 1d5a n ARG 124 Cb 0.18 -1.50 -0.06 0.00 -1.16 0.00 0.00 32.46 29.92 1d5a n ARG 124 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1d5a n GLY 125 N 1.07 1.25 3.78 -0.13 0.00 -0.47 -4.99 105.19 105.70 1d5a n GLY 125 Ca 0.22 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1d5a n GLY 125 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d5a s LEU 126 N -3.87 4.53 -0.25 0.99 1.43 -0.07 -5.02 118.68 116.43 1d5a s LEU 126 Ca 0.00 1.71 0.01 0.00 -1.03 0.00 0.00 54.13 54.82 1d5a s LEU 126 Cb 0.00 -3.52 0.06 0.00 0.03 0.00 0.00 46.19 42.77 1d5a s LEU 126 CO 0.00 0.13 -0.05 -0.63 0.23 0.00 0.00 176.35 176.03 1d5a s ILE 127 N -1.28 1.67 0.55 -0.59 1.01 -1.26 -4.62 121.20 116.67 1d5a s ILE 127 Ca 0.40 -1.36 -0.21 0.00 0.00 0.00 0.00 60.65 59.49 1d5a s ILE 127 Cb -0.22 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.28 1d5a s ILE 127 CO 0.26 -0.13 1.27 -2.16 0.00 0.00 0.00 174.94 174.19 1d5a s PRO 128 N 1.32 3.18 -0.46 2.79 0.04 -1.26 -3.79 135.00 136.82 1d5a s PRO 128 Ca -0.05 2.00 -0.02 0.00 0.04 0.00 0.00 61.00 62.98 1d5a s PRO 128 Cb -0.19 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.19 1d5a s PRO 128 CO -0.07 -1.08 0.21 -1.33 0.04 0.00 0.00 177.00 174.77 1d5a n MET 129 N -1.13 -1.60 -3.68 4.56 2.81 -0.66 -3.80 117.12 113.61 1d5a n MET 129 Ca 0.11 0.27 -0.37 0.00 -1.81 0.00 0.00 57.70 55.90 1d5a n MET 129 Cb 0.47 -3.78 -0.07 0.00 -0.71 0.00 0.00 33.22 29.14 1d5a n MET 129 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1d5a s GLU 130 N -4.94 3.87 0.00 0.03 2.02 -1.25 -4.77 118.70 113.66 1d5a s GLU 130 Ca 0.10 0.04 0.00 0.00 0.02 0.00 0.00 54.97 55.13 1d5a s GLU 130 Cb -0.05 -3.29 0.00 0.00 0.10 0.00 0.00 34.13 30.89 1d5a s GLU 130 CO 0.13 0.54 0.00 0.41 0.02 0.00 0.00 175.26 176.36 1d5a n GLY 131 N 2.55 -1.65 2.62 -1.39 0.00 -1.26 -4.36 105.19 101.69 1d5a n GLY 131 Ca -0.16 -2.05 -0.27 0.00 0.00 0.00 0.00 46.02 43.53 1d5a n GLY 131 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d5a n ASP 132 N 0.00 2.96 -4.49 1.61 8.00 -1.26 -5.04 116.55 118.33 1d5a n ASP 132 Ca 0.00 -3.23 -0.36 0.00 0.71 0.00 0.00 54.79 51.91 1d5a n ASP 132 Cb 0.00 -0.70 -0.12 0.00 -0.02 0.00 0.00 41.12 40.28 1d5a n ASP 132 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1d5a s GLU 133 N -1.79 3.72 0.13 -1.24 0.41 -1.26 -5.05 118.70 113.62 1d5a s GLU 133 Ca 0.32 -0.45 -0.30 0.00 -0.41 0.00 0.00 54.97 54.13 1d5a s GLU 133 Cb 0.06 -3.31 -0.07 0.00 -1.78 0.00 0.00 34.13 29.03 1d5a s GLU 133 CO -0.10 -0.10 1.18 -1.21 -0.49 0.00 0.00 175.26 174.53 1d5a s GLU 134 N 1.39 4.49 -0.12 1.61 2.02 -1.26 -4.98 118.70 121.84 1d5a s GLU 134 Ca 0.05 1.79 0.00 0.00 0.02 0.00 0.00 54.97 56.84 1d5a s GLU 134 Cb -0.15 -3.30 -0.02 0.00 0.10 0.00 0.00 34.13 30.77 1d5a s GLU 134 CO 0.04 -0.13 -0.13 -0.51 0.02 0.00 0.00 175.26 174.55 1d5a s LEU 135 N 0.33 2.72 0.20 1.80 1.43 -1.26 -4.93 118.68 118.97 1d5a s LEU 135 Ca 0.55 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 53.04 1d5a s LEU 135 Cb -0.30 -1.60 -0.08 0.00 0.03 0.00 0.00 46.19 44.23 1d5a s LEU 135 CO 0.33 0.19 1.22 -0.13 0.23 0.00 0.00 176.35 178.19 1d5a s ARG 136 N 0.19 4.47 0.38 1.70 0.52 -1.26 -4.91 118.95 120.04 1d5a s ARG 136 Ca -0.08 1.92 0.08 0.00 -0.52 0.00 0.00 55.73 57.14 1d5a s ARG 136 Cb -0.15 -3.22 -0.06 0.00 0.52 0.00 0.00 34.95 32.04 1d5a s ARG 136 CO 0.05 -0.11 0.08 -1.64 0.02 0.00 0.00 175.30 173.70 1d5a s MET 137 N -0.33 2.12 -0.29 3.54 -1.94 -1.26 -0.97 119.30 120.17 1d5a s MET 137 Ca 0.53 -1.83 -0.16 0.00 -1.71 0.00 0.00 55.69 52.52 1d5a s MET 137 Cb -0.34 -1.91 0.15 0.00 2.01 0.00 0.00 34.83 34.74 1d5a s MET 137 CO 0.38 0.01 0.98 -1.17 -0.01 0.00 0.00 175.02 175.22 1d5a s LEU 138 N -3.79 -0.49 0.33 -0.03 0.20 -0.88 -4.75 118.68 109.28 1d5a s LEU 138 Ca 0.37 0.79 0.07 0.00 0.69 0.00 0.00 54.13 56.05 1d5a s LEU 138 Cb 0.03 1.72 -0.02 0.00 -0.43 0.00 0.00 46.19 47.48 1d5a s LEU 138 CO 0.20 -0.12 0.31 0.00 -0.29 0.00 0.00 176.35 176.45 1d5a s ALA 139 N 1.35 3.89 -0.15 5.97 0.00 -1.02 -0.55 121.76 131.25 1d5a s ALA 139 Ca -0.09 -1.62 -0.29 0.00 0.00 0.00 0.00 51.96 49.96 1d5a s ALA 139 Cb -0.04 -1.24 0.09 0.00 0.00 0.00 0.00 23.12 21.93 1d5a s ALA 139 CO -0.15 0.01 0.80 -0.59 0.00 0.00 0.00 175.76 175.83 1d5a s PHE 140 N -2.29 -0.60 0.14 0.00 -0.12 -0.83 -2.45 117.98 111.83 1d5a s PHE 140 Ca 0.41 1.20 0.00 0.00 -0.05 0.00 0.00 56.93 58.50 1d5a s PHE 140 Cb -0.06 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.67 1d5a s PHE 140 CO 0.27 -0.46 0.02 0.34 -0.05 0.00 0.00 175.22 175.34 1d5a s ASP 141 N -0.66 0.79 -0.05 1.98 3.68 0.16 -4.66 116.67 117.92 1d5a s ASP 141 Ca -0.05 -1.16 -0.02 0.00 2.13 0.00 0.00 52.55 53.45 1d5a s ASP 141 Cb -0.02 0.19 0.04 0.00 -1.45 0.00 0.00 42.92 41.68 1d5a s ASP 141 CO 0.04 -0.63 0.10 0.27 0.13 0.00 0.00 175.17 175.09 1d5a s ILE 142 N -3.83 -0.10 -0.21 4.11 -4.36 -1.26 -1.72 121.20 113.82 1d5a s ILE 142 Ca 0.22 0.26 -0.06 0.00 -0.26 0.00 0.00 60.65 60.81 1d5a s ILE 142 Cb 0.07 -0.19 -0.03 0.00 1.25 0.00 0.00 42.46 43.56 1d5a s ILE 142 CO 0.01 0.11 0.03 -1.61 0.24 0.00 0.00 174.94 173.72 1d5a s GLU 143 N 1.51 3.68 0.55 0.37 2.02 -1.12 -4.99 118.70 120.72 1d5a s GLU 143 Ca -0.05 -0.48 0.03 0.00 0.02 0.00 0.00 54.97 54.49 1d5a s GLU 143 Cb -0.12 -3.18 0.10 0.00 0.10 0.00 0.00 34.13 31.03 1d5a s GLU 143 CO -0.05 -0.02 0.76 2.41 0.02 0.00 0.00 175.26 178.38 1d5a n THR 144 N 4.38 0.00 -1.55 3.63 -1.04 -1.26 -1.99 114.28 116.45 1d5a n THR 144 Ca -0.17 -1.38 -0.33 0.00 -2.04 0.00 0.00 64.05 60.14 1d5a n THR 144 Cb 0.52 -0.86 0.07 0.00 -1.82 0.00 0.00 70.33 68.24 1d5a n THR 144 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1d5a s LEU 145 N 0.00 3.29 -0.37 -4.42 2.96 -1.26 -4.72 118.68 114.15 1d5a s LEU 145 Ca 0.52 2.07 0.07 0.00 -0.22 0.00 0.00 54.13 56.58 1d5a s LEU 145 Cb -0.03 -4.56 0.70 0.00 0.50 0.00 0.00 46.19 42.80 1d5a s LEU 145 CO 0.34 -1.93 1.84 0.00 -1.32 0.00 0.00 176.35 175.28 1d5a n ALA 146 N -2.75 4.98 -2.37 5.97 0.00 -1.26 -4.95 120.51 120.13 1d5a n ALA 146 Ca 0.11 -2.62 -0.29 0.00 0.00 0.00 0.00 53.44 50.64 1d5a n ALA 146 Cb 0.52 -1.30 -0.15 0.00 0.00 0.00 0.00 19.45 18.52 1d5a n ALA 146 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1d5a s HIS 147 N -3.14 2.20 0.00 0.00 3.76 -1.26 -4.83 115.29 112.03 1d5a s HIS 147 Ca 0.55 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 55.06 1d5a s HIS 147 Cb 0.45 -1.34 0.00 0.00 1.11 0.00 0.00 32.58 32.80 1d5a s HIS 147 CO 0.12 0.08 0.00 0.00 -0.85 0.00 0.00 174.74 174.09 1d5a n ALA 148 N 1.97 0.00 0.00 -1.40 0.00 -1.26 -4.95 120.51 114.87 1d5a n ALA 148 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1d5a n ALA 148 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1d5a n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d5a n GLY 149 N -0.37 0.00 0.00 0.00 0.00 -1.26 -4.72 105.19 98.84 1d5a n GLY 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1d5a n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d5a n ALA 150 N -0.73 0.00 -1.84 4.61 0.00 -1.26 -4.77 120.51 116.52 1d5a n ALA 150 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1d5a n ALA 150 Cb 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.52 1d5a n ALA 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d5a n ALA 151 N 0.00 6.77 -1.19 0.00 0.00 -1.26 -4.68 120.51 120.15 1d5a n ALA 151 Ca 0.00 -3.96 -0.08 0.00 0.00 0.00 0.00 53.44 49.40 1d5a n ALA 151 Cb 0.16 -2.99 0.24 0.00 0.00 0.00 0.00 19.45 16.85 1d5a n ALA 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d5a n ALA 152 N 2.69 4.59 0.00 0.00 0.00 -1.26 -4.22 120.51 122.32 1d5a n ALA 152 Ca 0.63 -2.69 0.00 0.00 0.00 0.00 0.00 53.44 51.38 1d5a n ALA 152 Cb 0.26 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1d5a n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d5a n GLY 153 N -0.71 0.00 3.40 0.00 0.00 -1.26 -5.10 105.19 101.52 1d5a n GLY 153 Ca 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.33 1d5a n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d5a s ALA 154 N -0.37 0.45 0.00 4.61 0.00 -1.26 -4.71 121.76 120.47 1d5a s ALA 154 Ca 0.00 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.68 1d5a s ALA 154 Cb 0.00 1.23 0.00 0.00 0.00 0.00 0.00 23.12 24.35 1d5a s ALA 154 CO 0.00 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 175.44 1d5a n GLY 155 N -0.33 -1.05 2.56 0.00 0.00 -1.26 -4.69 105.19 100.42 1d5a n GLY 155 Ca 0.00 0.36 -0.09 0.00 0.00 0.00 0.00 46.02 46.29 1d5a n GLY 155 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1d5a n PRO 156 N 0.00 0.62 -3.65 1.61 -0.04 -1.26 -5.08 135.00 127.20 1d5a n PRO 156 Ca 0.00 -1.92 -0.02 0.00 -0.04 0.00 0.00 63.50 61.52 1d5a n PRO 156 Cb 0.00 2.00 -0.07 0.00 -0.04 0.00 0.00 33.50 35.39 1d5a n PRO 156 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1d5a s ILE 157 N -2.60 0.00 -0.13 0.52 2.07 -1.26 -4.46 121.20 115.34 1d5a s ILE 157 Ca 0.18 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.37 1d5a s ILE 157 Cb -0.02 -1.00 -0.06 0.00 0.13 0.00 0.00 42.46 41.52 1d5a s ILE 157 CO 0.13 0.00 -0.16 0.18 -1.91 0.00 0.00 174.94 173.18 1d5a n LEU 158 N 2.61 1.12 -3.78 8.50 4.77 -0.84 -4.88 117.00 124.51 1d5a n LEU 158 Ca -0.15 0.13 -0.13 0.00 -0.03 0.00 0.00 56.01 55.84 1d5a n LEU 158 Cb 0.57 -0.38 -0.09 0.00 -2.33 0.00 0.00 43.42 41.19 1d5a n LEU 158 CO 0.03 0.31 -0.01 0.00 -1.33 0.00 0.00 177.39 176.40 1d5a s MET 159 N -2.23 0.65 -0.14 3.23 0.23 -1.22 -4.09 119.30 115.73 1d5a s MET 159 Ca -0.18 -0.25 0.02 0.00 -1.03 0.00 0.00 55.69 54.25 1d5a s MET 159 Cb 0.07 0.29 0.00 0.00 -1.53 0.00 0.00 34.83 33.65 1d5a s MET 159 CO 0.23 -0.18 -0.19 0.42 -2.03 0.00 0.00 175.02 173.27 1d5a s ILE 160 N -1.44 2.37 -0.13 3.16 1.01 -0.71 -2.80 121.20 122.67 1d5a s ILE 160 Ca -0.13 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.66 1d5a s ILE 160 Cb -0.05 -1.96 0.00 0.00 0.01 0.00 0.00 42.46 40.46 1d5a s ILE 160 CO 0.03 0.54 -0.22 -0.94 0.00 0.00 0.00 174.94 174.35 1d5a s SER 161 N 0.67 3.18 0.07 3.58 1.04 -0.70 -0.46 113.70 121.08 1d5a s SER 161 Ca -0.09 -0.57 0.05 0.00 0.48 0.00 0.00 55.95 55.82 1d5a s SER 161 Cb -0.16 -1.45 -0.03 0.00 0.10 0.00 0.00 66.02 64.48 1d5a s SER 161 CO 0.02 0.11 -0.13 -0.72 0.98 0.00 0.00 173.24 173.49 1d5a s TYR 162 N 0.64 1.15 0.14 5.02 -0.85 -0.43 -0.66 117.35 122.36 1d5a s TYR 162 Ca -0.11 -0.46 0.09 0.00 -0.52 0.00 0.00 57.07 56.07 1d5a s TYR 162 Cb -0.16 -0.65 -0.04 0.00 0.38 0.00 0.00 41.96 41.49 1d5a s TYR 162 CO 0.02 0.04 -0.21 0.00 -1.52 0.00 0.00 175.55 173.88 1d5a s ALA 163 N -1.26 2.09 0.07 9.51 0.00 -1.03 -0.59 121.76 130.54 1d5a s ALA 163 Ca -0.03 -1.43 -0.01 0.00 0.00 0.00 0.00 51.96 50.49 1d5a s ALA 163 Cb -0.10 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1d5a s ALA 163 CO 0.02 0.36 0.11 -3.47 0.00 0.00 0.00 175.76 172.78 1d5a n ASP 164 N 0.65 -0.31 0.01 0.00 -0.08 0.55 -2.43 116.55 114.94 1d5a n ASP 164 Ca -0.16 -1.32 0.09 0.00 -1.51 0.00 0.00 54.79 51.89 1d5a n ASP 164 Cb 0.55 0.55 0.40 0.00 2.34 0.00 0.00 41.12 44.97 1d5a n ASP 164 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1d5a n GLU 165 N -0.10 0.01 -0.84 -0.67 -0.58 -1.26 -2.49 120.64 114.71 1d5a n GLU 165 Ca -0.01 0.19 0.06 0.00 -0.42 0.00 0.00 57.16 56.99 1d5a n GLU 165 Cb 0.11 -1.52 0.37 0.00 -0.57 0.00 0.00 31.44 29.83 1d5a n GLU 165 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1d5a n GLU 166 N -1.55 4.48 0.00 3.49 2.13 -1.26 -5.06 120.64 122.87 1d5a n GLU 166 Ca 0.04 -3.12 0.00 0.00 0.66 0.00 0.00 57.16 54.75 1d5a n GLU 166 Cb 0.22 -2.20 0.00 0.00 0.27 0.00 0.00 31.44 29.73 1d5a n GLU 166 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1d5a n GLY 167 N 0.35 -2.45 2.85 8.31 0.00 -1.04 -4.98 105.19 108.22 1d5a n GLY 167 Ca 0.28 -2.15 -0.28 0.00 0.00 0.00 0.00 46.02 43.87 1d5a n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d5a s ALA 168 N -1.37 1.38 0.44 4.61 0.00 -1.26 -0.33 121.76 125.23 1d5a s ALA 168 Ca 0.00 -0.84 0.07 0.00 0.00 0.00 0.00 51.96 51.19 1d5a s ALA 168 Cb 0.00 -1.17 -0.01 0.00 0.00 0.00 0.00 23.12 21.94 1d5a s ALA 168 CO 0.00 -0.96 0.40 1.03 0.00 0.00 0.00 175.76 176.24 1d5a s ARG 169 N 1.68 2.47 0.09 0.00 3.00 0.24 -4.81 118.95 121.62 1d5a s ARG 169 Ca -0.01 -1.62 0.07 0.00 0.00 0.00 0.00 55.73 54.17 1d5a s ARG 169 Cb -0.16 -2.34 -0.03 0.00 0.00 0.00 0.00 34.95 32.41 1d5a s ARG 169 CO -0.07 -0.29 -0.18 0.08 0.00 0.00 0.00 175.30 174.84 1d5a s VAL 170 N -2.53 1.44 -0.22 3.52 1.01 -1.17 -1.31 120.40 121.15 1d5a s VAL 170 Ca 0.47 -1.45 -0.02 0.00 0.00 0.00 0.00 61.98 60.98 1d5a s VAL 170 Cb -0.03 -1.35 0.06 0.00 0.00 0.00 0.00 36.38 35.06 1d5a s VAL 170 CO 0.27 -0.15 0.02 -0.63 0.00 0.00 0.00 175.10 174.61 1d5a s ILE 171 N -1.26 0.84 0.09 2.22 1.01 0.39 -1.76 121.20 122.74 1d5a s ILE 171 Ca 0.03 -0.83 0.06 0.00 0.00 0.00 0.00 60.65 59.91 1d5a s ILE 171 Cb -0.10 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1d5a s ILE 171 CO 0.03 -0.23 -0.17 0.42 0.00 0.00 0.00 174.94 174.99 1d5a s THR 172 N 1.70 1.39 -0.35 2.92 -4.23 -0.71 -1.74 115.64 114.62 1d5a s THR 172 Ca -0.01 -1.45 0.01 0.00 -1.18 0.00 0.00 61.69 59.05 1d5a s THR 172 Cb -0.18 -1.33 0.37 0.00 1.34 0.00 0.00 72.50 72.71 1d5a s THR 172 CO -0.09 -0.18 1.78 -2.67 -0.54 0.00 0.00 174.62 172.91 1d5a n TRP 173 N 1.11 2.01 -4.13 3.99 4.27 -1.26 0.16 117.44 123.59 1d5a n TRP 173 Ca -0.20 -1.77 -0.15 0.00 -3.89 0.00 0.00 57.50 51.50 1d5a n TRP 173 Cb 0.54 -0.88 -0.13 0.00 -1.36 0.00 0.00 31.31 29.49 1d5a n TRP 173 CO 0.00 0.00 0.00 0.21 -2.29 0.00 0.00 177.69 175.61 1d5a s LYS 174 N -2.25 0.52 -0.63 -2.67 2.36 -1.26 -4.66 119.74 111.15 1d5a s LYS 174 Ca 0.39 -0.52 -0.28 0.00 -2.55 0.00 0.00 55.97 53.01 1d5a s LYS 174 Cb 0.31 -0.39 0.02 0.00 -1.05 0.00 0.00 37.83 36.72 1d5a s LYS 174 CO 0.04 0.09 1.30 -0.80 1.55 0.00 0.00 175.35 177.53 1d5a s ASN 175 N -0.93 6.23 -0.08 1.43 0.01 -1.26 -4.52 114.94 115.82 1d5a s ASN 175 Ca -0.04 -0.02 -0.04 0.00 -0.71 0.00 0.00 52.86 52.05 1d5a s ASN 175 Cb -0.06 -2.55 0.04 0.00 0.41 0.00 0.00 41.25 39.09 1d5a s ASN 175 CO 0.00 -1.69 0.19 -0.63 -1.51 0.00 0.00 177.10 173.47 1d5a s ILE 176 N 5.63 -0.05 -0.49 0.60 1.01 -1.26 -5.10 121.20 121.54 1d5a s ILE 176 Ca 0.44 0.17 0.04 0.00 0.00 0.00 0.00 60.65 61.29 1d5a s ILE 176 Cb -0.09 -0.31 0.13 0.00 0.01 0.00 0.00 42.46 42.20 1d5a s ILE 176 CO 0.22 0.07 0.24 -1.81 0.00 0.00 0.00 174.94 173.65 1d5a s ASP 177 N 1.22 4.23 0.16 3.58 1.11 -1.26 -4.55 116.67 121.16 1d5a s ASP 177 Ca -0.09 -2.87 0.06 0.00 0.18 0.00 0.00 52.55 49.83 1d5a s ASP 177 Cb -0.11 -1.52 -0.04 0.00 1.07 0.00 0.00 42.92 42.32 1d5a s ASP 177 CO -0.07 -0.25 0.06 -0.76 1.18 0.00 0.00 175.17 175.33 1d5a s LEU 178 N -0.07 3.57 0.00 1.23 1.43 -1.26 -4.97 118.68 118.61 1d5a s LEU 178 Ca 0.17 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1d5a s LEU 178 Cb -0.25 -2.21 0.00 0.00 0.03 0.00 0.00 46.19 43.76 1d5a s LEU 178 CO -0.01 0.09 0.48 -0.81 0.23 0.00 0.00 176.35 176.33 1d5a n PRO 179 N -0.14 0.00 0.00 1.29 -0.04 -1.26 -1.68 135.00 133.17 1d5a n PRO 179 Ca -0.09 0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1d5a n PRO 179 Cb 0.54 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1d5a n PRO 179 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1d5a n TYR 180 N -0.98 0.00 -2.10 0.54 0.18 -1.26 -5.08 117.16 108.45 1d5a n TYR 180 Ca 0.00 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.47 1d5a n TYR 180 Cb 0.18 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.13 1d5a n TYR 180 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1d5a s VAL 181 N -0.71 4.67 -0.19 -3.48 1.01 -0.68 -3.03 120.40 117.99 1d5a s VAL 181 Ca 0.00 0.94 -0.03 0.00 0.00 0.00 0.00 61.98 62.89 1d5a s VAL 181 Cb 0.00 -3.82 0.06 0.00 0.00 0.00 0.00 36.38 32.62 1d5a s VAL 181 CO 0.00 -0.97 0.03 -1.61 0.00 0.00 0.00 175.10 172.55 1d5a s GLU 182 N -4.78 0.68 -0.13 2.72 2.02 -0.72 -4.74 118.70 113.75 1d5a s GLU 182 Ca 0.56 -0.39 -0.29 0.00 0.02 0.00 0.00 54.97 54.86 1d5a s GLU 182 Cb -0.11 -2.04 -0.02 0.00 0.10 0.00 0.00 34.13 32.07 1d5a s GLU 182 CO 0.46 -0.61 1.21 -1.12 0.02 0.00 0.00 175.26 175.22 1d5a s SER 183 N 1.86 7.01 0.48 -0.19 0.01 -1.26 -1.74 113.70 119.87 1d5a s SER 183 Ca -0.01 1.69 0.08 0.00 1.31 0.00 0.00 55.95 59.02 1d5a s SER 183 Cb -0.17 -2.55 0.08 0.00 0.21 0.00 0.00 66.02 63.59 1d5a s SER 183 CO -0.08 -0.68 0.64 0.52 0.41 0.00 0.00 173.24 174.05 1d5a n VAL 184 N 5.09 0.00 -0.10 3.43 0.31 0.43 -4.96 118.33 122.53 1d5a n VAL 184 Ca 0.13 -1.64 -0.15 0.00 -0.01 0.00 0.00 64.34 62.67 1d5a n VAL 184 Cb 0.46 -0.54 -0.14 0.00 -0.91 0.00 0.00 33.84 32.70 1d5a n VAL 184 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1d5a n SER 185 N -2.38 1.16 -4.03 4.52 3.41 -1.26 -4.30 113.62 110.74 1d5a n SER 185 Ca 0.12 -0.02 -0.10 0.00 -0.26 0.00 0.00 58.87 58.61 1d5a n SER 185 Cb 0.50 0.12 -0.08 0.00 -0.26 0.00 0.00 64.21 64.49 1d5a n SER 185 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1d5a s THR 186 N -2.52 0.06 -0.07 6.66 2.01 -1.26 -4.96 115.64 115.56 1d5a s THR 186 Ca -0.22 -1.57 0.30 0.00 0.31 0.00 0.00 61.69 60.51 1d5a s THR 186 Cb 0.08 -2.00 0.34 0.00 0.01 0.00 0.00 72.50 70.92 1d5a s THR 186 CO 0.72 -0.26 1.91 1.05 -0.69 0.00 0.00 174.62 177.34 1d5a h GLU 187 N 2.59 0.00 0.07 4.92 4.11 -1.91 -2.02 114.58 122.33 1d5a h GLU 187 Ca -0.32 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 58.87 1d5a h GLU 187 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1d5a h GLU 187 CO 0.50 0.00 -1.09 -0.22 0.07 0.00 0.00 179.01 178.26 1d5a h LYS 188 N 0.00 0.21 0.00 1.06 3.64 -1.96 -3.19 116.57 116.33 1d5a h LYS 188 Ca 0.00 -0.31 -0.15 0.00 -1.27 0.00 0.00 60.65 58.92 1d5a h LYS 188 Cb 0.39 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1d5a h LYS 188 CO 0.00 1.11 -0.73 0.93 -2.27 0.00 0.00 179.45 178.49 1d5a h GLU 189 N 0.08 0.00 -0.98 1.90 4.39 -1.84 -2.97 114.58 115.15 1d5a h GLU 189 Ca -0.08 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.66 1d5a h GLU 189 Cb 1.80 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 30.39 1d5a h GLU 189 CO 0.17 0.73 0.64 1.98 -1.16 0.00 0.00 179.01 181.36 1d5a h MET 190 N 0.00 1.17 -0.20 2.33 4.05 -1.40 -0.72 114.93 120.16 1d5a h MET 190 Ca -0.01 -0.07 -0.09 0.00 -0.28 0.00 0.00 59.70 59.25 1d5a h MET 190 Cb 1.54 -0.26 -0.00 0.00 -0.80 0.00 0.00 31.60 32.08 1d5a h MET 190 CO 0.09 0.77 -0.22 0.82 0.23 0.00 0.00 176.91 178.61 1d5a h ILE 191 N 1.20 1.33 -0.56 1.77 2.04 -1.52 -2.00 117.51 119.77 1d5a h ILE 191 Ca 0.40 -1.39 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 1d5a h ILE 191 Cb 0.06 1.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 1d5a h ILE 191 CO -0.14 0.43 0.32 0.50 0.00 0.00 0.00 178.15 179.26 1d5a h LYS 192 N 0.17 0.76 -0.30 2.37 3.64 -1.29 0.08 116.57 122.01 1d5a h LYS 192 Ca 0.03 -0.08 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 1d5a h LYS 192 Cb 0.77 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.39 1d5a h LYS 192 CO 0.05 0.57 0.00 -0.09 -2.27 0.00 0.00 179.45 177.71 1d5a h ARG 193 N 0.75 0.09 -0.51 1.90 9.65 -1.13 -0.04 114.38 125.09 1d5a h ARG 193 Ca 0.20 -0.01 0.08 0.00 -1.10 0.00 0.00 59.98 59.15 1d5a h ARG 193 Cb 0.01 -0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 28.51 1d5a h ARG 193 CO -0.04 0.06 0.16 0.35 2.80 0.00 0.00 179.97 183.31 1d5a h PHE 194 N 0.09 0.28 -0.00 2.20 -0.00 -0.77 0.14 116.94 118.88 1d5a h PHE 194 Ca 0.14 0.03 -0.02 0.00 -0.00 0.00 0.00 57.97 58.12 1d5a h PHE 194 Cb 0.19 -0.05 -0.00 0.00 -0.00 0.00 0.00 35.95 36.08 1d5a h PHE 194 CO -0.22 0.07 -0.09 -0.07 -0.00 0.00 0.00 178.31 178.01 1d5a h LEU 195 N 0.33 0.00 0.06 0.59 3.38 -0.03 -2.33 115.31 117.31 1d5a h LEU 195 Ca 0.25 -0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.95 1d5a h LEU 195 Cb 0.29 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1d5a h LEU 195 CO -0.27 0.09 -1.34 0.50 0.09 0.00 0.00 178.44 177.51 1d5a h LYS 196 N 0.00 0.13 -0.51 1.13 3.64 0.29 -2.95 116.57 118.30 1d5a h LYS 196 Ca -0.00 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1d5a h LYS 196 Cb 0.15 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1d5a h LYS 196 CO 0.01 0.99 0.33 0.28 -2.27 0.00 0.00 179.45 178.79 1d5a h VAL 197 N 0.03 1.13 -0.10 2.00 2.07 -0.25 0.12 116.25 121.25 1d5a h VAL 197 Ca -0.16 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.00 1d5a h VAL 197 Cb 1.93 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1d5a h VAL 197 CO 0.14 0.13 -0.44 0.40 0.02 0.00 0.00 177.57 177.82 1d5a h ILE 198 N 0.69 1.32 0.00 4.57 2.04 -1.57 -1.57 117.51 122.99 1d5a h ILE 198 Ca 0.19 -1.60 0.00 0.00 1.00 0.00 0.00 64.86 64.44 1d5a h ILE 198 Cb -0.07 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1d5a h ILE 198 CO -0.04 0.48 0.00 -0.61 0.00 0.00 0.00 178.15 177.98 1d5a h GLN 199 N 0.20 0.00 0.04 2.37 5.75 -1.14 0.33 115.11 122.66 1d5a h GLN 199 Ca 0.01 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.19 1d5a h GLN 199 Cb 0.87 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 29.38 1d5a h GLN 199 CO 0.07 0.00 -1.79 0.39 -2.65 0.00 0.00 178.83 174.85 1d5a n GLU 200 N -2.67 0.64 0.09 1.69 1.02 -0.05 -4.38 120.64 116.97 1d5a n GLU 200 Ca 0.02 0.39 -0.05 0.00 -0.02 0.00 0.00 57.16 57.51 1d5a n GLU 200 Cb 0.31 -1.68 -0.04 0.00 -0.02 0.00 0.00 31.44 30.01 1d5a n GLU 200 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1d5a h LYS 201 N -0.56 0.00 -6.17 3.49 1.57 -1.30 -3.49 116.57 110.12 1d5a h LYS 201 Ca -0.44 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.05 1d5a h LYS 201 Cb 1.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.95 1d5a h LYS 201 CO -0.13 0.86 -0.64 -3.47 -0.57 0.00 0.00 179.45 175.50 1d5a n ASP 202 N -3.42 -6.10 -4.76 0.86 -0.08 0.11 -4.93 116.55 98.22 1d5a n ASP 202 Ca -0.00 -0.58 -0.35 0.00 -1.51 0.00 0.00 54.79 52.35 1d5a n ASP 202 Cb 0.85 -3.21 0.03 0.00 2.34 0.00 0.00 41.12 41.13 1d5a n ASP 202 CO 0.00 0.00 0.00 -2.84 0.12 0.00 0.00 177.20 174.48 1d5a s PRO 203 N -4.10 3.04 -0.03 -0.67 0.02 -1.26 -4.90 135.00 127.09 1d5a s PRO 203 Ca 0.01 1.64 0.18 0.00 0.02 0.00 0.00 61.00 62.85 1d5a s PRO 203 Cb -0.00 -1.96 -0.21 0.00 0.02 0.00 0.00 34.50 32.35 1d5a s PRO 203 CO 0.83 -1.11 0.53 -0.25 -0.33 0.00 0.00 177.00 176.68 1d5a n ASP 204 N -1.72 0.43 -3.98 2.53 8.00 -0.15 -4.84 116.55 116.82 1d5a n ASP 204 Ca 0.12 0.19 -0.21 0.00 0.71 0.00 0.00 54.79 55.60 1d5a n ASP 204 Cb 0.51 0.80 -0.16 0.00 -0.02 0.00 0.00 41.12 42.25 1d5a n ASP 204 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1d5a s VAL 205 N -2.93 0.78 -0.28 2.53 1.01 -0.91 -1.39 120.40 119.21 1d5a s VAL 205 Ca -0.06 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1d5a s VAL 205 Cb 0.09 -0.72 0.06 0.00 0.00 0.00 0.00 36.38 35.81 1d5a s VAL 205 CO 0.84 0.26 -0.06 -0.76 0.00 0.00 0.00 175.10 175.38 1d5a s LEU 206 N 0.39 3.68 -0.15 3.92 1.43 -0.78 -2.07 118.68 125.11 1d5a s LEU 206 Ca -0.06 -1.35 -0.12 0.00 -1.03 0.00 0.00 54.13 51.56 1d5a s LEU 206 Cb -0.11 -1.63 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 1d5a s LEU 206 CO 0.01 -0.23 0.25 -0.63 0.23 0.00 0.00 176.35 175.98 1d5a s ILE 207 N 1.17 5.33 0.12 -0.59 1.01 0.29 -1.70 121.20 126.84 1d5a s ILE 207 Ca -0.07 0.45 -0.01 0.00 0.00 0.00 0.00 60.65 61.03 1d5a s ILE 207 Cb -0.20 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1d5a s ILE 207 CO -0.03 0.45 0.04 0.42 0.00 0.00 0.00 174.94 175.81 1d5a s THR 208 N 0.11 0.16 -0.52 2.92 -4.23 -1.14 -1.97 115.64 110.97 1d5a s THR 208 Ca 0.15 -1.90 -0.03 0.00 -1.18 0.00 0.00 61.69 58.73 1d5a s THR 208 Cb -0.13 -1.97 0.14 0.00 1.34 0.00 0.00 72.50 71.88 1d5a s THR 208 CO 0.03 -0.55 0.33 -0.47 -0.54 0.00 0.00 174.62 173.43 1d5a s TYR 209 N -4.00 3.49 -0.87 3.99 5.04 -1.26 -1.32 117.35 122.42 1d5a s TYR 209 Ca 0.21 -2.53 0.00 0.00 -2.44 0.00 0.00 57.07 52.32 1d5a s TYR 209 Cb 0.07 -3.23 0.00 0.00 0.35 0.00 0.00 41.96 39.15 1d5a s TYR 209 CO 0.00 -0.91 0.00 -1.71 -1.34 0.00 0.00 175.55 171.59 1d5a n ASN 210 N 4.07 -3.45 0.00 4.32 2.85 -1.26 -4.88 115.26 116.91 1d5a n ASN 210 Ca 0.02 0.03 0.07 0.00 -0.11 0.00 0.00 54.58 54.60 1d5a n ASN 210 Cb 0.40 -2.57 0.35 0.00 1.24 0.00 0.00 39.78 39.20 1d5a n ASN 210 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1d5a n GLY 211 N -1.14 -0.90 0.24 8.20 0.00 -1.26 -2.17 105.19 108.17 1d5a n GLY 211 Ca -0.11 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 45.97 1d5a n GLY 211 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1d5a h ASP 212 N 0.00 0.00 0.00 1.61 3.58 -1.92 -3.13 116.42 116.56 1d5a h ASP 212 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1d5a h ASP 212 Cb 0.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.25 1d5a h ASP 212 CO 0.00 0.13 0.00 0.59 -2.88 0.00 0.00 179.24 177.08 1d5a n ASN 213 N -3.28 0.12 0.00 2.28 3.02 -0.92 -4.09 115.26 112.38 1d5a n ASN 213 Ca 0.00 -0.46 0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1d5a n ASN 213 Cb 0.38 0.60 0.00 0.00 -0.61 0.00 0.00 39.78 40.15 1d5a n ASN 213 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1d5a n PHE 214 N -0.60 0.00 -0.17 3.10 7.35 -1.03 -4.81 117.46 121.30 1d5a n PHE 214 Ca 0.00 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.65 1d5a n PHE 214 Cb 0.01 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 39.81 1d5a n PHE 214 CO 0.00 0.00 0.00 -0.25 -0.76 0.00 0.00 176.76 175.75 1d5a n ASP 215 N -0.36 -0.42 -0.15 -2.13 8.00 -1.26 -0.68 116.55 119.55 1d5a n ASP 215 Ca 0.00 0.75 -0.11 0.00 0.71 0.00 0.00 54.79 56.14 1d5a n ASP 215 Cb 0.00 -0.11 -0.01 0.00 -0.02 0.00 0.00 41.12 40.98 1d5a n ASP 215 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1d5a h PHE 216 N 0.00 0.96 -1.00 1.24 -1.00 -1.90 -1.04 116.94 114.19 1d5a h PHE 216 Ca 0.08 -0.20 0.06 0.00 2.81 0.00 0.00 57.97 60.72 1d5a h PHE 216 Cb 0.19 -0.23 -0.07 0.00 3.61 0.00 0.00 35.95 39.44 1d5a h PHE 216 CO -0.42 0.95 0.65 0.00 -1.61 0.00 0.00 178.31 177.88 1d5a h ALA 217 N 0.87 1.40 0.23 2.45 0.00 -1.15 0.41 119.26 123.47 1d5a h ALA 217 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1d5a h ALA 217 Cb 0.64 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1d5a h ALA 217 CO 0.04 0.46 -0.11 -0.92 0.00 0.00 0.00 179.25 178.72 1d5a h TYR 218 N 1.19 -0.29 -0.26 0.00 3.20 -1.21 -2.91 116.97 116.69 1d5a h TYR 218 Ca 0.43 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.37 1d5a h TYR 218 Cb 0.15 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1d5a h TYR 218 CO -0.00 0.07 0.43 -0.07 -1.64 0.00 0.00 178.16 176.94 1d5a h LEU 219 N -0.94 0.00 0.04 2.82 3.38 -0.99 0.32 115.31 119.94 1d5a h LEU 219 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1d5a h LEU 219 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1d5a h LEU 219 CO 0.05 0.00 -0.02 0.50 0.09 0.00 0.00 178.44 179.06 1d5a h LYS 220 N 0.00 -0.05 -0.03 1.13 3.64 -0.89 -3.27 116.57 117.11 1d5a h LYS 220 Ca 0.13 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1d5a h LYS 220 Cb 0.98 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1d5a h LYS 220 CO -0.00 -0.03 -0.05 -0.22 -2.27 0.00 0.00 179.45 176.87 1d5a h LYS 221 N -0.40 -0.08 -0.04 1.90 3.64 -1.29 0.80 116.57 121.10 1d5a h LYS 221 Ca -0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1d5a h LYS 221 Cb 0.04 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1d5a h LYS 221 CO 0.01 -0.05 0.00 -2.13 -2.27 0.00 0.00 179.45 175.00 1d5a n ARG 222 N -5.17 0.15 0.00 1.90 3.00 0.11 -0.63 116.66 116.02 1d5a n ARG 222 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.79 1d5a n ARG 222 Cb 0.10 -1.02 0.00 0.00 0.00 0.00 0.00 32.46 31.54 1d5a n ARG 222 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1d5a n SER 223 N -0.23 3.32 0.09 6.15 2.88 0.08 -4.58 113.62 121.33 1d5a n SER 223 Ca 0.00 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.65 1d5a n SER 223 Cb 0.01 0.16 0.45 0.00 -0.75 0.00 0.00 64.21 64.08 1d5a n SER 223 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1d5a n GLU 224 N -1.98 0.16 0.00 -1.46 1.02 0.20 -1.96 120.64 116.61 1d5a n GLU 224 Ca 0.00 0.32 0.12 0.00 -0.02 0.00 0.00 57.16 57.58 1d5a n GLU 224 Cb 0.38 -1.76 0.15 0.00 -0.02 0.00 0.00 31.44 30.18 1d5a n GLU 224 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1d5a n MET 225 N -2.05 1.91 -0.18 3.49 0.00 -0.88 -4.11 117.12 115.30 1d5a n MET 225 Ca 0.03 -1.52 0.07 0.00 0.00 0.00 0.00 57.70 56.29 1d5a n MET 225 Cb 0.27 -1.47 0.10 0.00 0.00 0.00 0.00 33.22 32.12 1d5a n MET 225 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1d5a n LEU 226 N 0.78 1.70 -3.48 3.17 4.32 -0.94 -5.03 117.00 117.53 1d5a n LEU 226 Ca 0.13 -2.49 -0.22 0.00 -0.02 0.00 0.00 56.01 53.41 1d5a n LEU 226 Cb 0.53 -0.30 0.06 0.00 -1.62 0.00 0.00 43.42 42.08 1d5a n LEU 226 CO 0.19 0.58 -0.02 0.61 -1.22 0.00 0.00 177.39 177.53 1d5a n GLY 227 N -1.03 -0.93 2.75 -0.72 0.00 -1.09 -5.02 105.19 99.14 1d5a n GLY 227 Ca 0.11 0.45 -0.18 0.00 0.00 0.00 0.00 46.02 46.40 1d5a n GLY 227 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d5a s VAL 228 N -3.46 0.02 -0.21 1.61 1.01 -0.83 -5.06 120.40 113.48 1d5a s VAL 228 Ca 0.37 0.25 -0.27 0.00 0.00 0.00 0.00 61.98 62.33 1d5a s VAL 228 Cb -0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 36.38 36.10 1d5a s VAL 228 CO 0.79 0.15 0.94 -0.54 0.00 0.00 0.00 175.10 176.44 1d5a s LYS 229 N 1.54 4.26 -1.14 2.72 1.02 -1.26 -4.39 119.74 122.48 1d5a s LYS 229 Ca -0.03 1.18 -0.15 0.00 0.02 0.00 0.00 55.97 57.00 1d5a s LYS 229 Cb -0.13 -3.62 0.17 0.00 -0.52 0.00 0.00 37.83 33.73 1d5a s LYS 229 CO -0.03 -0.52 1.34 0.12 -0.92 0.00 0.00 175.35 175.34 1d5a s PHE 230 N 2.80 3.48 -0.38 3.18 5.36 -1.26 -4.99 117.98 126.17 1d5a s PHE 230 Ca 0.41 -2.01 -0.18 0.00 -0.96 0.00 0.00 56.93 54.18 1d5a s PHE 230 Cb -0.16 -4.27 0.01 0.00 -0.34 0.00 0.00 43.02 38.26 1d5a s PHE 230 CO 0.09 -1.38 0.53 0.42 -1.46 0.00 0.00 175.22 173.41 1d5a s ILE 231 N 1.61 4.99 0.00 3.12 1.09 -1.26 -4.21 121.20 126.53 1d5a s ILE 231 Ca 0.39 0.19 0.00 0.00 -1.10 0.00 0.00 60.65 60.14 1d5a s ILE 231 Cb -0.04 -4.02 0.00 0.00 -1.06 0.00 0.00 42.46 37.34 1d5a s ILE 231 CO -0.03 -0.32 0.00 0.18 -0.10 0.00 0.00 174.94 174.67 1d5a n LEU 232 N 5.82 0.00 -4.78 2.97 4.77 -1.07 -5.02 117.00 119.69 1d5a n LEU 232 Ca -0.04 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.57 1d5a n LEU 232 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1d5a n LEU 232 CO 0.47 0.00 0.75 -0.83 -1.33 0.00 0.00 177.39 176.45 1d5a s GLY 233 N -1.65 2.73 0.00 -0.72 0.00 -1.11 -4.91 107.32 101.66 1d5a s GLY 233 Ca 0.00 0.74 0.11 0.00 0.00 0.00 0.00 44.72 45.57 1d5a s GLY 233 CO 0.00 1.17 1.13 0.54 0.00 0.00 0.00 173.10 175.94 1d5a n ARG 234 N -0.20 0.57 -0.29 2.90 1.74 -0.86 -1.44 116.66 119.08 1d5a n ARG 234 Ca 0.06 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.22 1d5a n ARG 234 Cb 0.49 -1.31 0.17 0.00 -1.02 0.00 0.00 32.46 30.80 1d5a n ARG 234 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1d5a n ASP 235 N -0.81 2.08 -0.12 0.55 5.75 -1.26 -4.94 116.55 117.80 1d5a n ASP 235 Ca 0.08 -3.42 -0.02 0.00 -0.01 0.00 0.00 54.79 51.43 1d5a n ASP 235 Cb 0.04 -0.47 -0.01 0.00 -1.03 0.00 0.00 41.12 39.65 1d5a n ASP 235 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1d5a n GLY 236 N -1.30 0.37 3.95 6.12 0.00 -0.52 -5.00 105.19 108.81 1d5a n GLY 236 Ca 0.17 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1d5a n GLY 236 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d5a s SER 237 N -2.12 2.98 0.00 1.61 1.04 -1.25 -4.87 113.70 111.10 1d5a s SER 237 Ca 0.00 0.07 0.07 0.00 0.48 0.00 0.00 55.95 56.56 1d5a s SER 237 Cb 0.00 -0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.04 1d5a s SER 237 CO 0.00 -2.80 -0.20 -0.70 0.98 0.00 0.00 173.24 170.52 1d5a s GLU 238 N -5.86 2.17 0.09 4.02 2.12 -1.26 -2.61 118.70 117.37 1d5a s GLU 238 Ca 0.76 -0.91 -0.36 0.00 0.36 0.00 0.00 54.97 54.82 1d5a s GLU 238 Cb -0.02 -2.19 -0.17 0.00 0.26 0.00 0.00 34.13 32.01 1d5a s GLU 238 CO 0.53 0.56 1.21 -0.35 -0.54 0.00 0.00 175.26 176.67 1d5a n PRO 239 N 1.96 0.86 -3.78 4.30 -0.04 -1.26 -4.91 135.00 132.13 1d5a n PRO 239 Ca -0.16 0.31 -0.35 0.00 -0.04 0.00 0.00 63.50 63.25 1d5a n PRO 239 Cb 0.52 -1.86 -0.08 0.00 -0.04 0.00 0.00 33.50 32.04 1d5a n PRO 239 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1d5a s LYS 240 N 0.11 4.06 0.45 0.54 2.20 -0.54 -4.93 119.74 121.63 1d5a s LYS 240 Ca 0.82 -0.22 0.08 0.00 -0.36 0.00 0.00 55.97 56.29 1d5a s LYS 240 Cb -1.00 -3.36 0.01 0.00 -1.51 0.00 0.00 37.83 31.97 1d5a s LYS 240 CO 0.51 0.37 0.48 0.42 -0.36 0.00 0.00 175.35 176.76 1d5a s ILE 241 N 0.16 2.53 0.00 5.43 1.01 -1.26 -0.77 121.20 128.30 1d5a s ILE 241 Ca 0.09 -1.24 0.00 0.00 0.00 0.00 0.00 60.65 59.49 1d5a s ILE 241 Cb -0.11 -2.78 0.00 0.00 0.01 0.00 0.00 42.46 39.58 1d5a s ILE 241 CO -0.01 0.00 0.00 0.00 0.00 0.00 0.00 174.94 174.93 1d5a n GLN 242 N -1.73 0.00 -2.35 2.79 -0.00 -1.01 -4.97 117.38 110.11 1d5a n GLN 242 Ca 0.05 0.00 -0.41 0.00 -0.00 0.00 0.00 57.00 56.65 1d5a n GLN 242 Cb 0.61 0.00 -0.03 0.00 -0.00 0.00 0.00 30.24 30.82 1d5a n GLN 242 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1d5a s ARG 243 N -2.00 4.51 -0.00 2.61 0.52 -1.26 0.13 118.95 123.46 1d5a s ARG 243 Ca 0.00 1.93 0.14 0.00 -0.52 0.00 0.00 55.73 57.28 1d5a s ARG 243 Cb 0.00 -3.19 -0.16 0.00 0.52 0.00 0.00 34.95 32.12 1d5a s ARG 243 CO 0.00 -0.01 0.58 -0.12 0.02 0.00 0.00 175.30 175.77 1d5a n MET 244 N 1.72 2.11 0.00 3.54 1.56 0.41 -4.82 117.12 121.64 1d5a n MET 244 Ca 0.02 -0.01 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1d5a n MET 244 Cb 0.44 -1.19 0.00 0.00 2.15 0.00 0.00 33.22 34.62 1d5a n MET 244 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1d5a n GLY 245 N 1.37 -0.98 0.03 -5.12 0.00 -1.26 -4.88 105.19 94.35 1d5a n GLY 245 Ca 0.02 0.36 0.13 0.00 0.00 0.00 0.00 46.02 46.53 1d5a n GLY 245 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1d5a n ASP 246 N 0.00 0.47 -1.12 1.61 8.00 -1.26 -4.91 116.55 119.34 1d5a n ASP 246 Ca 0.00 0.17 -0.01 0.00 0.71 0.00 0.00 54.79 55.66 1d5a n ASP 246 Cb 0.00 -0.13 -0.00 0.00 -0.02 0.00 0.00 41.12 40.97 1d5a n ASP 246 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1d5a n ARG 247 N -1.78 0.02 -2.26 -1.24 1.74 -1.26 -5.17 116.66 106.71 1d5a n ARG 247 Ca 0.05 -0.19 -0.08 0.00 -0.77 0.00 0.00 57.85 56.87 1d5a n ARG 247 Cb 0.38 0.15 -0.00 0.00 -1.02 0.00 0.00 32.46 31.97 1d5a n ARG 247 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1d5a n PHE 248 N -0.04 -0.94 -3.77 -1.55 3.01 -1.26 -0.44 117.46 112.47 1d5a n PHE 248 Ca 0.00 -0.66 -0.13 0.00 1.01 0.00 0.00 57.45 57.68 1d5a n PHE 248 Cb 0.03 -0.12 -0.11 0.00 -0.01 0.00 0.00 39.48 39.27 1d5a n PHE 248 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1d5a s ALA 249 N -2.22 -0.73 -0.07 4.37 0.00 0.12 -4.56 121.76 118.67 1d5a s ALA 249 Ca 0.07 0.84 0.02 0.00 0.00 0.00 0.00 51.96 52.89 1d5a s ALA 249 Cb -0.01 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1d5a s ALA 249 CO 0.04 -0.14 -0.11 0.08 0.00 0.00 0.00 175.76 175.63 1d5a s VAL 250 N 0.19 3.32 0.11 0.00 1.01 -1.26 -2.39 120.40 121.39 1d5a s VAL 250 Ca -0.00 -0.61 0.10 0.00 0.00 0.00 0.00 61.98 61.47 1d5a s VAL 250 Cb -0.02 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 1d5a s VAL 250 CO 0.00 0.58 -0.26 -0.70 0.00 0.00 0.00 175.10 174.72 1d5a s GLU 251 N -0.56 1.40 -0.26 2.72 2.12 0.05 -4.79 118.70 119.38 1d5a s GLU 251 Ca 0.08 -1.28 -0.01 0.00 0.36 0.00 0.00 54.97 54.12 1d5a s GLU 251 Cb -0.12 -1.81 0.08 0.00 0.26 0.00 0.00 34.13 32.55 1d5a s GLU 251 CO 0.02 0.43 0.06 0.08 -0.54 0.00 0.00 175.26 175.31 1d5a s VAL 252 N -1.04 0.79 0.13 3.70 1.01 -1.26 -1.47 120.40 122.25 1d5a s VAL 252 Ca 0.12 -1.07 -0.35 0.00 0.00 0.00 0.00 61.98 60.68 1d5a s VAL 252 Cb -0.10 -1.44 -0.15 0.00 0.00 0.00 0.00 36.38 34.69 1d5a s VAL 252 CO 0.05 -0.46 1.45 0.29 0.00 0.00 0.00 175.10 176.43 1d5a n LYS 253 N 4.91 1.63 0.00 2.72 4.76 -1.26 -1.61 118.16 129.31 1d5a n LYS 253 Ca -0.06 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 55.97 1d5a n LYS 253 Cb 0.44 -2.29 0.00 0.00 -1.84 0.00 0.00 35.03 31.34 1d5a n LYS 253 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1d5a n GLY 254 N 2.91 2.84 1.08 0.72 0.00 -1.26 -2.03 105.19 109.46 1d5a n GLY 254 Ca 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 1d5a n GLY 254 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5a n ARG 255 N 0.00 1.28 -3.79 1.61 1.74 -0.63 -4.93 116.66 111.93 1d5a n ARG 255 Ca 0.00 -0.98 -0.29 0.00 -0.77 0.00 0.00 57.85 55.81 1d5a n ARG 255 Cb 0.00 0.11 -0.16 0.00 -1.02 0.00 0.00 32.46 31.39 1d5a n ARG 255 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1d5a s ILE 256 N -0.79 0.94 -0.66 0.55 1.01 -0.49 -4.71 121.20 117.05 1d5a s ILE 256 Ca 0.08 -1.08 -0.26 0.00 0.00 0.00 0.00 60.65 59.39 1d5a s ILE 256 Cb -0.01 -1.50 0.04 0.00 0.01 0.00 0.00 42.46 41.00 1d5a s ILE 256 CO 0.05 -0.37 1.17 -2.28 0.00 0.00 0.00 174.94 173.51 1d5a s HIS 257 N 1.63 2.49 -0.68 3.97 5.65 -1.26 -1.86 115.29 125.23 1d5a s HIS 257 Ca 0.02 0.02 -0.16 0.00 0.25 0.00 0.00 55.06 55.19 1d5a s HIS 257 Cb -0.18 -4.48 0.16 0.00 -1.18 0.00 0.00 32.58 26.90 1d5a s HIS 257 CO -0.14 -1.79 0.69 0.12 -0.65 0.00 0.00 174.74 172.97 1d5a s PHE 258 N 5.06 3.37 -0.25 3.88 5.99 -0.69 -4.90 117.98 130.44 1d5a s PHE 258 Ca 0.35 -1.48 -0.27 0.00 0.00 0.00 0.00 56.93 55.53 1d5a s PHE 258 Cb -0.10 -3.89 0.01 0.00 0.00 0.00 0.00 43.02 39.04 1d5a s PHE 258 CO 0.18 -1.10 0.96 0.34 -0.00 0.00 0.00 175.22 175.60 1d5a s ASP 259 N 3.10 6.97 0.39 6.13 -1.08 -1.26 -2.90 116.67 128.02 1d5a s ASP 259 Ca 0.12 1.20 0.08 0.00 -0.52 0.00 0.00 52.55 53.44 1d5a s ASP 259 Cb -0.20 -2.50 0.78 0.00 -1.46 0.00 0.00 42.92 39.54 1d5a s ASP 259 CO -0.02 -0.64 1.94 -0.07 0.52 0.00 0.00 175.17 176.90 1d5a h LEU 260 N 9.43 0.30 -0.05 -1.34 3.38 -1.59 -3.34 115.31 122.10 1d5a h LEU 260 Ca -0.21 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 57.74 1d5a h LEU 260 Cb 1.07 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.69 1d5a h LEU 260 CO 0.95 0.40 -0.53 0.22 0.09 0.00 0.00 178.44 179.56 1d5a h TYR 261 N 0.31 -1.57 -0.31 1.13 3.20 -1.92 -1.65 116.97 116.17 1d5a h TYR 261 Ca 0.07 0.05 0.06 0.00 3.14 0.00 0.00 58.73 62.06 1d5a h TYR 261 Cb 0.29 0.69 -0.06 0.00 1.54 0.00 0.00 36.73 39.19 1d5a h TYR 261 CO 0.01 -0.56 -0.10 -1.35 -1.64 0.00 0.00 178.16 174.52 1d5a h PRO 262 N -0.63 -0.03 -0.14 1.82 0.11 -1.87 -2.53 132.00 128.73 1d5a h PRO 262 Ca 0.02 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.18 1d5a h PRO 262 Cb 0.71 0.01 -0.06 0.00 0.11 0.00 0.00 31.00 31.77 1d5a h PRO 262 CO -0.39 -0.02 -0.22 0.28 -0.21 0.00 0.00 178.00 177.45 1d5a h VAL 263 N -0.03 0.46 -0.45 3.15 2.07 -1.65 -3.09 116.25 116.72 1d5a h VAL 263 Ca 0.15 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.74 1d5a h VAL 263 Cb 0.26 0.46 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1d5a h VAL 263 CO -0.34 0.00 0.12 0.40 0.02 0.00 0.00 177.57 177.78 1d5a h ILE 264 N -0.27 0.81 0.00 4.57 2.04 -0.98 -1.31 117.51 122.37 1d5a h ILE 264 Ca 0.10 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.87 1d5a h ILE 264 Cb 0.42 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1d5a h ILE 264 CO -0.30 0.05 0.00 -1.14 0.00 0.00 0.00 178.15 176.76 1d5a n ARG 265 N -5.06 0.54 -0.03 2.37 0.63 -0.98 -0.64 116.66 113.49 1d5a n ARG 265 Ca 0.04 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.94 1d5a n ARG 265 Cb 0.19 -1.11 -0.04 0.00 0.45 0.00 0.00 32.46 31.96 1d5a n ARG 265 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1d5a n ARG 266 N -0.61 2.72 -0.05 -0.14 0.63 -0.54 -4.74 116.66 113.94 1d5a n ARG 266 Ca 0.03 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.79 1d5a n ARG 266 Cb 0.01 -1.12 -0.14 0.00 0.45 0.00 0.00 32.46 31.66 1d5a n ARG 266 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1d5a n THR 267 N -2.26 1.63 -4.62 5.15 -1.04 -0.93 -4.95 114.28 107.27 1d5a n THR 267 Ca -0.08 -0.67 -0.32 0.00 -2.04 0.00 0.00 64.05 60.94 1d5a n THR 267 Cb 0.65 -1.43 -0.12 0.00 -1.82 0.00 0.00 70.33 67.62 1d5a n THR 267 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1d5a s ILE 268 N -2.55 3.16 -0.08 12.58 1.01 0.19 -5.10 121.20 130.41 1d5a s ILE 268 Ca -0.23 -0.96 0.04 0.00 0.00 0.00 0.00 60.65 59.51 1d5a s ILE 268 Cb 0.07 -2.34 -0.01 0.00 0.01 0.00 0.00 42.46 40.20 1d5a s ILE 268 CO 0.73 0.39 -0.22 0.21 0.00 0.00 0.00 174.94 176.06 1d5a s ASN 269 N -1.33 3.33 0.11 3.58 3.84 -1.26 -4.32 114.94 118.88 1d5a s ASN 269 Ca 0.15 -0.46 -0.13 0.00 0.21 0.00 0.00 52.86 52.63 1d5a s ASN 269 Cb -0.11 -1.09 0.02 0.00 -0.55 0.00 0.00 41.25 39.52 1d5a s ASN 269 CO 0.06 0.22 0.32 -0.76 -2.79 0.00 0.00 177.10 174.15 1d5a s LEU 270 N -0.03 0.80 0.32 3.21 1.43 -1.26 -5.05 118.68 118.09 1d5a s LEU 270 Ca -0.07 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.59 1d5a s LEU 270 Cb -0.15 1.53 0.53 0.00 0.03 0.00 0.00 46.19 48.13 1d5a s LEU 270 CO 0.05 -0.80 1.96 1.55 0.23 0.00 0.00 176.35 179.33 1d5a h PRO 271 N 2.52 0.90 -2.15 1.29 0.13 -2.00 -3.43 132.00 129.26 1d5a h PRO 271 Ca -0.34 -0.08 -0.02 0.00 -0.87 0.00 0.00 66.00 64.69 1d5a h PRO 271 Cb 1.23 -0.19 -0.22 0.00 0.13 0.00 0.00 31.00 31.96 1d5a h PRO 271 CO 0.50 0.64 -0.03 0.95 -0.23 0.00 0.00 178.00 179.84 1d5a s THR 272 N -5.66 -0.00 0.01 1.56 -4.23 -1.26 -5.01 115.64 101.05 1d5a s THR 272 Ca -0.10 0.02 -0.10 0.00 -1.18 0.00 0.00 61.69 60.32 1d5a s THR 272 Cb 0.17 -0.91 -0.05 0.00 1.34 0.00 0.00 72.50 73.05 1d5a s THR 272 CO 0.78 0.01 0.34 -0.31 -0.54 0.00 0.00 174.62 174.89 1d5a s TYR 273 N 1.26 3.63 -0.09 3.99 1.51 -1.26 -4.91 117.35 121.48 1d5a s TYR 273 Ca -0.07 0.77 -0.30 0.00 -1.01 0.00 0.00 57.07 56.46 1d5a s TYR 273 Cb -0.05 -2.13 0.07 0.00 -0.11 0.00 0.00 41.96 39.73 1d5a s TYR 273 CO -0.13 0.62 0.69 0.99 -1.11 0.00 0.00 175.55 176.60 1d5a s THR 274 N -1.21 0.00 0.57 -0.71 2.01 -1.26 -4.98 115.64 110.05 1d5a s THR 274 Ca 0.26 0.00 0.29 0.00 0.31 0.00 0.00 61.69 62.55 1d5a s THR 274 Cb -0.14 -1.00 0.41 0.00 0.01 0.00 0.00 72.50 71.77 1d5a s THR 274 CO 0.14 0.00 1.92 0.25 -0.69 0.00 0.00 174.62 176.24 1d5a h LEU 275 N 3.36 0.00 0.06 4.42 7.12 -1.98 -0.16 115.31 128.12 1d5a h LEU 275 Ca -0.27 0.00 -0.17 0.00 0.13 0.00 0.00 57.88 57.57 1d5a h LEU 275 Cb 1.14 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.27 1d5a h LEU 275 CO 0.33 0.00 -0.87 -0.33 -0.13 0.00 0.00 178.44 177.44 1d5a h GLU 276 N 0.00 0.12 0.00 1.25 4.39 -1.93 -3.00 114.58 115.41 1d5a h GLU 276 Ca 0.26 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1d5a h GLU 276 Cb 1.23 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 1d5a h GLU 276 CO -0.00 1.10 0.00 -2.37 -1.16 0.00 0.00 179.01 176.57 1d5a n THR 277 N -4.28 0.00 -0.03 1.13 5.66 -0.62 -2.57 114.28 113.56 1d5a n THR 277 Ca -0.21 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 60.79 1d5a n THR 277 Cb 0.71 -0.61 -0.09 0.00 -1.55 0.00 0.00 70.33 68.79 1d5a n THR 277 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1d5a n VAL 278 N -0.98 0.40 0.12 1.08 0.31 -0.17 -4.17 118.33 114.92 1d5a n VAL 278 Ca 0.17 -0.37 -0.02 0.00 -0.01 0.00 0.00 64.34 64.11 1d5a n VAL 278 Cb 0.08 -0.28 0.18 0.00 -0.91 0.00 0.00 33.84 32.91 1d5a n VAL 278 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 1d5a h TYR 279 N 0.00 0.11 -0.01 3.52 3.20 -1.34 -2.89 116.97 119.55 1d5a h TYR 279 Ca -0.16 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.64 1d5a h TYR 279 Cb 1.14 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.39 1d5a h TYR 279 CO 0.00 0.64 -0.13 0.93 -1.64 0.00 0.00 178.16 177.96 1d5a h GLU 280 N 0.07 0.11 -0.46 1.82 5.08 -1.63 0.30 114.58 119.86 1d5a h GLU 280 Ca -0.00 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1d5a h GLU 280 Cb 1.03 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.28 1d5a h GLU 280 CO 0.08 0.81 0.31 -1.35 -1.00 0.00 0.00 179.01 177.86 1d5a h PRO 281 N -0.56 0.37 0.10 2.33 0.11 -1.72 -2.86 132.00 129.77 1d5a h PRO 281 Ca -0.01 -0.02 -0.27 0.00 0.11 0.00 0.00 66.00 65.81 1d5a h PRO 281 Cb 0.85 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.86 1d5a h PRO 281 CO 0.03 0.24 -1.40 0.28 -0.21 0.00 0.00 178.00 176.93 1d5a h VAL 282 N 0.38 0.99 -3.73 3.15 2.07 -1.55 -3.47 116.25 114.10 1d5a h VAL 282 Ca 0.20 -2.36 -0.68 0.00 0.82 0.00 0.00 66.70 64.69 1d5a h VAL 282 Cb 0.32 2.64 -0.19 0.00 -1.52 0.00 0.00 31.29 32.54 1d5a h VAL 282 CO -0.05 0.66 -0.81 -0.36 0.02 0.00 0.00 177.57 177.04 1d5a s PHE 283 N -2.46 2.51 0.24 1.57 0.40 0.10 -5.03 117.98 115.32 1d5a s PHE 283 Ca -0.21 -0.28 0.36 0.00 -0.60 0.00 0.00 56.93 56.20 1d5a s PHE 283 Cb 0.05 -1.33 1.75 0.00 0.51 0.00 0.00 43.02 43.99 1d5a s PHE 283 CO 0.74 0.38 2.08 0.78 0.70 0.00 0.00 175.22 179.90 1d5a h GLY 284 N 3.73 0.00 -3.96 4.36 0.00 -1.80 -3.30 103.07 102.10 1d5a h GLY 284 Ca -0.50 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.32 1d5a h GLY 284 CO 0.45 0.00 0.43 1.20 0.00 0.00 0.00 176.54 178.62 1d5a s GLN 285 N -3.82 4.68 0.78 4.80 -0.21 -1.26 -4.96 119.66 119.67 1d5a s GLN 285 Ca -0.01 1.65 -0.08 0.00 0.02 0.00 0.00 55.36 56.93 1d5a s GLN 285 Cb 0.10 -3.27 0.11 0.00 1.00 0.00 0.00 33.01 30.95 1d5a s GLN 285 CO 0.43 0.22 1.09 -2.14 -2.12 0.00 0.00 175.29 172.78 1d5a s PRO 286 N -0.71 1.65 -0.15 2.91 0.02 -1.26 -3.82 135.00 133.64 1d5a s PRO 286 Ca 0.46 -0.50 -0.22 0.00 0.02 0.00 0.00 61.00 60.76 1d5a s PRO 286 Cb -0.28 -2.12 0.06 0.00 0.02 0.00 0.00 34.50 32.17 1d5a s PRO 286 CO 0.35 -1.61 0.57 0.00 -0.33 0.00 0.00 177.00 175.98 1d5a s ALA 287 N -3.40 -1.43 0.50 -1.55 0.00 -1.26 -4.99 121.76 109.62 1d5a s ALA 287 Ca 0.65 1.39 -0.21 0.00 0.00 0.00 0.00 51.96 53.79 1d5a s ALA 287 Cb -0.08 -0.59 -0.07 0.00 0.00 0.00 0.00 23.12 22.39 1d5a s ALA 287 CO 0.47 -0.30 1.13 -1.21 0.00 0.00 0.00 175.76 175.85 1d5a s GLU 288 N -0.27 3.58 0.00 0.00 2.02 -1.26 -4.95 118.70 117.82 1d5a s GLU 288 Ca -0.04 1.65 0.00 0.00 0.02 0.00 0.00 54.97 56.60 1d5a s GLU 288 Cb -0.03 -2.19 0.00 0.00 0.10 0.00 0.00 34.13 32.01 1d5a s GLU 288 CO 0.03 -0.67 0.00 0.36 0.02 0.00 0.00 175.26 175.00 1d5a n LYS 289 N -0.91 0.00 -3.18 1.61 2.85 -1.26 -4.97 118.16 112.30 1d5a n LYS 289 Ca 0.09 0.00 -0.14 0.00 -1.05 0.00 0.00 58.31 57.21 1d5a n LYS 289 Cb 0.50 0.00 0.07 0.00 -0.65 0.00 0.00 35.03 34.95 1d5a n LYS 289 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1d5a n VAL 290 N 0.00 -6.47 -1.12 0.58 0.31 -1.26 -4.94 118.33 105.43 1d5a n VAL 290 Ca 0.00 -0.74 -0.13 0.00 -0.01 0.00 0.00 64.34 63.46 1d5a n VAL 290 Cb 0.00 -5.27 0.26 0.00 -0.91 0.00 0.00 33.84 27.92 1d5a n VAL 290 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1d5a n TYR 291 N -3.49 2.74 0.15 3.52 4.02 -1.26 -4.60 117.16 118.24 1d5a n TYR 291 Ca -0.18 -1.47 -0.14 0.00 -0.01 0.00 0.00 57.90 56.10 1d5a n TYR 291 Cb 0.63 -0.80 -0.07 0.00 -0.02 0.00 0.00 39.34 39.08 1d5a n TYR 291 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1d5a h ALA 292 N 2.02 -0.33 0.07 -0.72 0.00 -1.92 -3.25 119.26 115.13 1d5a h ALA 292 Ca 0.42 -0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.96 1d5a h ALA 292 Cb 2.57 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 20.50 1d5a h ALA 292 CO 0.90 -0.69 -1.62 0.93 0.00 0.00 0.00 179.25 178.77 1d5a h GLU 293 N -0.34 0.15 0.00 0.00 5.08 -1.88 -3.35 114.58 114.23 1d5a h GLU 293 Ca -0.02 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1d5a h GLU 293 Cb 0.28 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1d5a h GLU 293 CO 0.03 0.92 0.00 0.39 -1.00 0.00 0.00 179.01 179.35 1d5a n GLU 294 N -3.32 0.08 -0.07 2.33 1.02 -1.24 -2.30 120.64 117.15 1d5a n GLU 294 Ca -0.18 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.74 1d5a n GLU 294 Cb 1.04 -1.36 -0.12 0.00 -0.02 0.00 0.00 31.44 30.97 1d5a n GLU 294 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1d5a n ILE 295 N -0.86 1.63 -0.17 -3.67 5.41 -1.23 -3.23 119.36 117.23 1d5a n ILE 295 Ca 0.01 -0.31 -0.03 0.00 1.00 0.00 0.00 62.75 63.43 1d5a n ILE 295 Cb 0.01 -1.89 0.07 0.00 -0.71 0.00 0.00 39.64 37.12 1d5a n ILE 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1d5a h ALA 296 N -0.30 0.66 0.01 -1.39 0.00 -1.71 -0.25 119.26 116.28 1d5a h ALA 296 Ca -0.41 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 1d5a h ALA 296 Cb 1.63 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 1d5a h ALA 296 CO -0.11 -0.18 -0.01 0.93 0.00 0.00 0.00 179.25 179.88 1d5a h GLU 297 N 0.40 -0.02 -0.48 0.00 5.08 -1.73 -0.77 114.58 117.06 1d5a h GLU 297 Ca 0.25 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.75 1d5a h GLU 297 Cb 0.25 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1d5a h GLU 297 CO -0.24 -0.01 0.50 0.00 -1.00 0.00 0.00 179.01 178.26 1d5a h ALA 298 N -1.91 2.22 0.06 3.43 0.00 -1.51 0.94 119.26 122.49 1d5a h ALA 298 Ca -0.00 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1d5a h ALA 298 Cb 0.01 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1d5a h ALA 298 CO 0.00 -0.75 -0.71 2.35 0.00 0.00 0.00 179.25 180.15 1d5a h TRP 299 N 0.00 0.24 0.00 0.00 2.91 -0.95 -3.26 115.95 114.89 1d5a h TRP 299 Ca 0.23 -0.17 0.00 0.00 1.13 0.00 0.00 58.89 60.07 1d5a h TRP 299 Cb 1.22 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.86 1d5a h TRP 299 CO 0.00 1.27 0.00 0.00 -1.03 0.00 0.00 178.44 178.68 1d5a h ALA 300 N -0.07 1.00 -2.39 2.65 0.00 -0.37 -3.32 119.26 116.77 1d5a h ALA 300 Ca -0.16 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.02 1d5a h ALA 300 Cb 1.38 0.00 -0.33 0.00 0.00 0.00 0.00 17.79 18.84 1d5a h ALA 300 CO 0.02 0.00 0.18 0.45 0.00 0.00 0.00 179.25 179.90 1d5a n SER 301 N -2.85 5.03 0.00 0.00 2.88 0.32 -5.01 113.62 113.98 1d5a n SER 301 Ca 0.02 -3.27 0.00 0.00 -1.33 0.00 0.00 58.87 54.29 1d5a n SER 301 Cb 0.33 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 1d5a n SER 301 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1d5a n GLY 302 N 1.77 0.00 0.24 0.46 0.00 -1.25 -0.79 105.19 105.63 1d5a n GLY 302 Ca 0.25 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.39 1d5a n GLY 302 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1d5a h GLU 303 N 0.00 0.00 -0.06 1.61 5.08 -1.94 -3.26 114.58 116.01 1d5a h GLU 303 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1d5a h GLU 303 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1d5a h GLU 303 CO 0.00 0.15 0.00 0.41 -1.00 0.00 0.00 179.01 178.57 1d5a n GLY 304 N 0.13 -0.25 0.10 -3.84 0.00 0.03 -2.99 105.19 98.37 1d5a n GLY 304 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1d5a n GLY 304 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1d5a h LEU 305 N 0.09 0.00 -2.40 0.99 3.38 -1.67 -3.36 115.31 112.35 1d5a h LEU 305 Ca 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1d5a h LEU 305 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1d5a h LEU 305 CO 0.00 0.05 0.12 -0.33 0.09 0.00 0.00 178.44 178.37 1d5a h GLU 306 N 0.00 0.00 0.14 1.13 5.08 -1.84 -1.00 114.58 118.08 1d5a h GLU 306 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 1d5a h GLU 306 Cb 0.90 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1d5a h GLU 306 CO 0.00 0.00 -1.82 -0.09 -1.00 0.00 0.00 179.01 176.10 1d5a h ARG 307 N 0.00 0.30 -0.02 2.33 2.43 -1.86 -3.35 114.38 114.21 1d5a h ARG 307 Ca 0.00 -0.51 -0.04 0.00 -0.81 0.00 0.00 59.98 58.62 1d5a h ARG 307 Cb 0.24 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1d5a h ARG 307 CO 0.00 1.20 -0.16 0.28 -1.51 0.00 0.00 179.97 179.78 1d5a h VAL 308 N 0.08 1.13 0.00 0.20 2.07 -1.40 -2.34 116.25 115.99 1d5a h VAL 308 Ca -0.36 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.51 1d5a h VAL 308 Cb 2.06 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 33.12 1d5a h VAL 308 CO 0.13 0.18 -0.19 0.00 0.02 0.00 0.00 177.57 177.71 1d5a h ALA 309 N 1.81 1.43 0.18 1.67 0.00 -1.58 -1.30 119.26 121.47 1d5a h ALA 309 Ca 0.01 -0.18 -0.31 0.00 0.00 0.00 0.00 54.91 54.43 1d5a h ALA 309 Cb 0.31 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.08 1d5a h ALA 309 CO 0.02 0.24 -1.45 0.00 0.00 0.00 0.00 179.25 178.06 1d5a h ARG 310 N 0.00 0.38 -0.12 0.00 3.08 -1.59 -3.16 114.38 112.97 1d5a h ARG 310 Ca -0.00 -0.65 -0.03 0.00 0.07 0.00 0.00 59.98 59.37 1d5a h ARG 310 Cb 0.41 0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1d5a h ARG 310 CO 0.03 1.29 -0.04 -0.92 -1.07 0.00 0.00 179.97 179.25 1d5a h TYR 311 N 0.10 0.17 0.67 3.04 3.20 -1.26 -0.28 116.97 122.61 1d5a h TYR 311 Ca -0.23 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.60 1d5a h TYR 311 Cb 2.07 -0.05 0.01 0.00 1.54 0.00 0.00 36.73 40.29 1d5a h TYR 311 CO 0.09 0.22 -0.32 1.03 -1.64 0.00 0.00 178.16 177.54 1d5a h SER 312 N 0.17 -0.76 0.56 -2.11 0.87 -1.28 -2.46 113.55 108.54 1d5a h SER 312 Ca 0.04 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1d5a h SER 312 Cb 0.19 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 1d5a h SER 312 CO 0.01 -0.40 0.00 0.00 -0.53 0.00 0.00 176.83 175.91 1d5a h MET 313 N -1.20 0.00 0.71 2.24 -0.00 -1.50 -2.59 114.93 112.59 1d5a h MET 313 Ca -0.09 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.57 1d5a h MET 313 Cb 0.69 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.30 1d5a h MET 313 CO 0.15 0.00 -0.34 0.93 -0.00 0.00 0.00 176.91 177.65 1d5a h GLU 314 N 0.00 -0.91 -0.71 -0.10 5.08 -0.89 0.45 114.58 117.50 1d5a h GLU 314 Ca 0.00 0.06 0.07 0.00 -1.00 0.00 0.00 59.36 58.49 1d5a h GLU 314 Cb 0.28 0.21 -0.09 0.00 0.50 0.00 0.00 28.75 29.65 1d5a h GLU 314 CO 0.00 -0.61 -0.47 -0.44 -1.00 0.00 0.00 179.01 176.49 1d5a h ASP 315 N -0.97 -1.69 -0.83 1.42 3.45 -1.04 0.45 116.42 117.22 1d5a h ASP 315 Ca -0.10 0.25 0.06 0.00 0.43 0.00 0.00 57.03 57.67 1d5a h ASP 315 Cb 0.73 0.74 -0.06 0.00 -0.56 0.00 0.00 39.33 40.17 1d5a h ASP 315 CO 0.16 -0.21 0.51 0.00 -1.57 0.00 0.00 179.24 178.13 1d5a h ALA 316 N 0.10 1.13 -0.11 3.45 0.00 -1.50 0.14 119.26 122.47 1d5a h ALA 316 Ca 0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1d5a h ALA 316 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1d5a h ALA 316 CO -0.70 0.25 0.05 -0.22 0.00 0.00 0.00 179.25 178.63 1d5a h LYS 317 N 0.93 0.17 0.72 0.00 3.11 0.19 -0.20 116.57 121.49 1d5a h LYS 317 Ca 0.36 -0.03 -0.04 0.00 -2.81 0.00 0.00 60.65 58.14 1d5a h LYS 317 Cb 0.16 -0.03 0.01 0.00 -1.00 0.00 0.00 32.23 31.37 1d5a h LYS 317 CO -0.17 0.26 -0.35 0.00 -2.81 0.00 0.00 179.45 176.39 1d5a h ALA 318 N 0.90 -0.97 -0.91 5.00 0.00 0.15 -1.91 119.26 121.50 1d5a h ALA 318 Ca 0.04 -0.22 0.16 0.00 0.00 0.00 0.00 54.91 54.88 1d5a h ALA 318 Cb 0.16 0.38 -0.10 0.00 0.00 0.00 0.00 17.79 18.23 1d5a h ALA 318 CO -0.00 -0.98 0.51 0.00 0.00 0.00 0.00 179.25 178.77 1d5a h THR 319 N -1.10 0.74 -0.26 0.00 1.03 -0.74 0.54 112.91 113.12 1d5a h THR 319 Ca -0.10 -0.24 -0.05 0.00 -0.01 0.00 0.00 66.41 66.01 1d5a h THR 319 Cb 0.77 -0.02 -0.01 0.00 -1.07 0.00 0.00 68.15 67.81 1d5a h THR 319 CO 0.16 0.13 -0.04 0.22 -0.01 0.00 0.00 175.52 175.98 1d5a h TYR 320 N 0.70 0.41 0.00 0.00 3.20 -0.90 -1.24 116.97 119.14 1d5a h TYR 320 Ca 0.50 -0.04 -0.17 0.00 3.14 0.00 0.00 58.73 62.16 1d5a h TYR 320 Cb 0.71 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 1d5a h TYR 320 CO -0.06 0.44 -0.80 0.93 -1.64 0.00 0.00 178.16 177.03 1d5a h GLU 321 N 0.38 0.00 -0.00 1.82 5.08 0.75 -2.80 114.58 119.80 1d5a h GLU 321 Ca 0.08 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1d5a h GLU 321 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1d5a h GLU 321 CO 0.01 0.80 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.70 1d5a h LEU 322 N 0.00 0.06 -2.32 1.33 3.38 -0.37 -3.16 115.31 114.23 1d5a h LEU 322 Ca -0.01 -0.74 -0.01 0.00 0.09 0.00 0.00 57.88 57.21 1d5a h LEU 322 Cb 1.55 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1d5a h LEU 322 CO 0.10 0.80 -0.04 1.23 0.09 0.00 0.00 178.44 180.62 1d5a h GLY 323 N -0.67 0.00 2.00 0.83 0.00 -1.34 0.35 103.07 104.25 1d5a h GLY 323 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1d5a h GLY 323 CO 0.01 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.72 1d5a n LYS 324 N -3.66 0.02 -0.13 4.80 4.81 -1.06 -1.69 118.16 121.26 1d5a n LYS 324 Ca -0.02 0.10 -0.21 0.00 -0.87 0.00 0.00 58.31 57.30 1d5a n LYS 324 Cb 0.14 -1.53 -0.11 0.00 0.02 0.00 0.00 35.03 33.55 1d5a n LYS 324 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1d5a n GLU 325 N -1.57 0.59 0.10 1.64 4.07 0.11 -4.65 120.64 120.93 1d5a n GLU 325 Ca 0.06 0.18 -0.01 0.00 -0.06 0.00 0.00 57.16 57.33 1d5a n GLU 325 Cb 0.29 -1.47 -0.04 0.00 -0.06 0.00 0.00 31.44 30.17 1d5a n GLU 325 CO 0.00 0.00 0.00 0.74 -0.06 0.00 0.00 177.13 177.81 1d5a h PHE 326 N -0.36 0.00 -0.21 4.31 -1.00 -1.24 -3.38 116.94 115.06 1d5a h PHE 326 Ca -0.59 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.23 1d5a h PHE 326 Cb 1.74 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 41.27 1d5a h PHE 326 CO -0.02 0.66 -0.04 0.35 -1.61 0.00 0.00 178.31 177.65 1d5a h PHE 327 N 0.00 -0.09 -0.66 -0.55 3.57 -1.57 -1.90 116.94 115.74 1d5a h PHE 327 Ca -0.04 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.59 1d5a h PHE 327 Cb 1.54 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 40.32 1d5a h PHE 327 CO 0.00 -0.08 0.44 -1.35 -2.23 0.00 0.00 178.31 175.09 1d5a h PRO 328 N 0.01 0.41 0.07 6.41 0.11 -1.82 0.58 132.00 137.77 1d5a h PRO 328 Ca 0.10 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 1d5a h PRO 328 Cb 0.15 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1d5a h PRO 328 CO -0.21 0.27 -0.03 0.52 -0.21 0.00 0.00 178.00 178.34 1d5a h MET 329 N 0.42 -0.09 -0.53 1.05 2.86 -1.60 -1.97 114.93 115.07 1d5a h MET 329 Ca 0.31 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.94 1d5a h MET 329 Cb 0.64 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 1d5a h MET 329 CO -0.09 0.40 0.25 0.93 1.06 0.00 0.00 176.91 179.46 1d5a h GLU 330 N -0.62 0.74 -0.95 1.72 4.39 -0.77 -0.57 114.58 118.51 1d5a h GLU 330 Ca -0.01 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 1d5a h GLU 330 Cb 0.53 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.99 1d5a h GLU 330 CO 0.02 0.58 0.58 0.00 -1.16 0.00 0.00 179.01 179.02 1d5a h ALA 331 N 1.54 1.21 -0.19 3.43 0.00 0.19 -0.97 119.26 124.47 1d5a h ALA 331 Ca 0.19 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 1d5a h ALA 331 Cb 0.08 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1d5a h ALA 331 CO -0.03 0.66 -0.52 1.96 0.00 0.00 0.00 179.25 181.32 1d5a h GLN 332 N 1.31 0.54 -0.15 0.00 1.08 -0.45 -2.54 115.11 114.91 1d5a h GLN 332 Ca 0.34 -0.33 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1d5a h GLN 332 Cb -0.07 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 1d5a h GLN 332 CO -0.07 0.93 0.05 -0.07 -0.95 0.00 0.00 178.83 178.72 1d5a h LEU 333 N 0.42 0.21 -0.37 1.46 3.38 -0.64 -1.97 115.31 117.81 1d5a h LEU 333 Ca 0.01 -0.20 0.07 0.00 0.09 0.00 0.00 57.88 57.85 1d5a h LEU 333 Cb 1.05 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.68 1d5a h LEU 333 CO 0.10 0.36 -0.09 0.28 0.09 0.00 0.00 178.44 179.17 1d5a h SER 334 N 0.05 -0.35 -0.94 -0.43 0.02 -1.18 0.42 113.55 111.14 1d5a h SER 334 Ca 0.05 0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.13 1d5a h SER 334 Cb 0.22 0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.95 1d5a h SER 334 CO -0.00 -0.12 0.62 -0.09 -1.14 0.00 0.00 176.83 176.09 1d5a h ARG 335 N -0.00 1.19 -0.15 3.45 2.43 -1.42 0.65 114.38 120.53 1d5a h ARG 335 Ca 0.18 -0.07 -0.19 0.00 -0.81 0.00 0.00 59.98 59.08 1d5a h ARG 335 Cb 0.27 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1d5a h ARG 335 CO -0.39 0.79 -0.69 1.25 -1.51 0.00 0.00 179.97 179.42 1d5a h LEU 336 N 1.22 0.73 0.13 3.80 5.85 -0.37 -3.32 115.31 123.35 1d5a h LEU 336 Ca 0.36 -0.45 -0.31 0.00 0.84 0.00 0.00 57.88 58.31 1d5a h LEU 336 Cb -0.06 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.75 1d5a h LEU 336 CO -0.10 1.22 -1.58 0.58 -0.34 0.00 0.00 178.44 178.22 1d5a h VAL 337 N 0.45 1.10 0.00 1.05 2.07 -0.01 -3.49 116.25 117.43 1d5a h VAL 337 Ca -0.03 -2.74 0.00 0.00 0.82 0.00 0.00 66.70 64.75 1d5a h VAL 337 Cb 1.29 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 33.81 1d5a h VAL 337 CO 0.13 0.82 0.00 0.61 0.02 0.00 0.00 177.57 179.15 1d5a n GLY 338 N 1.70 1.41 3.12 2.17 0.00 0.22 -4.34 105.19 109.47 1d5a n GLY 338 Ca -0.18 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 1d5a n GLY 338 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1d5a s GLN 339 N -1.31 0.70 0.69 1.61 -1.52 -1.16 -4.70 119.66 113.96 1d5a s GLN 339 Ca 0.00 -1.28 -0.17 0.00 -1.95 0.00 0.00 55.36 51.97 1d5a s GLN 339 Cb 0.00 0.12 -0.01 0.00 -0.22 0.00 0.00 33.01 32.89 1d5a s GLN 339 CO 0.00 -0.11 0.93 -1.13 -0.25 0.00 0.00 175.29 174.73 1d5a n SER 340 N 0.05 0.42 0.26 5.90 3.41 -1.26 -4.62 113.62 117.79 1d5a n SER 340 Ca -0.13 0.70 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 1d5a n SER 340 Cb 0.61 -1.39 0.71 0.00 -0.26 0.00 0.00 64.21 63.88 1d5a n SER 340 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1d5a h LEU 341 N -0.05 0.00 -0.14 1.04 6.46 -1.91 -1.76 115.31 118.95 1d5a h LEU 341 Ca -0.48 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.27 1d5a h LEU 341 Cb 1.35 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.27 1d5a h LEU 341 CO 0.48 0.12 0.03 -0.25 -0.62 0.00 0.00 178.44 178.20 1d5a h TRP 342 N 0.00 0.24 -0.22 1.25 7.01 -1.90 -1.03 115.95 121.31 1d5a h TRP 342 Ca -0.00 -0.03 -0.18 0.00 2.11 0.00 0.00 58.89 60.79 1d5a h TRP 342 Cb 0.39 -0.07 0.00 0.00 -2.10 0.00 0.00 29.16 27.39 1d5a h TRP 342 CO 0.00 0.38 -0.58 -0.44 -2.79 0.00 0.00 178.44 175.01 1d5a h ASP 343 N 0.03 0.89 -0.01 2.65 3.32 -1.82 -3.28 116.42 118.20 1d5a h ASP 343 Ca 0.05 -0.57 -0.12 0.00 0.02 0.00 0.00 57.03 56.40 1d5a h ASP 343 Cb 0.26 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1d5a h ASP 343 CO 0.00 1.30 -0.38 0.58 -1.72 0.00 0.00 179.24 179.03 1d5a h VAL 344 N 0.51 1.30 0.00 -1.35 2.07 -1.32 -2.80 116.25 114.66 1d5a h VAL 344 Ca -0.01 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 65.99 1d5a h VAL 344 Cb 1.20 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1d5a h VAL 344 CO 0.13 0.48 0.00 -1.54 0.02 0.00 0.00 177.57 176.65 1d5a n SER 345 N -4.04 0.22 -0.36 0.57 3.41 -0.39 -2.50 113.62 110.52 1d5a n SER 345 Ca -0.01 0.54 0.08 0.00 -0.26 0.00 0.00 58.87 59.21 1d5a n SER 345 Cb 0.49 -0.59 0.17 0.00 -0.26 0.00 0.00 64.21 64.03 1d5a n SER 345 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1d5a n ARG 346 N -1.72 1.43 -4.21 4.33 1.74 -1.15 -4.03 116.66 113.05 1d5a n ARG 346 Ca 0.05 -2.95 -0.28 0.00 -0.77 0.00 0.00 57.85 53.90 1d5a n ARG 346 Cb 0.27 -1.55 -0.09 0.00 -1.02 0.00 0.00 32.46 30.08 1d5a n ARG 346 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1d5a s SER 347 N -3.05 4.64 0.67 0.55 0.15 -1.04 -5.04 113.70 110.58 1d5a s SER 347 Ca 0.35 -0.37 -0.08 0.00 0.70 0.00 0.00 55.95 56.55 1d5a s SER 347 Cb 0.33 -0.96 0.03 0.00 -1.71 0.00 0.00 66.02 63.71 1d5a s SER 347 CO -0.02 0.14 1.00 -0.94 1.20 0.00 0.00 173.24 174.62 1d5a s SER 348 N -2.57 5.21 0.10 5.45 1.04 -1.26 -4.92 113.70 116.75 1d5a s SER 348 Ca 0.25 0.72 -0.20 0.00 0.48 0.00 0.00 55.95 57.21 1d5a s SER 348 Cb -0.10 -1.52 -0.07 0.00 0.10 0.00 0.00 66.02 64.42 1d5a s SER 348 CO 0.17 -1.37 1.68 0.71 0.98 0.00 0.00 173.24 175.41 1d5a h THR 349 N -0.49 1.13 -0.74 2.02 1.35 -1.99 -1.68 112.91 112.52 1d5a h THR 349 Ca -0.45 -0.37 0.12 0.00 -0.55 0.00 0.00 66.41 65.16 1d5a h THR 349 Cb 1.28 0.98 -0.09 0.00 -1.73 0.00 0.00 68.15 68.60 1d5a h THR 349 CO 0.62 0.13 0.32 1.23 -0.25 0.00 0.00 175.52 177.57 1d5a h GLY 350 N 0.22 1.12 2.00 5.82 0.00 -1.94 0.44 103.07 110.73 1d5a h GLY 350 Ca 0.07 -0.18 -0.09 0.00 0.00 0.00 0.00 47.33 47.14 1d5a h GLY 350 CO -0.01 -0.04 -0.41 3.43 0.00 0.00 0.00 176.54 179.50 1d5a h ASN 351 N 0.50 0.00 -0.34 0.19 2.35 -1.88 -2.23 115.58 114.17 1d5a h ASN 351 Ca 0.39 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 56.09 1d5a h ASN 351 Cb 0.53 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.89 1d5a h ASN 351 CO -0.35 0.41 0.03 -0.07 -1.65 0.00 0.00 177.43 175.80 1d5a h LEU 352 N 0.00 0.57 -0.82 1.61 3.38 -0.02 -1.83 115.31 118.20 1d5a h LEU 352 Ca -0.00 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1d5a h LEU 352 Cb 0.87 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1d5a h LEU 352 CO 0.05 0.72 0.45 0.58 0.09 0.00 0.00 178.44 180.33 1d5a h VAL 353 N 0.41 1.24 -0.50 1.22 2.07 -0.99 -2.12 116.25 117.57 1d5a h VAL 353 Ca 0.10 -0.61 -0.09 0.00 0.82 0.00 0.00 66.70 66.92 1d5a h VAL 353 Cb 0.41 0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1d5a h VAL 353 CO 0.01 0.27 -0.07 -0.08 0.02 0.00 0.00 177.57 177.73 1d5a h GLU 354 N 1.14 0.88 -0.46 1.57 4.81 -1.14 0.06 114.58 121.45 1d5a h GLU 354 Ca 0.29 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1d5a h GLU 354 Cb 0.03 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1d5a h GLU 354 CO -0.05 0.92 0.00 -1.49 -0.73 0.00 0.00 179.01 177.67 1d5a h TRP 355 N 0.80 0.80 0.01 0.92 -0.00 -1.15 -1.07 115.95 116.26 1d5a h TRP 355 Ca 0.14 -0.11 -0.00 0.00 -0.00 0.00 0.00 58.89 58.92 1d5a h TRP 355 Cb 0.58 -0.22 0.00 0.00 -0.00 0.00 0.00 29.16 29.51 1d5a h TRP 355 CO 0.03 0.74 -0.00 0.35 -0.00 0.00 0.00 178.44 179.56 1d5a h PHE 356 N 0.71 -0.01 -0.74 0.49 3.57 -0.70 -2.89 116.94 117.38 1d5a h PHE 356 Ca 0.14 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1d5a h PHE 356 Cb 0.43 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 1d5a h PHE 356 CO 0.02 0.24 0.46 -0.07 -2.23 0.00 0.00 178.31 176.73 1d5a h LEU 357 N -0.25 0.87 -0.69 0.59 3.38 -0.81 -1.80 115.31 116.60 1d5a h LEU 357 Ca -0.00 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 57.96 1d5a h LEU 357 Cb 0.25 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1d5a h LEU 357 CO 0.00 0.66 0.41 -0.07 0.09 0.00 0.00 178.44 179.53 1d5a h LEU 358 N 1.00 0.66 -0.65 1.67 3.38 -1.20 0.69 115.31 120.85 1d5a h LEU 358 Ca 0.27 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 1d5a h LEU 358 Cb -0.07 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1d5a h LEU 358 CO -0.05 0.44 -0.11 -0.09 0.09 0.00 0.00 178.44 178.72 1d5a h ARG 359 N 0.79 0.94 -0.21 1.13 2.43 -1.36 -1.80 114.38 116.30 1d5a h ARG 359 Ca 0.29 -0.33 -0.20 0.00 -0.81 0.00 0.00 59.98 58.92 1d5a h ARG 359 Cb 0.08 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1d5a h ARG 359 CO -0.14 0.99 -0.66 -0.22 -1.51 0.00 0.00 179.97 178.44 1d5a h LYS 360 N 0.84 0.79 -0.87 0.20 1.63 -0.59 -2.56 116.57 116.01 1d5a h LYS 360 Ca 0.13 -0.57 0.01 0.00 -0.85 0.00 0.00 60.65 59.38 1d5a h LYS 360 Cb 0.65 0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 32.33 1d5a h LYS 360 CO 0.04 1.19 0.57 0.00 -3.45 0.00 0.00 179.45 177.81 1d5a h ALA 361 N 0.67 1.39 -0.48 5.00 0.00 0.53 -0.65 119.26 125.72 1d5a h ALA 361 Ca -0.02 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1d5a h ALA 361 Cb 1.27 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1d5a h ALA 361 CO 0.14 0.56 -0.03 -0.92 0.00 0.00 0.00 179.25 179.00 1d5a h TYR 362 N 1.16 0.95 -0.03 0.00 3.20 -1.24 0.36 116.97 121.36 1d5a h TYR 362 Ca 0.32 -0.18 -0.06 0.00 3.14 0.00 0.00 58.73 61.95 1d5a h TYR 362 Cb -0.12 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 37.90 1d5a h TYR 362 CO -0.00 0.91 -0.28 0.93 -1.64 0.00 0.00 178.16 178.08 1d5a h GLU 363 N 0.72 0.06 -0.58 1.82 5.08 -0.93 -2.93 114.58 117.81 1d5a h GLU 363 Ca 0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1d5a h GLU 363 Cb 0.55 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1d5a h GLU 363 CO 0.03 0.33 0.00 0.54 -1.00 0.00 0.00 179.01 178.92 1d5a n ARG 364 N -4.19 2.71 -2.98 2.33 1.74 -0.33 -4.97 116.66 110.98 1d5a n ARG 364 Ca -0.02 -2.43 -0.22 0.00 -0.77 0.00 0.00 57.85 54.41 1d5a n ARG 364 Cb 0.34 -1.47 0.03 0.00 -1.02 0.00 0.00 32.46 30.34 1d5a n ARG 364 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1d5a n ASN 365 N 1.29 -6.02 -4.68 0.55 4.05 -0.09 -4.94 115.26 105.43 1d5a n ASN 365 Ca 0.20 -0.27 -0.36 0.00 0.45 0.00 0.00 54.58 54.60 1d5a n ASN 365 Cb 0.56 -4.84 -0.09 0.00 1.23 0.00 0.00 39.78 36.64 1d5a n ASN 365 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 1d5a s ASP 366 N -2.70 6.16 0.12 1.20 1.01 0.11 -2.79 116.67 119.78 1d5a s ASP 366 Ca 0.29 0.17 -0.30 0.00 0.71 0.00 0.00 52.55 53.41 1d5a s ASP 366 Cb -0.13 -2.11 -0.07 0.00 1.01 0.00 0.00 42.92 41.62 1d5a s ASP 366 CO 0.35 0.08 1.23 0.54 0.21 0.00 0.00 175.17 177.58 1d5a s VAL 367 N 0.94 3.71 0.20 -1.27 0.11 0.30 -4.37 120.40 120.03 1d5a s VAL 367 Ca 0.09 1.31 -0.30 0.00 -2.93 0.00 0.00 61.98 60.15 1d5a s VAL 367 Cb -0.13 -3.84 -0.08 0.00 -1.53 0.00 0.00 36.38 30.80 1d5a s VAL 367 CO 0.04 0.15 1.00 0.00 -3.33 0.00 0.00 175.10 172.95 1d5a s ALA 368 N 0.61 3.33 0.99 1.54 0.00 -1.26 -4.69 121.76 122.28 1d5a s ALA 368 Ca 0.57 0.69 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 1d5a s ALA 368 Cb -0.32 -3.27 0.18 0.00 0.00 0.00 0.00 23.12 19.71 1d5a s ALA 368 CO 0.32 0.01 1.11 -1.25 0.00 0.00 0.00 175.76 175.95 1d5a s PRO 369 N -0.78 0.49 0.37 0.00 0.04 -1.26 -4.44 135.00 129.42 1d5a s PRO 369 Ca 0.45 0.40 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1d5a s PRO 369 Cb -0.27 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 1d5a s PRO 369 CO 0.34 -2.66 0.58 -0.80 0.04 0.00 0.00 177.00 174.49 1d5a s ASN 370 N -3.65 6.23 0.67 6.66 0.01 -1.26 -4.84 114.94 118.76 1d5a s ASN 370 Ca 0.65 0.45 -0.12 0.00 -0.71 0.00 0.00 52.86 53.14 1d5a s ASN 370 Cb -0.17 -1.97 -0.01 0.00 0.41 0.00 0.00 41.25 39.51 1d5a s ASN 370 CO 0.56 -0.37 1.05 -0.54 -1.51 0.00 0.00 177.10 176.30 1d5a s LYS 371 N -4.37 3.08 0.56 -0.60 1.02 -1.26 -4.54 119.74 113.62 1d5a s LYS 371 Ca 0.42 0.98 -0.17 0.00 0.02 0.00 0.00 55.97 57.21 1d5a s LYS 371 Cb -0.10 -2.01 -0.05 0.00 -0.52 0.00 0.00 37.83 35.15 1d5a s LYS 371 CO 0.37 -0.99 1.06 -2.14 -0.92 0.00 0.00 175.35 172.73 1d5a s PRO 372 N -4.88 3.45 0.28 -1.68 0.02 -1.26 -5.05 135.00 125.88 1d5a s PRO 372 Ca 0.59 1.29 0.05 0.00 0.02 0.00 0.00 61.00 62.95 1d5a s PRO 372 Cb -0.14 -2.05 -0.02 0.00 0.02 0.00 0.00 34.50 32.31 1d5a s PRO 372 CO 0.51 -0.71 0.41 0.16 -0.33 0.00 0.00 177.00 177.04 1d5a s ASP 373 N -2.45 6.20 0.46 2.53 1.47 -1.26 -4.76 116.67 118.86 1d5a s ASP 373 Ca 0.66 0.01 0.33 0.00 1.18 0.00 0.00 52.55 54.73 1d5a s ASP 373 Cb -0.17 -1.66 1.48 0.00 -0.34 0.00 0.00 42.92 42.23 1d5a s ASP 373 CO 0.31 -0.21 1.61 -0.33 0.68 0.00 0.00 175.17 177.24 1d5a h GLU 374 N 1.05 0.06 0.00 2.11 5.08 -1.97 0.61 114.58 121.51 1d5a h GLU 374 Ca -0.50 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1d5a h GLU 374 Cb 1.24 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1d5a h GLU 374 CO 0.58 0.04 0.00 -2.13 -1.00 0.00 0.00 179.01 176.50 1d5a n ARG 375 N -4.60 0.00 -0.30 2.33 0.00 -1.26 -1.36 116.66 111.47 1d5a n ARG 375 Ca 0.38 0.27 0.07 0.00 -0.00 0.00 0.00 57.85 58.58 1d5a n ARG 375 Cb 1.53 -1.17 0.23 0.00 0.00 0.00 0.00 32.46 33.04 1d5a n ARG 375 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1d5a h GLU 376 N 0.00 0.62 -0.98 -0.14 4.39 -1.72 0.25 114.58 117.00 1d5a h GLU 376 Ca 0.00 -0.04 0.11 0.00 0.34 0.00 0.00 59.36 59.77 1d5a h GLU 376 Cb 0.00 -0.14 -0.08 0.00 -0.10 0.00 0.00 28.75 28.43 1d5a h GLU 376 CO 0.00 0.41 0.62 1.25 -1.16 0.00 0.00 179.01 180.14 1d5a h LEU 377 N 0.64 0.92 -0.18 1.33 5.85 0.12 -1.70 115.31 122.28 1d5a h LEU 377 Ca 0.47 0.04 0.04 0.00 0.84 0.00 0.00 57.88 59.26 1d5a h LEU 377 Cb 0.67 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1d5a h LEU 377 CO -0.36 0.52 -0.05 0.00 -0.34 0.00 0.00 178.44 178.21 1d5a h ALA 378 N 1.53 0.12 -0.06 1.25 0.00 0.76 -1.07 119.26 121.79 1d5a h ALA 378 Ca 0.47 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.46 1d5a h ALA 378 Cb 0.42 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1d5a h ALA 378 CO -0.23 -0.48 0.01 -0.09 0.00 0.00 0.00 179.25 178.46 1d5a h ARG 379 N -0.00 0.03 0.00 0.00 2.43 -1.09 -3.02 114.38 112.72 1d5a h ARG 379 Ca 0.09 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1d5a h ARG 379 Cb 0.14 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1d5a h ARG 379 CO -0.19 0.02 -0.13 0.00 -1.51 0.00 0.00 179.97 178.16 1d5a h ARG 380 N 0.03 0.00 0.00 0.20 3.08 -1.02 -3.11 114.38 113.56 1d5a h ARG 380 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1d5a h ARG 380 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1d5a h ARG 380 CO -0.04 0.13 0.00 2.41 -1.07 0.00 0.00 179.97 181.40 1d5a n THR 381 N -3.65 0.00 -2.70 2.04 -1.04 -0.44 -3.31 114.28 105.19 1d5a n THR 381 Ca -0.02 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.91 1d5a n THR 381 Cb 0.25 -0.24 0.09 0.00 -1.82 0.00 0.00 70.33 68.61 1d5a n THR 381 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1d5a n GLU 382 N -0.62 1.17 -2.45 -2.82 1.02 -1.17 -5.10 120.64 110.67 1d5a n GLU 382 Ca 0.04 -2.27 -0.41 0.00 -0.02 0.00 0.00 57.16 54.50 1d5a n GLU 382 Cb 0.02 -0.47 -0.04 0.00 -0.02 0.00 0.00 31.44 30.93 1d5a n GLU 382 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1d5a s SER 383 N -1.79 7.22 0.02 1.62 0.15 -1.21 -4.92 113.70 114.80 1d5a s SER 383 Ca 0.24 2.25 -0.30 0.00 0.70 0.00 0.00 55.95 58.84 1d5a s SER 383 Cb 0.41 -2.62 -0.08 0.00 -1.71 0.00 0.00 66.02 62.02 1d5a s SER 383 CO -0.05 -0.21 1.90 -0.31 1.20 0.00 0.00 173.24 175.78 1d5a s TYR 384 N -0.82 1.44 -0.17 3.44 1.51 -1.26 -4.98 117.35 116.51 1d5a s TYR 384 Ca 0.47 -0.32 -0.05 0.00 -1.01 0.00 0.00 57.07 56.16 1d5a s TYR 384 Cb -0.32 -4.18 -0.03 0.00 -0.11 0.00 0.00 41.96 37.32 1d5a s TYR 384 CO 0.40 -5.23 -0.01 0.00 -1.11 0.00 0.00 175.55 169.60 1d5a s ALA 385 N 4.33 3.08 -0.02 3.71 0.00 -1.26 -5.10 121.76 126.51 1d5a s ALA 385 Ca 0.85 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.00 1d5a s ALA 385 Cb -0.41 -1.67 -0.00 0.00 0.00 0.00 0.00 23.12 21.04 1d5a s ALA 385 CO 0.39 0.13 -0.09 0.20 0.00 0.00 0.00 175.76 176.38 1d5a s GLY 386 N 0.50 0.50 -0.27 0.00 0.00 -1.26 -5.11 107.32 101.68 1d5a s GLY 386 Ca -0.02 -0.38 -0.02 0.00 0.00 0.00 0.00 44.72 44.31 1d5a s GLY 386 CO 0.02 -0.22 0.50 -0.32 0.00 0.00 0.00 173.10 173.08 1d5a s GLY 387 N -0.02 -0.73 -0.38 0.20 0.00 -1.26 -5.11 107.32 100.01 1d5a s GLY 387 Ca 0.00 1.40 -0.00 0.00 0.00 0.00 0.00 44.72 46.12 1d5a s GLY 387 CO 0.00 3.06 0.15 -0.47 0.00 0.00 0.00 173.10 175.83 1d5a s TYR 388 N 2.71 3.65 -0.32 1.90 5.04 -1.26 -5.02 117.35 124.06 1d5a s TYR 388 Ca 0.17 -2.63 -0.12 0.00 -2.44 0.00 0.00 57.07 52.05 1d5a s TYR 388 Cb -0.15 -3.11 -0.03 0.00 0.35 0.00 0.00 41.96 39.02 1d5a s TYR 388 CO -0.19 -0.96 0.21 0.08 -1.34 0.00 0.00 175.55 173.35 1d5a s VAL 389 N 1.05 5.20 0.65 3.14 1.01 -1.26 -5.05 120.40 125.14 1d5a s VAL 389 Ca 0.09 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.79 1d5a s VAL 389 Cb -0.21 -3.61 -0.00 0.00 0.00 0.00 0.00 36.38 32.56 1d5a s VAL 389 CO -0.06 0.08 1.13 -0.54 0.00 0.00 0.00 175.10 175.72 1d5a s LYS 390 N 1.72 2.77 0.47 2.72 1.02 -1.26 -4.83 119.74 122.35 1d5a s LYS 390 Ca 0.06 1.50 -0.22 0.00 0.02 0.00 0.00 55.97 57.33 1d5a s LYS 390 Cb -0.17 -1.94 -0.07 0.00 -0.52 0.00 0.00 37.83 35.13 1d5a s LYS 390 CO 0.10 -1.30 1.12 -1.21 -0.92 0.00 0.00 175.35 173.15 1d5a s GLU 391 N -3.92 3.73 1.05 1.68 2.02 -1.26 -4.82 118.70 117.18 1d5a s GLU 391 Ca 0.69 1.64 -0.13 0.00 0.02 0.00 0.00 54.97 57.20 1d5a s GLU 391 Cb -0.23 -2.29 0.22 0.00 0.10 0.00 0.00 34.13 31.93 1d5a s GLU 391 CO 0.40 -0.54 1.08 -1.25 0.02 0.00 0.00 175.26 174.97 1d5a s PRO 392 N -2.87 -0.01 0.48 0.39 0.04 -1.26 -5.01 135.00 126.76 1d5a s PRO 392 Ca 0.65 0.49 -0.22 0.00 0.04 0.00 0.00 61.00 61.96 1d5a s PRO 392 Cb -0.25 -1.69 -0.07 0.00 0.04 0.00 0.00 34.50 32.53 1d5a s PRO 392 CO 0.30 -3.02 1.18 -1.21 0.04 0.00 0.00 177.00 174.29 1d5a s GLU 393 N -4.91 3.63 0.37 4.56 0.41 -0.54 -5.02 118.70 117.20 1d5a s GLU 393 Ca 0.66 1.80 -0.01 0.00 -0.41 0.00 0.00 54.97 57.01 1d5a s GLU 393 Cb -0.19 -2.33 -0.04 0.00 -1.78 0.00 0.00 34.13 29.79 1d5a s GLU 393 CO 0.59 -0.66 0.60 0.15 -0.49 0.00 0.00 175.26 175.44 1d5a s LYS 394 N -2.80 3.51 0.04 1.61 1.02 -1.26 -4.36 119.74 117.50 1d5a s LYS 394 Ca 0.66 -0.19 0.00 0.00 0.02 0.00 0.00 55.97 56.45 1d5a s LYS 394 Cb -0.29 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 1d5a s LYS 394 CO 0.35 0.08 0.00 0.41 -0.92 0.00 0.00 175.35 175.27 1d5a n GLY 395 N -1.81 -1.80 3.54 -3.33 0.00 -1.26 -4.95 105.19 95.58 1d5a n GLY 395 Ca -0.03 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.61 1d5a n GLY 395 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1d5a s LEU 396 N 0.00 3.51 0.20 0.99 2.96 -1.26 -4.37 118.68 120.71 1d5a s LEU 396 Ca 0.00 -0.06 0.09 0.00 -0.22 0.00 0.00 54.13 53.94 1d5a s LEU 396 Cb 0.00 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1d5a s LEU 396 CO 0.00 0.12 -0.18 0.26 -1.32 0.00 0.00 176.35 175.23 1d5a s TRP 397 N 0.65 1.92 0.19 5.38 0.52 -0.77 -5.01 118.94 121.82 1d5a s TRP 397 Ca 0.01 -0.46 0.04 0.00 0.02 0.00 0.00 56.10 55.71 1d5a s TRP 397 Cb -0.14 -0.91 -0.05 0.00 -1.15 0.00 0.00 33.47 31.22 1d5a s TRP 397 CO 0.02 0.42 -0.05 -1.83 0.02 0.00 0.00 176.95 175.53 1d5a s GLU 398 N -3.13 1.21 -0.90 4.98 -1.05 -1.26 -1.54 118.70 117.00 1d5a s GLU 398 Ca 0.20 -1.57 -0.05 0.00 -0.15 0.00 0.00 54.97 53.40 1d5a s GLU 398 Cb -0.04 -0.63 -0.02 0.00 -0.44 0.00 0.00 34.13 33.00 1d5a s GLU 398 CO 0.08 -0.01 0.77 0.09 0.95 0.00 0.00 175.26 177.14 1d5a n ASN 399 N -0.31 -6.77 -4.57 0.83 3.02 -0.39 -4.89 115.26 102.18 1d5a n ASN 399 Ca -0.07 -0.50 -0.34 0.00 -0.03 0.00 0.00 54.58 53.63 1d5a n ASN 399 Cb 0.62 -4.59 -0.11 0.00 -0.61 0.00 0.00 39.78 35.09 1d5a n ASN 399 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1d5a s ILE 400 N -3.19 4.14 -0.03 2.41 1.01 -0.00 -4.57 121.20 120.98 1d5a s ILE 400 Ca 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.57 1d5a s ILE 400 Cb -0.05 -2.80 -0.04 0.00 0.01 0.00 0.00 42.46 39.59 1d5a s ILE 400 CO 0.78 0.52 0.06 -0.69 0.00 0.00 0.00 174.94 175.61 1d5a s VAL 401 N 0.00 4.63 -0.24 2.92 1.01 -0.49 0.87 120.40 129.10 1d5a s VAL 401 Ca 0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1d5a s VAL 401 Cb -0.13 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.20 1d5a s VAL 401 CO 0.02 0.42 -0.07 -0.47 0.00 0.00 0.00 175.10 175.00 1d5a s TYR 402 N -1.12 3.05 -0.25 5.22 5.04 0.16 -1.51 117.35 127.94 1d5a s TYR 402 Ca 0.20 -1.57 -0.11 0.00 -2.44 0.00 0.00 57.07 53.15 1d5a s TYR 402 Cb -0.12 -2.04 -0.05 0.00 0.35 0.00 0.00 41.96 40.10 1d5a s TYR 402 CO 0.11 -0.73 0.20 -0.51 -1.34 0.00 0.00 175.55 173.28 1d5a s LEU 403 N 1.32 4.08 -0.15 6.97 1.43 -0.60 -1.11 118.68 130.63 1d5a s LEU 403 Ca 0.00 0.11 -0.07 0.00 -1.03 0.00 0.00 54.13 53.15 1d5a s LEU 403 Cb -0.16 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 43.85 1d5a s LEU 403 CO -0.05 -0.01 0.09 -0.62 0.23 0.00 0.00 176.35 175.99 1d5a s ASP 404 N 1.35 5.93 0.13 2.29 2.15 -0.06 -2.11 116.67 126.35 1d5a s ASP 404 Ca 0.09 0.26 -0.30 0.00 0.43 0.00 0.00 52.55 53.02 1d5a s ASP 404 Cb -0.15 -1.94 -0.06 0.00 -0.30 0.00 0.00 42.92 40.47 1d5a s ASP 404 CO 0.07 0.29 1.01 -0.31 -0.17 0.00 0.00 175.17 176.07 1d5a s TYR 405 N -0.35 3.73 -0.27 -5.34 4.12 -0.92 -0.85 117.35 117.46 1d5a s TYR 405 Ca 0.10 1.72 -0.05 0.00 0.02 0.00 0.00 57.07 58.85 1d5a s TYR 405 Cb -0.12 -3.14 0.01 0.00 -1.52 0.00 0.00 41.96 37.19 1d5a s TYR 405 CO 0.01 -0.11 0.03 0.15 0.02 0.00 0.00 175.55 175.66 1d5a s LYS 406 N -0.05 3.09 -1.26 -0.62 -0.14 0.04 -4.69 119.74 116.11 1d5a s LYS 406 Ca 0.48 -0.84 -0.02 0.00 -1.36 0.00 0.00 55.97 54.23 1d5a s LYS 406 Cb -0.25 -3.24 -0.01 0.00 -1.68 0.00 0.00 37.83 32.65 1d5a s LYS 406 CO 0.31 -0.39 0.75 0.43 -0.76 0.00 0.00 175.35 175.69 1d5a n SER 407 N 4.81 -2.02 0.35 2.83 7.64 -1.26 -3.14 113.62 122.83 1d5a n SER 407 Ca -0.15 -0.81 -0.14 0.00 1.01 0.00 0.00 58.87 58.77 1d5a n SER 407 Cb 0.48 -4.17 -0.07 0.00 -1.01 0.00 0.00 64.21 59.45 1d5a n SER 407 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1d5a h LEU 408 N -1.81 -0.76 -0.15 -3.43 5.85 -1.94 -2.55 115.31 110.53 1d5a h LEU 408 Ca -0.61 0.03 -0.16 0.00 0.84 0.00 0.00 57.88 57.97 1d5a h LEU 408 Cb 1.35 0.20 0.01 0.00 0.37 0.00 0.00 40.66 42.59 1d5a h LEU 408 CO 0.54 -0.49 -0.55 1.88 -0.34 0.00 0.00 178.44 179.49 1d5a h TYR 409 N -1.02 0.83 -0.45 1.25 0.05 -1.95 -2.68 116.97 113.00 1d5a h TYR 409 Ca -0.09 -0.35 0.06 0.00 0.05 0.00 0.00 58.73 58.40 1d5a h TYR 409 Cb 0.69 -0.14 -0.05 0.00 1.01 0.00 0.00 36.73 38.24 1d5a h TYR 409 CO 0.04 1.14 0.14 -1.35 -1.05 0.00 0.00 178.16 177.08 1d5a h PRO 410 N 0.29 0.29 0.00 4.88 0.11 -1.87 -1.61 132.00 134.08 1d5a h PRO 410 Ca -0.03 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.00 1d5a h PRO 410 Cb 1.18 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1d5a h PRO 410 CO 0.11 0.20 -0.33 0.66 -0.21 0.00 0.00 178.00 178.43 1d5a h SER 411 N 0.30 0.00 0.00 -2.05 4.64 -1.46 -2.24 113.55 112.74 1d5a h SER 411 Ca 0.22 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.38 1d5a h SER 411 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 1d5a h SER 411 CO -0.24 0.33 -0.53 0.40 -0.87 0.00 0.00 176.83 175.92 1d5a h ILE 412 N 0.00 1.32 -0.59 0.95 2.04 -1.09 -0.49 117.51 119.65 1d5a h ILE 412 Ca -0.00 -1.76 -0.07 0.00 1.00 0.00 0.00 64.86 64.03 1d5a h ILE 412 Cb 0.62 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 1d5a h ILE 412 CO 0.04 0.55 0.09 0.40 0.00 0.00 0.00 178.15 179.23 1d5a h ILE 413 N 0.45 1.25 0.07 -0.67 2.04 -0.75 -1.72 117.51 118.17 1d5a h ILE 413 Ca 0.01 -0.98 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 1d5a h ILE 413 Cb 1.07 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1d5a h ILE 413 CO 0.10 0.36 -0.03 0.40 0.00 0.00 0.00 178.15 178.98 1d5a h ILE 414 N 0.90 1.21 -0.83 -0.67 2.04 -1.33 -1.90 117.51 116.93 1d5a h ILE 414 Ca 0.18 -1.48 0.05 0.00 1.00 0.00 0.00 64.86 64.61 1d5a h ILE 414 Cb 0.40 2.10 -0.05 0.00 -0.74 0.00 0.00 36.82 38.53 1d5a h ILE 414 CO 0.01 0.34 0.52 0.74 0.00 0.00 0.00 178.15 179.76 1d5a h THR 415 N -0.82 1.08 -0.59 -0.27 2.02 -1.10 -2.49 112.91 110.74 1d5a h THR 415 Ca -0.01 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1d5a h THR 415 Cb 0.62 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1d5a h THR 415 CO 0.01 0.18 0.00 1.41 0.37 0.00 0.00 175.52 177.50 1d5a n HIS 416 N -4.60 1.88 -4.38 3.16 8.25 -0.65 -4.95 115.22 113.93 1d5a n HIS 416 Ca 0.11 -0.70 -0.40 0.00 -0.26 0.00 0.00 57.72 56.47 1d5a n HIS 416 Cb 0.13 -0.43 -0.05 0.00 1.12 0.00 0.00 29.99 30.76 1d5a n HIS 416 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1d5a n ASN 417 N 0.72 -2.57 -4.62 0.41 5.15 -0.94 -4.84 115.26 108.57 1d5a n ASN 417 Ca 0.27 -1.12 -0.43 0.00 -0.60 0.00 0.00 54.58 52.70 1d5a n ASN 417 Cb 1.10 -2.16 -0.03 0.00 -0.53 0.00 0.00 39.78 38.17 1d5a n ASN 417 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1d5a s VAL 418 N -3.25 3.61 0.19 3.44 1.01 -0.75 -4.73 120.40 119.93 1d5a s VAL 418 Ca 0.79 0.67 -0.22 0.00 0.00 0.00 0.00 61.98 63.22 1d5a s VAL 418 Cb -0.45 -3.67 0.06 0.00 0.00 0.00 0.00 36.38 32.31 1d5a s VAL 418 CO 0.97 -0.33 0.63 -0.55 0.00 0.00 0.00 175.10 175.82 1d5a s SER 419 N 4.81 -0.48 0.30 3.32 0.15 -1.26 -4.50 113.70 116.04 1d5a s SER 419 Ca 0.74 -0.18 0.05 0.00 0.70 0.00 0.00 55.95 57.26 1d5a s SER 419 Cb -0.25 0.63 0.48 0.00 -1.71 0.00 0.00 66.02 65.18 1d5a s SER 419 CO 0.31 -1.07 1.75 -0.65 1.20 0.00 0.00 173.24 174.78 1d5a h PRO 420 N 2.01 0.38 -0.04 5.44 0.11 -1.92 -2.64 132.00 135.34 1d5a h PRO 420 Ca -0.30 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1d5a h PRO 420 Cb 1.29 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1d5a h PRO 420 CO 0.34 0.62 0.00 -0.40 -0.21 0.00 0.00 178.00 178.35 1d5a n ASP 421 N -4.12 0.36 0.00 -2.05 5.75 -1.26 -3.30 116.55 111.93 1d5a n ASP 421 Ca -0.01 -1.59 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 1d5a n ASP 421 Cb 0.40 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.46 1d5a n ASP 421 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1d5a n THR 422 N -0.50 0.11 -0.19 2.12 -2.24 -1.06 -4.80 114.28 107.73 1d5a n THR 422 Ca 0.12 -0.32 -0.08 0.00 -2.27 0.00 0.00 64.05 61.50 1d5a n THR 422 Cb 0.11 1.32 -0.07 0.00 -2.10 0.00 0.00 70.33 69.59 1d5a n THR 422 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1d5a h LEU 423 N 0.00 -1.33 -5.51 3.22 5.85 -1.47 -0.69 115.31 115.37 1d5a h LEU 423 Ca 0.00 0.19 -0.36 0.00 0.84 0.00 0.00 57.88 58.56 1d5a h LEU 423 Cb 0.34 0.57 -0.25 0.00 0.37 0.00 0.00 40.66 41.69 1d5a h LEU 423 CO 0.00 -0.20 -0.73 0.59 -0.34 0.00 0.00 178.44 177.76 1d5a n ASN 424 N -4.46 -1.86 -4.72 1.25 3.02 -1.23 -3.54 115.26 103.71 1d5a n ASN 424 Ca -0.00 -2.86 -0.40 0.00 -0.03 0.00 0.00 54.58 51.29 1d5a n ASN 424 Cb 0.19 0.75 -0.05 0.00 -0.61 0.00 0.00 39.78 40.07 1d5a n ASN 424 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1d5a s ARG 425 N 0.19 4.44 -0.12 3.52 0.52 -1.26 -5.03 118.95 121.21 1d5a s ARG 425 Ca 0.32 0.88 -0.30 0.00 -0.52 0.00 0.00 55.73 56.12 1d5a s ARG 425 Cb 0.11 -3.45 -0.02 0.00 0.52 0.00 0.00 34.95 32.12 1d5a s ARG 425 CO -0.15 0.06 1.13 -1.21 0.02 0.00 0.00 175.30 175.15 1d5a s GLU 426 N 0.80 4.33 0.00 3.54 2.02 -1.26 -2.95 118.70 125.19 1d5a s GLU 426 Ca 0.38 1.53 0.00 0.00 0.02 0.00 0.00 54.97 56.90 1d5a s GLU 426 Cb -0.18 -3.61 0.00 0.00 0.10 0.00 0.00 34.13 30.45 1d5a s GLU 426 CO 0.18 -0.49 0.00 0.41 0.02 0.00 0.00 175.26 175.38 1d5a n GLY 427 N 3.32 0.86 3.75 -1.39 0.00 -1.26 -5.05 105.19 105.42 1d5a n GLY 427 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1d5a n GLY 427 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d5a n ARG 429 N 2.01 0.51 -3.72 0.00 1.74 -1.26 -4.89 116.66 111.05 1d5a n ARG 429 Ca 0.05 -0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.98 1d5a n ARG 429 Cb 0.41 -1.67 -0.15 0.00 -1.02 0.00 0.00 32.46 30.03 1d5a n ARG 429 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1d5a s GLU 430 N -3.35 0.06 0.13 5.56 2.12 -1.26 -5.07 118.70 116.89 1d5a s GLU 430 Ca -0.01 0.42 -0.15 0.00 0.36 0.00 0.00 54.97 55.59 1d5a s GLU 430 Cb 0.12 -0.23 0.03 0.00 0.26 0.00 0.00 34.13 34.32 1d5a s GLU 430 CO 0.82 -0.22 0.39 1.52 -0.54 0.00 0.00 175.26 177.24 1d5a s TYR 431 N 1.54 -0.12 -0.00 5.30 -0.85 -1.26 0.27 117.35 122.23 1d5a s TYR 431 Ca -0.05 -0.21 0.04 0.00 -0.52 0.00 0.00 57.07 56.33 1d5a s TYR 431 Cb -0.12 0.23 -0.03 0.00 0.38 0.00 0.00 41.96 42.42 1d5a s TYR 431 CO -0.06 -0.72 -0.12 -0.51 -1.52 0.00 0.00 175.55 172.62 1d5a s ASP 432 N -2.83 4.19 -0.28 -0.18 -0.00 -0.55 -4.90 116.67 112.12 1d5a s ASP 432 Ca 0.05 -0.24 -0.06 0.00 -0.00 0.00 0.00 52.55 52.30 1d5a s ASP 432 Cb 0.02 -0.87 0.01 0.00 -0.00 0.00 0.00 42.92 42.08 1d5a s ASP 432 CO -0.10 0.30 0.05 -0.69 -0.00 0.00 0.00 175.17 174.73 1d5a s VAL 433 N -0.88 3.79 0.16 -1.27 1.01 -1.26 -0.54 120.40 121.41 1d5a s VAL 433 Ca 0.14 -0.70 -0.34 0.00 0.00 0.00 0.00 61.98 61.09 1d5a s VAL 433 Cb -0.11 -2.93 -0.14 0.00 0.00 0.00 0.00 36.38 33.21 1d5a s VAL 433 CO 0.04 0.13 1.58 0.00 0.00 0.00 0.00 175.10 176.86 1d5a n ALA 434 N 4.84 1.43 -0.32 5.51 0.00 -0.53 -4.90 120.51 126.54 1d5a n ALA 434 Ca -0.15 0.44 0.23 0.00 0.00 0.00 0.00 53.44 53.96 1d5a n ALA 434 Cb 0.48 -2.36 0.42 0.00 0.00 0.00 0.00 19.45 18.00 1d5a n ALA 434 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1d5a n PRO 435 N 3.45 -0.07 0.00 0.00 -0.02 -1.26 -1.56 135.00 135.54 1d5a n PRO 435 Ca 0.17 1.39 0.00 0.00 -2.02 0.00 0.00 63.50 63.04 1d5a n PRO 435 Cb 0.29 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1d5a n PRO 435 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1d5a n GLN 436 N -5.31 2.17 0.00 -0.52 7.27 -1.26 -4.69 117.38 115.04 1d5a n GLN 436 Ca 0.30 0.00 0.10 0.00 0.07 0.00 0.00 57.00 57.47 1d5a n GLN 436 Cb 0.99 -0.81 -0.04 0.00 2.41 0.00 0.00 30.24 32.79 1d5a n GLN 436 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 1d5a n VAL 437 N -0.96 0.00 -0.31 1.69 0.24 -1.25 -5.00 118.33 112.74 1d5a n VAL 437 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1d5a n VAL 437 Cb 0.00 0.88 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 1d5a n VAL 437 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1d5a n GLY 438 N 1.49 0.63 3.62 7.63 0.00 -0.60 -4.97 105.19 112.99 1d5a n GLY 438 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1d5a n GLY 438 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1d5a n HIS 439 N -2.00 1.41 -4.04 1.61 8.25 -1.26 -4.49 115.22 114.70 1d5a n HIS 439 Ca 0.00 0.58 -0.35 0.00 -0.26 0.00 0.00 57.72 57.70 1d5a n HIS 439 Cb 0.00 -2.27 -0.11 0.00 1.12 0.00 0.00 29.99 28.73 1d5a n HIS 439 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1d5a s ARG 440 N -1.91 3.82 -0.17 -0.41 0.52 -1.23 -1.45 118.95 118.13 1d5a s ARG 440 Ca 0.61 -0.42 -0.02 0.00 -0.52 0.00 0.00 55.73 55.37 1d5a s ARG 440 Cb -0.59 -3.17 -0.02 0.00 0.52 0.00 0.00 34.95 31.70 1d5a s ARG 440 CO 0.58 0.15 -0.08 -0.06 0.02 0.00 0.00 175.30 175.91 1d5a s PHE 441 N 0.69 2.91 0.26 -0.53 0.40 0.30 -3.56 117.98 118.46 1d5a s PHE 441 Ca 0.02 -0.67 -0.29 0.00 -0.60 0.00 0.00 56.93 55.39 1d5a s PHE 441 Cb -0.14 -1.96 -0.09 0.00 0.51 0.00 0.00 43.02 41.34 1d5a s PHE 441 CO 0.02 -0.29 1.20 0.00 0.70 0.00 0.00 175.22 176.85 1d5a n LYS 443 N 1.56 1.47 0.16 0.00 5.02 0.14 -4.66 118.16 121.85 1d5a n LYS 443 Ca 0.01 -2.40 0.03 0.00 -2.02 0.00 0.00 58.31 53.94 1d5a n LYS 443 Cb 0.44 -1.41 0.14 0.00 -0.02 0.00 0.00 35.03 34.18 1d5a n LYS 443 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1d5a h ASP 444 N 0.00 0.00 -4.90 4.39 3.32 -1.93 -3.46 116.42 113.84 1d5a h ASP 444 Ca 0.00 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.90 1d5a h ASP 444 Cb 0.95 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.29 1d5a h ASP 444 CO 0.00 0.47 -0.52 0.72 -1.72 0.00 0.00 179.24 178.19 1d5a s PHE 445 N -3.19 0.06 0.04 4.55 -0.12 -1.26 -5.12 117.98 112.94 1d5a s PHE 445 Ca 0.02 -0.15 -0.31 0.00 -0.05 0.00 0.00 56.93 56.45 1d5a s PHE 445 Cb 0.09 -0.06 -0.07 0.00 -0.63 0.00 0.00 43.02 42.35 1d5a s PHE 445 CO 0.72 -0.26 1.51 -2.14 -0.05 0.00 0.00 175.22 175.00 1d5a s PRO 446 N -1.30 4.25 0.71 1.99 0.02 -1.26 -4.99 135.00 134.42 1d5a s PRO 446 Ca -0.14 2.13 -0.13 0.00 0.02 0.00 0.00 61.00 62.88 1d5a s PRO 446 Cb -0.07 -3.55 0.03 0.00 0.02 0.00 0.00 34.50 30.93 1d5a s PRO 446 CO 0.01 -0.63 1.11 0.20 -0.33 0.00 0.00 177.00 177.36 1d5a s GLY 447 N 2.01 1.97 0.08 0.52 0.00 -1.26 -4.88 107.32 105.76 1d5a s GLY 447 Ca 0.68 0.45 -0.36 0.00 0.00 0.00 0.00 44.72 45.49 1d5a s GLY 447 CO 0.29 0.80 1.56 -2.75 0.00 0.00 0.00 173.10 173.00 1d5a h PHE 448 N -0.47 -1.38 -0.06 1.90 3.57 -1.95 -1.76 116.94 116.79 1d5a h PHE 448 Ca -0.45 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 1d5a h PHE 448 Cb 1.24 0.52 -0.00 0.00 2.79 0.00 0.00 35.95 40.50 1d5a h PHE 448 CO 0.55 -0.69 0.01 0.82 -2.23 0.00 0.00 178.31 176.77 1d5a h ILE 449 N -1.07 1.23 -0.40 1.41 2.04 -1.93 -2.59 117.51 116.19 1d5a h ILE 449 Ca -0.08 -0.69 0.08 0.00 1.00 0.00 0.00 64.86 65.17 1d5a h ILE 449 Cb 0.91 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 1d5a h ILE 449 CO -0.01 0.19 0.27 -0.65 0.00 0.00 0.00 178.15 177.96 1d5a h PRO 450 N -0.15 0.19 -0.23 2.37 0.11 -1.79 -0.38 132.00 132.12 1d5a h PRO 450 Ca 0.02 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 66.00 1d5a h PRO 450 Cb 0.30 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.36 1d5a h PRO 450 CO 0.00 0.13 -0.32 1.03 -0.21 0.00 0.00 178.00 178.63 1d5a h SER 451 N 0.20 0.68 0.24 -2.05 0.87 -1.17 -1.88 113.55 110.43 1d5a h SER 451 Ca 0.18 -0.51 -0.14 0.00 -1.23 0.00 0.00 61.79 60.10 1d5a h SER 451 Cb 0.47 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 1d5a h SER 451 CO -0.03 1.06 -0.53 -0.07 -0.53 0.00 0.00 176.83 176.73 1d5a h LEU 452 N 0.32 0.35 -0.25 2.23 3.38 -0.97 -2.29 115.31 118.09 1d5a h LEU 452 Ca 0.03 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.72 1d5a h LEU 452 Cb 0.90 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1d5a h LEU 452 CO 0.07 0.82 -0.22 0.25 0.09 0.00 0.00 178.44 179.45 1d5a h LEU 453 N 0.25 0.62 -1.17 1.67 6.46 -1.08 -2.29 115.31 119.77 1d5a h LEU 453 Ca 0.01 -0.46 0.02 0.00 -0.12 0.00 0.00 57.88 57.33 1d5a h LEU 453 Cb 1.01 -0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 40.72 1d5a h LEU 453 CO 0.09 0.96 0.57 1.23 -0.62 0.00 0.00 178.44 180.66 1d5a h GLY 454 N 0.30 1.21 1.73 3.75 0.00 -1.27 -1.16 103.07 107.64 1d5a h GLY 454 Ca 0.04 -0.43 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 1d5a h GLY 454 CO 0.06 0.40 -0.38 -0.55 0.00 0.00 0.00 176.54 176.07 1d5a h ASP 455 N 1.11 0.32 -0.20 0.19 3.32 -1.27 -2.44 116.42 117.44 1d5a h ASP 455 Ca 0.33 -0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.19 1d5a h ASP 455 Cb -0.05 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1d5a h ASP 455 CO -0.09 0.67 -0.10 -0.07 -1.72 0.00 0.00 179.24 177.94 1d5a h LEU 456 N 0.26 0.44 -1.25 1.55 3.38 -0.73 -2.08 115.31 116.89 1d5a h LEU 456 Ca 0.03 -0.41 -0.07 0.00 0.09 0.00 0.00 57.88 57.51 1d5a h LEU 456 Cb 0.79 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1d5a h LEU 456 CO 0.06 0.76 -0.35 -0.07 0.09 0.00 0.00 178.44 178.93 1d5a h LEU 457 N 0.13 0.00 -0.22 1.67 3.38 -1.23 -1.08 115.31 117.95 1d5a h LEU 457 Ca 0.05 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 1d5a h LEU 457 Cb 0.59 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1d5a h LEU 457 CO 0.03 0.35 -0.89 -0.08 0.09 0.00 0.00 178.44 177.94 1d5a h GLU 458 N 0.00 0.00 -0.10 1.13 4.57 -1.39 -2.35 114.58 116.44 1d5a h GLU 458 Ca -0.00 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 58.00 1d5a h GLU 458 Cb 0.70 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 1d5a h GLU 458 CO 0.05 0.89 -0.68 1.49 -1.18 0.00 0.00 179.01 179.57 1d5a h GLU 459 N 0.00 0.43 -0.58 1.92 4.22 -1.09 -2.72 114.58 116.76 1d5a h GLU 459 Ca -0.01 -0.33 -0.06 0.00 0.08 0.00 0.00 59.36 59.04 1d5a h GLU 459 Cb 1.57 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.86 1d5a h GLU 459 CO 0.12 0.96 0.12 -0.09 -2.18 0.00 0.00 179.01 177.93 1d5a h ARG 460 N 0.31 0.95 -0.36 1.92 2.43 -1.13 -1.44 114.38 117.06 1d5a h ARG 460 Ca -0.02 -0.24 -0.03 0.00 -0.81 0.00 0.00 59.98 58.88 1d5a h ARG 460 Cb 1.24 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 1d5a h ARG 460 CO 0.12 0.89 0.10 1.96 -1.51 0.00 0.00 179.97 181.53 1d5a h GLN 461 N 0.85 0.53 -0.05 0.20 1.08 -1.36 -2.01 115.11 114.35 1d5a h GLN 461 Ca 0.18 -0.08 -0.15 0.00 -1.45 0.00 0.00 58.65 57.15 1d5a h GLN 461 Cb 0.39 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 1d5a h GLN 461 CO 0.01 0.48 -0.64 -0.22 -0.95 0.00 0.00 178.83 177.51 1d5a h LYS 462 N 0.52 0.20 -0.16 1.46 3.64 -1.13 -2.22 116.57 118.87 1d5a h LYS 462 Ca 0.12 -0.15 -0.20 0.00 -1.27 0.00 0.00 60.65 59.16 1d5a h LYS 462 Cb 0.18 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1d5a h LYS 462 CO -0.01 0.77 -0.70 0.28 -2.27 0.00 0.00 179.45 177.52 1d5a h VAL 463 N 0.14 1.30 -0.29 2.00 2.07 -0.82 -2.56 116.25 118.10 1d5a h VAL 463 Ca -0.01 -1.95 -0.11 0.00 0.82 0.00 0.00 66.70 65.45 1d5a h VAL 463 Cb 1.15 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.83 1d5a h VAL 463 CO 0.10 0.61 -0.28 0.11 0.02 0.00 0.00 177.57 178.13 1d5a h LYS 464 N 0.49 0.59 0.08 1.57 1.57 -1.34 0.16 116.57 119.69 1d5a h LYS 464 Ca -0.03 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1d5a h LYS 464 Cb 1.31 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 1d5a h LYS 464 CO 0.14 0.81 -0.07 0.87 -0.57 0.00 0.00 179.45 180.63 1d5a h LYS 465 N 0.51 -0.16 -0.74 3.15 1.79 -1.37 -2.41 116.57 117.34 1d5a h LYS 465 Ca 0.07 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1d5a h LYS 465 Cb 0.75 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.40 1d5a h LYS 465 CO 0.06 -0.11 0.44 -0.22 -1.08 0.00 0.00 179.45 178.54 1d5a h LYS 466 N -0.17 1.01 0.00 3.15 3.64 -1.12 -2.53 116.57 120.56 1d5a h LYS 466 Ca 0.00 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1d5a h LYS 466 Cb 0.16 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1d5a h LYS 466 CO -0.01 0.72 0.00 0.00 -2.27 0.00 0.00 179.45 177.89 1d5a n MET 467 N -4.50 0.23 0.05 1.90 0.00 0.01 -2.17 117.12 112.64 1d5a n MET 467 Ca 0.07 0.33 0.12 0.00 0.00 0.00 0.00 57.70 58.21 1d5a n MET 467 Cb 0.06 -1.84 0.09 0.00 0.00 0.00 0.00 33.22 31.53 1d5a n MET 467 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1d5a n LYS 468 N -2.26 0.33 -0.00 3.17 5.02 -0.92 -3.99 118.16 119.52 1d5a n LYS 468 Ca 0.04 0.05 0.10 0.00 -2.02 0.00 0.00 58.31 56.48 1d5a n LYS 468 Cb 0.32 -1.67 -0.12 0.00 -0.02 0.00 0.00 35.03 33.55 1d5a n LYS 468 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1d5a n ALA 469 N -1.88 4.58 -2.18 7.82 0.00 -0.98 -4.96 120.51 122.91 1d5a n ALA 469 Ca 0.02 -0.59 -0.31 0.00 0.00 0.00 0.00 53.44 52.56 1d5a n ALA 469 Cb 0.45 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.08 1d5a n ALA 469 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1d5a s THR 470 N -3.04 4.75 -0.05 0.00 -1.32 -0.92 -4.99 115.64 110.07 1d5a s THR 470 Ca 0.07 0.74 0.12 0.00 -1.21 0.00 0.00 61.69 61.41 1d5a s THR 470 Cb 0.16 -3.68 -0.18 0.00 -1.51 0.00 0.00 72.50 67.29 1d5a s THR 470 CO 0.87 -0.37 0.27 0.52 -2.21 0.00 0.00 174.62 173.70 1d5a n VAL 471 N -0.88 0.00 -2.18 5.08 0.31 -1.26 -4.96 118.33 114.44 1d5a n VAL 471 Ca 0.03 -0.26 -0.43 0.00 -0.01 0.00 0.00 64.34 63.66 1d5a n VAL 471 Cb 0.54 0.28 -0.02 0.00 -0.91 0.00 0.00 33.84 33.72 1d5a n VAL 471 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1d5a s ASP 472 N -3.26 6.36 0.49 4.52 -1.08 -1.26 -4.91 116.67 117.52 1d5a s ASP 472 Ca -0.04 1.40 0.18 0.00 -0.52 0.00 0.00 52.55 53.57 1d5a s ASP 472 Cb 0.08 -2.53 1.21 0.00 -1.46 0.00 0.00 42.92 40.22 1d5a s ASP 472 CO 0.48 -1.31 2.04 1.55 0.52 0.00 0.00 175.17 178.45 1d5a h PRO 473 N 10.77 0.15 0.17 4.34 0.13 -1.99 -0.14 132.00 145.43 1d5a h PRO 473 Ca -0.31 -0.01 -0.31 0.00 -0.87 0.00 0.00 66.00 64.49 1d5a h PRO 473 Cb 1.14 -0.03 0.03 0.00 0.13 0.00 0.00 31.00 32.27 1d5a h PRO 473 CO 1.02 0.10 -1.34 0.82 -0.23 0.00 0.00 178.00 178.37 1d5a h ILE 474 N 0.16 1.30 -0.10 -3.56 2.04 -2.00 -2.92 117.51 112.43 1d5a h ILE 474 Ca 0.17 -2.59 -0.02 0.00 1.00 0.00 0.00 64.86 63.43 1d5a h ILE 474 Cb 0.49 2.84 -0.00 0.00 -0.74 0.00 0.00 36.82 39.41 1d5a h ILE 474 CO -0.02 0.78 -0.00 -0.08 0.00 0.00 0.00 178.15 178.83 1d5a h GLU 475 N 0.21 0.17 -0.89 2.37 4.22 -1.87 -2.54 114.58 116.26 1d5a h GLU 475 Ca -0.21 -0.06 0.10 0.00 0.08 0.00 0.00 59.36 59.28 1d5a h GLU 475 Cb 2.02 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 31.19 1d5a h GLU 475 CO 0.25 0.44 0.57 -0.09 -2.18 0.00 0.00 179.01 178.00 1d5a h ARG 476 N -0.11 0.82 -0.18 1.92 2.43 -1.12 0.07 114.38 118.22 1d5a h ARG 476 Ca 0.03 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 58.99 1d5a h ARG 476 Cb 0.36 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1d5a h ARG 476 CO 0.01 0.54 -0.53 -0.22 -1.51 0.00 0.00 179.97 178.26 1d5a h LYS 477 N 0.85 0.51 -0.04 0.20 3.64 -1.42 -2.47 116.57 117.83 1d5a h LYS 477 Ca 0.42 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1d5a h LYS 477 Cb 0.46 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1d5a h LYS 477 CO -0.18 0.91 -0.03 1.25 -2.27 0.00 0.00 179.45 179.13 1d5a h LEU 478 N 0.40 0.10 -2.13 5.20 5.85 -0.84 -2.72 115.31 121.17 1d5a h LEU 478 Ca 0.01 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 1d5a h LEU 478 Cb 1.06 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1d5a h LEU 478 CO 0.10 0.54 -0.03 -0.07 -0.34 0.00 0.00 178.44 178.64 1d5a h LEU 479 N -0.33 0.00 -0.02 2.25 3.38 -1.05 -1.17 115.31 118.37 1d5a h LEU 479 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1d5a h LEU 479 Cb 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1d5a h LEU 479 CO 0.01 0.03 -0.03 -0.78 0.09 0.00 0.00 178.44 177.75 1d5a h ASP 480 N 0.00 0.06 -0.47 -0.43 3.58 -1.35 -2.09 116.42 115.72 1d5a h ASP 480 Ca -0.00 -0.54 0.07 0.00 0.42 0.00 0.00 57.03 56.97 1d5a h ASP 480 Cb 0.05 -0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.03 1d5a h ASP 480 CO 0.00 0.59 0.14 1.88 -2.88 0.00 0.00 179.24 178.98 1d5a h TYR 481 N -0.47 0.24 -0.93 0.28 0.99 -1.11 -1.61 116.97 114.37 1d5a h TYR 481 Ca 0.00 0.03 0.03 0.00 2.00 0.00 0.00 58.73 60.79 1d5a h TYR 481 Cb 0.58 -0.04 -0.05 0.00 1.00 0.00 0.00 36.73 38.22 1d5a h TYR 481 CO 0.11 0.06 0.61 -0.09 -0.00 0.00 0.00 178.16 178.86 1d5a h ARG 482 N 0.30 1.14 0.00 4.88 2.43 -1.19 -1.61 114.38 120.33 1d5a h ARG 482 Ca 0.23 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.23 1d5a h ARG 482 Cb 0.26 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1d5a h ARG 482 CO -0.25 0.76 -0.46 -0.56 -1.51 0.00 0.00 179.97 177.94 1d5a h GLN 483 N 1.18 0.00 0.00 0.20 -0.00 -0.66 -3.04 115.11 112.79 1d5a h GLN 483 Ca 0.37 0.00 -0.12 0.00 -0.00 0.00 0.00 58.65 58.90 1d5a h GLN 483 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 27.47 1d5a h GLN 483 CO -0.11 0.46 -0.55 0.00 -0.00 0.00 0.00 178.83 178.63 1d5a h ARG 484 N 0.00 0.00 -0.18 0.06 3.08 -0.71 -2.63 114.38 114.00 1d5a h ARG 484 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 1d5a h ARG 484 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 1d5a h ARG 484 CO 0.06 0.55 -0.59 0.00 -1.07 0.00 0.00 179.97 178.92 1d5a h ALA 485 N 1.45 0.63 -0.45 0.04 0.00 -1.24 -2.03 119.26 117.67 1d5a h ALA 485 Ca -0.01 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.26 1d5a h ALA 485 Cb 1.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1d5a h ALA 485 CO 0.07 0.70 -0.16 0.82 0.00 0.00 0.00 179.25 180.68 1d5a h ILE 486 N 0.43 1.27 -0.54 0.00 2.04 -1.46 -2.22 117.51 117.04 1d5a h ILE 486 Ca -0.00 -1.31 0.04 0.00 1.00 0.00 0.00 64.86 64.59 1d5a h ILE 486 Cb 1.15 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 38.36 1d5a h ILE 486 CO 0.11 0.45 0.29 0.50 0.00 0.00 0.00 178.15 179.50 1d5a h LYS 487 N 0.74 0.55 -0.14 2.37 3.64 -1.31 0.18 116.57 122.61 1d5a h LYS 487 Ca 0.11 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1d5a h LYS 487 Cb 0.72 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1d5a h LYS 487 CO 0.06 0.37 0.08 0.82 -2.27 0.00 0.00 179.45 178.50 1d5a h ILE 488 N 0.57 1.10 -0.22 2.00 2.04 -1.26 -1.04 117.51 120.71 1d5a h ILE 488 Ca 0.23 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1d5a h ILE 488 Cb 0.11 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1d5a h ILE 488 CO -0.14 0.09 0.05 0.25 0.00 0.00 0.00 178.15 178.40 1d5a h LEU 489 N 0.13 0.33 -1.25 1.44 5.85 -1.09 -2.96 115.31 117.75 1d5a h LEU 489 Ca 0.05 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 1d5a h LEU 489 Cb 0.08 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1d5a h LEU 489 CO -0.01 0.48 0.13 0.00 -0.34 0.00 0.00 178.44 178.70 1d5a h ALA 490 N 0.87 1.40 0.00 1.25 0.00 -0.56 -1.86 119.26 120.36 1d5a h ALA 490 Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1d5a h ALA 490 Cb 0.28 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1d5a h ALA 490 CO 0.00 0.44 0.00 0.09 0.00 0.00 0.00 179.25 179.78 1d5a n ASN 491 N -4.33 0.00 0.09 0.00 3.02 -0.40 -3.07 115.26 110.57 1d5a n ASN 491 Ca 0.03 -0.03 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1d5a n ASN 491 Cb 0.18 -0.30 -0.02 0.00 -0.61 0.00 0.00 39.78 39.04 1d5a n ASN 491 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1d5a h SER 492 N 0.00 0.00 -0.28 6.41 0.02 -1.17 -3.40 113.55 115.13 1d5a h SER 492 Ca 0.00 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 1d5a h SER 492 Cb 0.23 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.71 1d5a h SER 492 CO 0.00 0.29 -0.14 1.88 -1.14 0.00 0.00 176.83 177.72 1d5a h TYR 493 N 0.00 -0.35 -0.16 3.45 -1.99 -1.58 -1.75 116.97 114.60 1d5a h TYR 493 Ca -0.07 0.03 0.05 0.00 2.00 0.00 0.00 58.73 60.75 1d5a h TYR 493 Cb 1.28 0.20 -0.07 0.00 2.00 0.00 0.00 36.73 40.14 1d5a h TYR 493 CO 0.00 -0.21 -0.34 -0.92 -0.00 0.00 0.00 178.16 176.69 1d5a h TYR 494 N -0.11 -0.94 -0.17 4.88 3.20 -1.81 -1.32 116.97 120.70 1d5a h TYR 494 Ca 0.15 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 1d5a h TYR 494 Cb 0.33 0.44 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 1d5a h TYR 494 CO -0.34 -0.41 0.06 0.78 -1.64 0.00 0.00 178.16 176.62 1d5a h GLY 495 N -0.40 0.25 1.11 1.82 0.00 -1.77 -2.65 103.07 101.41 1d5a h GLY 495 Ca 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1d5a h GLY 495 CO -0.38 0.10 0.49 -1.82 0.00 0.00 0.00 176.54 174.93 1d5a h TYR 496 N 0.23 1.15 -0.71 5.60 3.20 -0.33 -2.22 116.97 123.90 1d5a h TYR 496 Ca 0.06 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.00 1d5a h TYR 496 Cb 0.06 -0.37 -0.05 0.00 1.54 0.00 0.00 36.73 37.91 1d5a h TYR 496 CO 0.00 0.78 0.47 1.88 -1.64 0.00 0.00 178.16 179.65 1d5a h TYR 497 N 1.19 0.66 -0.64 -3.82 0.99 -1.14 -1.71 116.97 112.51 1d5a h TYR 497 Ca 0.30 0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.05 1d5a h TYR 497 Cb -0.01 -0.22 0.00 0.00 1.00 0.00 0.00 36.73 37.50 1d5a h TYR 497 CO 0.01 0.32 0.00 0.00 -0.00 0.00 0.00 178.16 178.49 1d5a n ALA 498 N -2.47 2.40 -2.59 3.88 0.00 -0.89 -1.95 120.51 118.90 1d5a n ALA 498 Ca 0.11 -1.14 -0.43 0.00 0.00 0.00 0.00 53.44 51.99 1d5a n ALA 498 Cb 0.31 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.79 1d5a n ALA 498 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1d5a s TYR 499 N -1.15 2.83 0.41 0.00 5.04 -0.64 -4.92 117.35 118.93 1d5a s TYR 499 Ca 0.44 0.49 0.22 0.00 -2.44 0.00 0.00 57.07 55.78 1d5a s TYR 499 Cb 0.23 -4.23 1.22 0.00 0.35 0.00 0.00 41.96 39.53 1d5a s TYR 499 CO 0.30 -1.24 1.71 0.00 -1.34 0.00 0.00 175.55 174.98 1d5a h ALA 500 N 9.21 2.40 -0.38 3.97 0.00 -1.87 0.19 119.26 132.78 1d5a h ALA 500 Ca -0.24 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1d5a h ALA 500 Cb 1.07 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1d5a h ALA 500 CO 1.09 -0.91 0.00 -1.71 0.00 0.00 0.00 179.25 177.72 1d5a n ASN 501 N -4.68 2.25 -4.75 0.00 4.05 -1.26 -4.71 115.26 106.16 1d5a n ASN 501 Ca 0.30 -1.95 -0.40 0.00 0.45 0.00 0.00 54.58 52.98 1d5a n ASN 501 Cb 1.09 -0.25 -0.05 0.00 1.23 0.00 0.00 39.78 41.80 1d5a n ASN 501 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1d5a s ALA 502 N -1.50 3.38 0.05 5.20 0.00 0.68 -4.61 121.76 124.96 1d5a s ALA 502 Ca 0.30 0.79 -0.19 0.00 0.00 0.00 0.00 51.96 52.86 1d5a s ALA 502 Cb 0.16 -3.30 -0.14 0.00 0.00 0.00 0.00 23.12 19.84 1d5a s ALA 502 CO 0.21 -0.06 1.33 0.00 0.00 0.00 0.00 175.76 177.24 1d5a h ARG 503 N 4.23 0.44 -1.45 0.00 3.08 -1.88 -3.09 114.38 115.72 1d5a h ARG 503 Ca -0.46 -0.26 -0.42 0.00 0.07 0.00 0.00 59.98 58.92 1d5a h ARG 503 Cb 1.21 0.02 -0.18 0.00 0.08 0.00 0.00 29.97 31.10 1d5a h ARG 503 CO 0.68 0.84 0.53 0.91 -1.07 0.00 0.00 179.97 181.86 1d5a n TRP 504 N -4.45 1.94 -1.70 3.04 8.01 -1.26 -4.64 117.44 118.37 1d5a n TRP 504 Ca -0.06 -2.21 -0.39 0.00 -1.31 0.00 0.00 57.50 53.53 1d5a n TRP 504 Cb 0.42 -1.10 0.04 0.00 -2.01 0.00 0.00 31.31 28.66 1d5a n TRP 504 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.69 177.66 1d5a n TYR 505 N 0.10 1.84 -3.03 -5.99 9.36 -1.17 -4.78 117.16 113.48 1d5a n TYR 505 Ca 0.39 0.45 0.01 0.00 3.32 0.00 0.00 57.90 62.07 1d5a n TYR 505 Cb 0.59 -2.30 -0.00 0.00 -0.63 0.00 0.00 39.34 37.00 1d5a n TYR 505 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1d5a h ARG 507 N 6.34 0.36 -0.62 0.00 2.43 -1.95 -2.10 114.38 118.83 1d5a h ARG 507 Ca 0.02 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 1d5a h ARG 507 Cb 1.20 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.65 1d5a h ARG 507 CO 0.03 0.36 0.18 0.93 -1.51 0.00 0.00 179.97 179.97 1d5a h GLU 508 N 0.36 0.94 -0.16 0.20 3.07 -1.95 -1.39 114.58 115.66 1d5a h GLU 508 Ca 0.09 -0.19 -0.02 0.00 -0.50 0.00 0.00 59.36 58.73 1d5a h GLU 508 Cb 0.18 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1d5a h GLU 508 CO -0.00 0.82 0.00 0.00 -1.40 0.00 0.00 179.01 178.43 1d5a h ALA 510 N 0.77 1.07 -0.33 0.00 0.00 -1.22 -0.62 119.26 118.93 1d5a h ALA 510 Ca 0.04 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1d5a h ALA 510 Cb 0.37 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1d5a h ALA 510 CO 0.01 0.46 -0.25 1.49 0.00 0.00 0.00 179.25 180.96 1d5a h GLU 511 N 1.13 0.66 -0.15 0.00 4.81 -1.24 -2.17 114.58 117.62 1d5a h GLU 511 Ca 0.31 -0.27 -0.19 0.00 -0.13 0.00 0.00 59.36 59.08 1d5a h GLU 511 Cb -0.12 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.23 1d5a h GLU 511 CO -0.07 0.85 -0.68 0.77 -0.73 0.00 0.00 179.01 179.14 1d5a h SER 512 N 0.57 0.71 -0.64 1.04 0.02 -0.58 -2.59 113.55 112.07 1d5a h SER 512 Ca 0.08 -0.43 -0.07 0.00 -0.84 0.00 0.00 61.79 60.53 1d5a h SER 512 Cb 0.73 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.04 1d5a h SER 512 CO 0.06 1.19 0.13 0.58 -1.14 0.00 0.00 176.83 177.65 1d5a h VAL 513 N 0.43 1.26 -0.64 2.27 2.07 -0.99 -0.78 116.25 119.87 1d5a h VAL 513 Ca -0.02 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 1d5a h VAL 513 Cb 1.27 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1d5a h VAL 513 CO 0.13 0.37 0.31 0.74 0.02 0.00 0.00 177.57 179.14 1d5a h THR 514 N 0.96 1.22 -0.22 2.57 2.02 -1.36 -1.75 112.91 116.35 1d5a h THR 514 Ca 0.20 -0.60 -0.14 0.00 0.77 0.00 0.00 66.41 66.65 1d5a h THR 514 Cb 0.40 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1d5a h THR 514 CO 0.01 0.25 -0.43 0.00 0.37 0.00 0.00 175.52 175.71 1d5a h ALA 515 N 1.14 0.84 -0.35 6.16 0.00 -1.24 -2.66 119.26 123.14 1d5a h ALA 515 Ca 0.22 -0.45 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 1d5a h ALA 515 Cb 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1d5a h ALA 515 CO -0.03 0.65 -0.40 -1.49 0.00 0.00 0.00 179.25 177.98 1d5a h TRP 516 N 0.44 1.04 -0.77 0.00 6.55 -0.93 -2.51 115.95 119.77 1d5a h TRP 516 Ca 0.03 -0.31 0.03 0.00 0.95 0.00 0.00 58.89 59.59 1d5a h TRP 516 Cb 0.93 -0.22 -0.05 0.00 -0.86 0.00 0.00 29.16 28.97 1d5a h TRP 516 CO 0.04 1.12 0.49 0.78 -1.05 0.00 0.00 178.44 179.82 1d5a h GLY 517 N 0.83 1.11 0.99 1.49 0.00 -1.24 -1.10 103.07 105.15 1d5a h GLY 517 Ca 0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1d5a h GLY 517 CO 0.09 0.33 0.31 -0.09 0.00 0.00 0.00 176.54 177.19 1d5a h ARG 518 N 0.97 0.86 -0.61 4.80 2.43 -1.37 -2.11 114.38 119.36 1d5a h ARG 518 Ca 0.30 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.27 1d5a h ARG 518 Cb -0.02 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 1d5a h ARG 518 CO -0.10 0.68 0.05 0.37 -1.51 0.00 0.00 179.97 179.45 1d5a h GLN 519 N 0.83 1.03 0.16 0.20 4.15 -0.92 -1.37 115.11 119.18 1d5a h GLN 519 Ca 0.21 -0.29 -0.01 0.00 0.77 0.00 0.00 58.65 59.33 1d5a h GLN 519 Cb 0.08 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.66 1d5a h GLN 519 CO -0.03 0.98 -0.07 1.88 -1.93 0.00 0.00 178.83 179.66 1d5a h TYR 520 N 0.96 -0.19 -0.53 3.99 -1.99 -1.11 -2.69 116.97 115.41 1d5a h TYR 520 Ca 0.18 -0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.91 1d5a h TYR 520 Cb 0.49 0.06 -0.03 0.00 2.00 0.00 0.00 36.73 39.26 1d5a h TYR 520 CO 0.03 0.19 0.35 0.82 -0.00 0.00 0.00 178.16 179.56 1d5a h ILE 521 N -0.64 1.13 -0.08 -2.88 1.08 -1.40 -0.19 117.51 114.53 1d5a h ILE 521 Ca -0.02 -0.25 -0.08 0.00 -0.39 0.00 0.00 64.86 64.12 1d5a h ILE 521 Cb 0.47 0.35 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 1d5a h ILE 521 CO 0.03 0.13 -0.32 -0.33 -0.69 0.00 0.00 178.15 176.97 1d5a h GLU 522 N 0.72 0.15 -0.01 2.37 5.08 -1.26 0.29 114.58 121.91 1d5a h GLU 522 Ca 0.20 -0.06 -0.20 0.00 -1.00 0.00 0.00 59.36 58.30 1d5a h GLU 522 Cb -0.07 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1d5a h GLU 522 CO -0.04 0.46 -0.87 1.79 -1.00 0.00 0.00 179.01 179.34 1d5a h THR 523 N 0.13 1.44 -0.72 1.13 1.35 -0.79 -1.48 112.91 113.98 1d5a h THR 523 Ca 0.02 -2.47 0.02 0.00 -0.55 0.00 0.00 66.41 63.43 1d5a h THR 523 Cb 0.64 2.39 -0.04 0.00 -1.73 0.00 0.00 68.15 69.41 1d5a h THR 523 CO 0.05 0.73 0.47 0.00 -0.25 0.00 0.00 175.52 176.52 1d5a h THR 524 N 0.18 1.14 0.22 6.82 1.03 -0.38 -1.38 112.91 120.53 1d5a h THR 524 Ca -0.05 -0.31 -0.32 0.00 -0.01 0.00 0.00 66.41 65.72 1d5a h THR 524 Cb 1.50 0.15 0.03 0.00 -1.07 0.00 0.00 68.15 68.75 1d5a h THR 524 CO 0.14 0.17 -1.41 0.24 -0.01 0.00 0.00 175.52 174.65 1d5a h MET 525 N 0.91 0.46 0.00 0.00 2.07 -0.85 -2.78 114.93 114.74 1d5a h MET 525 Ca 0.28 -0.78 0.00 0.00 -2.07 0.00 0.00 59.70 57.13 1d5a h MET 525 Cb -0.01 0.29 0.00 0.00 -1.87 0.00 0.00 31.60 30.01 1d5a h MET 525 CO -0.07 1.37 0.00 -2.13 1.07 0.00 0.00 176.91 177.15 1d5a n ARG 526 N -3.66 0.17 -0.08 1.72 0.00 -0.57 -2.62 116.66 111.63 1d5a n ARG 526 Ca -0.14 0.36 -0.22 0.00 -0.00 0.00 0.00 57.85 57.85 1d5a n ARG 526 Cb 1.08 -1.80 -0.12 0.00 0.00 0.00 0.00 32.46 31.62 1d5a n ARG 526 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1d5a h GLU 527 N 0.00 0.06 -0.36 -0.14 4.39 -1.27 -2.98 114.58 114.28 1d5a h GLU 527 Ca 0.00 -0.11 0.11 0.00 0.34 0.00 0.00 59.36 59.70 1d5a h GLU 527 Cb 0.39 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1d5a h GLU 527 CO 0.00 1.05 0.30 0.97 -1.16 0.00 0.00 179.01 180.17 1d5a h ILE 528 N -0.76 0.66 0.11 3.13 2.10 -1.41 -1.33 117.51 120.01 1d5a h ILE 528 Ca -0.36 0.00 -0.27 0.00 1.08 0.00 0.00 64.86 65.32 1d5a h ILE 528 Cb 1.46 0.78 -0.00 0.00 -1.09 0.00 0.00 36.82 37.97 1d5a h ILE 528 CO -0.14 0.00 -1.37 -0.33 -1.08 0.00 0.00 178.15 175.24 1d5a h GLU 529 N 0.00 0.23 0.00 2.19 5.08 -1.63 -2.93 114.58 117.51 1d5a h GLU 529 Ca 0.17 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1d5a h GLU 529 Cb 0.77 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1d5a h GLU 529 CO -0.00 1.19 -0.00 0.93 -1.00 0.00 0.00 179.01 180.12 1d5a h GLU 530 N -0.35 0.00 0.00 2.33 5.08 -1.31 -2.83 114.58 117.50 1d5a h GLU 530 Ca -0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1d5a h GLU 530 Cb 1.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.97 1d5a h GLU 530 CO 0.05 0.00 -0.18 1.63 -1.00 0.00 0.00 179.01 179.51 1d5a n LYS 531 N -2.57 5.80 0.00 2.33 5.02 -0.53 -4.73 118.16 123.47 1d5a n LYS 531 Ca 0.05 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1d5a n LYS 531 Cb 0.47 -0.60 0.00 0.00 -0.02 0.00 0.00 35.03 34.88 1d5a n LYS 531 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1d5a n PHE 532 N -1.09 0.00 -1.35 2.13 3.01 -1.12 -5.02 117.46 114.02 1d5a n PHE 532 Ca 0.00 -0.09 -0.12 0.00 1.01 0.00 0.00 57.45 58.25 1d5a n PHE 532 Cb 0.01 -0.01 -0.05 0.00 -0.01 0.00 0.00 39.48 39.42 1d5a n PHE 532 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1d5a n GLY 533 N -0.09 1.27 3.89 1.37 0.00 -1.07 -4.96 105.19 105.59 1d5a n GLY 533 Ca 0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 1d5a n GLY 533 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1d5a s PHE 534 N -2.33 3.31 -0.12 1.61 0.40 -1.14 -4.64 117.98 115.07 1d5a s PHE 534 Ca 0.00 0.95 0.00 0.00 -0.60 0.00 0.00 56.93 57.28 1d5a s PHE 534 Cb 0.00 -2.99 0.02 0.00 0.51 0.00 0.00 43.02 40.56 1d5a s PHE 534 CO 0.00 -1.10 -0.10 0.21 0.70 0.00 0.00 175.22 174.94 1d5a s LYS 535 N -5.27 1.76 -0.07 0.44 2.20 0.79 -4.32 119.74 115.27 1d5a s LYS 535 Ca 0.57 -0.35 -0.30 0.00 -0.36 0.00 0.00 55.97 55.53 1d5a s LYS 535 Cb -0.11 -1.72 -0.02 0.00 -1.51 0.00 0.00 37.83 34.47 1d5a s LYS 535 CO 0.50 -0.23 1.09 0.08 -0.36 0.00 0.00 175.35 176.43 1d5a s VAL 536 N 1.56 4.55 -0.16 4.02 1.01 -1.26 -2.39 120.40 127.73 1d5a s VAL 536 Ca 0.03 1.84 0.17 0.00 0.00 0.00 0.00 61.98 64.03 1d5a s VAL 536 Cb -0.13 -4.18 -0.24 0.00 0.00 0.00 0.00 36.38 31.82 1d5a s VAL 536 CO -0.08 0.02 0.13 0.18 0.00 0.00 0.00 175.10 175.35 1d5a n LEU 537 N 4.98 0.00 -3.63 3.92 4.77 -0.59 -4.79 117.00 121.65 1d5a n LEU 537 Ca 0.09 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.96 1d5a n LEU 537 Cb 0.48 0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 41.87 1d5a n LEU 537 CO 0.53 0.38 0.43 -0.47 -1.33 0.00 0.00 177.39 176.93 1d5a s TYR 538 N -2.62 -0.82 -0.10 -1.77 5.04 -1.20 -1.47 117.35 114.41 1d5a s TYR 538 Ca -0.09 1.90 -0.09 0.00 -2.44 0.00 0.00 57.07 56.35 1d5a s TYR 538 Cb 0.07 0.36 0.03 0.00 0.35 0.00 0.00 41.96 42.77 1d5a s TYR 538 CO 0.78 -0.40 0.27 0.00 -1.34 0.00 0.00 175.55 174.86 1d5a s ALA 539 N 0.66 -0.67 0.00 3.97 0.00 -1.26 -0.56 121.76 123.90 1d5a s ALA 539 Ca -0.02 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.76 1d5a s ALA 539 Cb -0.05 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1d5a s ALA 539 CO -0.04 -0.14 0.00 -0.40 0.00 0.00 0.00 175.76 175.18 1d5a n ASP 540 N 3.11 0.00 0.00 0.00 5.68 -0.81 -4.83 116.55 119.69 1d5a n ASP 540 Ca -0.14 -0.71 0.14 0.00 -0.50 0.00 0.00 54.79 53.57 1d5a n ASP 540 Cb 0.57 0.00 0.75 0.00 -1.14 0.00 0.00 41.12 41.30 1d5a n ASP 540 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1d5a n THR 541 N 0.00 0.08 -0.10 2.12 -2.24 -1.26 -3.62 114.28 109.26 1d5a n THR 541 Ca 0.00 0.02 -0.12 0.00 -2.27 0.00 0.00 64.05 61.68 1d5a n THR 541 Cb 0.00 -0.57 -0.13 0.00 -2.10 0.00 0.00 70.33 67.52 1d5a n THR 541 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1d5a n ASP 542 N -1.17 1.04 0.00 3.42 8.00 -1.26 -4.94 116.55 121.63 1d5a n ASP 542 Ca 0.16 -0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.61 1d5a n ASP 542 Cb 0.17 0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 1d5a n ASP 542 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1d5a n GLY 543 N 2.04 -1.30 3.04 0.44 0.00 -1.24 -2.17 105.19 106.00 1d5a n GLY 543 Ca -0.35 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 1d5a n GLY 543 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1d5a s PHE 544 N -2.26 0.46 -0.09 1.61 -0.12 -0.90 -1.93 117.98 114.76 1d5a s PHE 544 Ca 0.00 -0.68 -0.03 0.00 -0.05 0.00 0.00 56.93 56.16 1d5a s PHE 544 Cb 0.00 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.05 1d5a s PHE 544 CO 0.00 -0.21 0.06 -0.06 -0.05 0.00 0.00 175.22 174.96 1d5a s PHE 545 N -2.21 3.32 0.14 3.49 0.08 0.28 -1.55 117.98 121.53 1d5a s PHE 545 Ca -0.07 0.30 -0.14 0.00 0.12 0.00 0.00 56.93 57.15 1d5a s PHE 545 Cb -0.04 -1.83 0.02 0.00 -0.57 0.00 0.00 43.02 40.59 1d5a s PHE 545 CO -0.03 0.57 0.36 0.00 -0.10 0.00 0.00 175.22 176.02 1d5a s ALA 546 N -0.97 -0.62 0.28 5.36 0.00 -0.57 -1.55 121.76 123.69 1d5a s ALA 546 Ca 0.15 -0.35 -0.10 0.00 0.00 0.00 0.00 51.96 51.66 1d5a s ALA 546 Cb -0.12 0.71 -0.00 0.00 0.00 0.00 0.00 23.12 23.71 1d5a s ALA 546 CO 0.04 -0.65 0.49 -0.08 0.00 0.00 0.00 175.76 175.56 1d5a s THR 547 N -3.86 0.00 -0.36 0.00 -1.32 -1.01 -1.39 115.64 107.71 1d5a s THR 547 Ca 0.07 -1.45 -0.02 0.00 -1.21 0.00 0.00 61.69 59.08 1d5a s THR 547 Cb 0.02 -2.37 0.08 0.00 -1.51 0.00 0.00 72.50 68.73 1d5a s THR 547 CO -0.08 0.00 0.11 -0.63 -2.21 0.00 0.00 174.62 171.81 1d5a s ILE 548 N -3.68 3.14 -0.22 5.08 1.01 -1.26 -0.15 121.20 125.13 1d5a s ILE 548 Ca 0.24 -1.74 -0.38 0.00 0.00 0.00 0.00 60.65 58.78 1d5a s ILE 548 Cb -0.01 -3.00 -0.14 0.00 0.01 0.00 0.00 42.46 39.33 1d5a s ILE 548 CO 0.12 -0.41 1.82 -0.81 0.00 0.00 0.00 174.94 175.66 1d5a n PRO 549 N 4.60 1.53 -2.46 2.79 -0.04 -1.26 -2.99 135.00 137.17 1d5a n PRO 549 Ca -0.07 0.56 -0.08 0.00 -0.04 0.00 0.00 63.50 63.87 1d5a n PRO 549 Cb 0.42 -2.32 0.04 0.00 -0.04 0.00 0.00 33.50 31.60 1d5a n PRO 549 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1d5a n GLY 550 N 4.40 -0.07 3.12 0.55 0.00 -1.26 -5.07 105.19 106.86 1d5a n GLY 550 Ca 0.26 0.06 -0.12 0.00 0.00 0.00 0.00 46.02 46.21 1d5a n GLY 550 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d5a s ALA 551 N -3.19 -0.49 0.75 4.61 0.00 -1.16 -5.15 121.76 117.14 1d5a s ALA 551 Ca 0.17 0.31 -0.14 0.00 0.00 0.00 0.00 51.96 52.29 1d5a s ALA 551 Cb -0.02 -0.14 0.05 0.00 0.00 0.00 0.00 23.12 23.02 1d5a s ALA 551 CO 0.36 -0.16 1.20 0.16 0.00 0.00 0.00 175.76 177.33 1d5a s ASP 552 N -0.59 4.03 0.33 0.00 1.47 -1.26 -4.83 116.67 115.82 1d5a s ASP 552 Ca -0.07 2.34 0.06 0.00 1.18 0.00 0.00 52.55 56.06 1d5a s ASP 552 Cb -0.04 -2.59 0.72 0.00 -0.34 0.00 0.00 42.92 40.67 1d5a s ASP 552 CO 0.01 -2.37 1.85 0.00 0.68 0.00 0.00 175.17 175.34 1d5a h ALA 553 N -0.51 1.71 -0.27 2.11 0.00 -1.99 -2.03 119.26 118.30 1d5a h ALA 553 Ca -0.47 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 1d5a h ALA 553 Cb 1.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1d5a h ALA 553 CO 0.49 0.04 -0.33 0.93 0.00 0.00 0.00 179.25 180.37 1d5a h GLU 554 N 0.80 0.57 -0.43 0.00 4.39 -2.00 -1.93 114.58 115.99 1d5a h GLU 554 Ca 0.47 -0.26 -0.09 0.00 0.34 0.00 0.00 59.36 59.83 1d5a h GLU 554 Cb 0.65 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 1d5a h GLU 554 CO -0.24 0.83 -0.10 1.15 -1.16 0.00 0.00 179.01 179.49 1d5a h THR 555 N 0.48 1.25 -0.12 1.13 2.02 -1.73 -1.78 112.91 114.17 1d5a h THR 555 Ca 0.05 -1.14 -0.07 0.00 0.77 0.00 0.00 66.41 66.03 1d5a h THR 555 Cb 0.81 1.03 -0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1d5a h THR 555 CO 0.07 0.39 -0.18 0.58 0.37 0.00 0.00 175.52 176.74 1d5a h VAL 556 N 0.69 1.37 0.59 3.16 2.07 -1.33 -1.56 116.25 121.24 1d5a h VAL 556 Ca 0.12 -1.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.20 1d5a h VAL 556 Cb 0.57 2.00 0.01 0.00 -1.52 0.00 0.00 31.29 32.34 1d5a h VAL 556 CO 0.04 0.41 -0.28 0.11 0.02 0.00 0.00 177.57 177.86 1d5a h LYS 557 N -0.06 -0.77 -0.84 1.57 1.57 -1.28 -1.11 116.57 115.66 1d5a h LYS 557 Ca 0.01 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1d5a h LYS 557 Cb 0.74 0.17 -0.05 0.00 0.08 0.00 0.00 32.23 33.18 1d5a h LYS 557 CO 0.04 -0.51 0.54 -0.91 -0.57 0.00 0.00 179.45 178.04 1d5a h ASN 558 N -0.80 0.89 0.70 0.86 2.35 -1.41 -1.26 115.58 116.91 1d5a h ASN 558 Ca -0.08 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.58 1d5a h ASN 558 Cb 0.61 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1d5a h ASN 558 CO 0.13 0.61 -0.41 0.50 -1.65 0.00 0.00 177.43 176.61 1d5a h LYS 559 N 1.04 0.00 -0.07 0.81 3.64 -1.21 -0.71 116.57 120.08 1d5a h LYS 559 Ca 0.34 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.67 1d5a h LYS 559 Cb 0.02 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1d5a h LYS 559 CO -0.12 0.41 -0.13 0.00 -2.27 0.00 0.00 179.45 177.35 1d5a h ALA 560 N 1.59 0.10 0.00 5.00 0.00 -0.62 -1.75 119.26 123.58 1d5a h ALA 560 Ca -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1d5a h ALA 560 Cb 0.87 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1d5a h ALA 560 CO 0.05 -0.01 -0.04 0.87 0.00 0.00 0.00 179.25 180.12 1d5a h LYS 561 N -0.28 0.00 0.00 0.00 1.57 -1.04 0.21 116.57 117.03 1d5a h LYS 561 Ca 0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1d5a h LYS 561 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 1d5a h LYS 561 CO 0.03 0.04 -0.58 1.49 -0.57 0.00 0.00 179.45 179.85 1d5a h GLU 562 N 0.00 0.00 -0.13 3.15 4.81 -0.94 -3.20 114.58 118.28 1d5a h GLU 562 Ca -0.00 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 1d5a h GLU 562 Cb 0.07 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.46 1d5a h GLU 562 CO 0.00 0.58 -0.50 0.35 -0.73 0.00 0.00 179.01 178.72 1d5a h PHE 563 N 0.00 0.76 0.00 0.92 3.57 0.31 -3.26 116.94 119.24 1d5a h PHE 563 Ca -0.01 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 61.18 1d5a h PHE 563 Cb 1.21 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.83 1d5a h PHE 563 CO 0.00 1.10 0.00 1.28 -2.23 0.00 0.00 178.31 178.46 1d5a n LEU 564 N -4.21 0.00 0.00 0.59 4.77 -0.75 -1.44 117.00 115.96 1d5a n LEU 564 Ca -0.07 0.94 0.00 0.00 -0.03 0.00 0.00 56.01 56.85 1d5a n LEU 564 Cb 0.60 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1d5a n LEU 564 CO 0.47 -0.44 0.35 -0.46 -1.33 0.00 0.00 177.39 175.97 1d5a n ASN 565 N -1.98 0.00 -0.02 -1.43 0.23 -1.23 -0.42 115.26 110.42 1d5a n ASN 565 Ca 0.00 0.19 -0.21 0.00 -0.53 0.00 0.00 54.58 54.03 1d5a n ASN 565 Cb 0.00 -0.19 -0.13 0.00 -2.08 0.00 0.00 39.78 37.37 1d5a n ASN 565 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 1d5a h TYR 566 N 0.00 0.36 0.00 -2.53 3.20 -1.51 -3.41 116.97 113.08 1d5a h TYR 566 Ca 0.00 -0.26 -0.31 0.00 3.14 0.00 0.00 58.73 61.30 1d5a h TYR 566 Cb 0.00 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.20 1d5a h TYR 566 CO 0.00 1.61 -1.99 1.51 -1.64 0.00 0.00 178.16 177.65 1d5a n ILE 567 N -3.90 1.46 -0.31 1.81 3.06 -0.19 -4.32 119.36 116.97 1d5a n ILE 567 Ca -0.29 -0.81 0.07 0.00 -2.50 0.00 0.00 62.75 59.22 1d5a n ILE 567 Cb 0.90 -0.76 0.22 0.00 0.54 0.00 0.00 39.64 40.54 1d5a n ILE 567 CO 0.00 0.00 0.00 0.78 -2.50 0.00 0.00 176.55 174.83 1d5a h ASN 568 N 0.00 0.67 0.81 9.51 -0.26 -0.97 0.23 115.58 125.56 1d5a h ASN 568 Ca -0.38 0.07 -0.02 0.00 -0.56 0.00 0.00 56.30 55.41 1d5a h ASN 568 Cb 2.07 -0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 39.28 1d5a h ASN 568 CO 0.05 0.32 -0.09 -0.65 -1.06 0.00 0.00 177.43 176.01 1d5a h PRO 569 N 0.75 0.00 -0.01 0.81 0.11 -1.79 -2.70 132.00 129.18 1d5a h PRO 569 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1d5a h PRO 569 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1d5a h PRO 569 CO -0.31 0.09 -0.13 -2.13 -0.21 0.00 0.00 178.00 175.31 1d5a n ARG 570 N -3.27 0.90 -3.77 1.05 0.63 0.76 -4.86 116.66 108.10 1d5a n ARG 570 Ca -0.00 -0.40 -0.36 0.00 -0.92 0.00 0.00 57.85 56.16 1d5a n ARG 570 Cb 0.31 -1.49 -0.07 0.00 0.45 0.00 0.00 32.46 31.66 1d5a n ARG 570 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1d5a s LEU 571 N -2.38 4.32 0.46 6.15 1.43 -0.96 -5.08 118.68 122.62 1d5a s LEU 571 Ca 0.30 0.43 -0.24 0.00 -1.03 0.00 0.00 54.13 53.60 1d5a s LEU 571 Cb 0.20 -2.14 -0.07 0.00 0.03 0.00 0.00 46.19 44.20 1d5a s LEU 571 CO 0.46 0.30 1.26 -2.16 0.23 0.00 0.00 176.35 176.43 1d5a s PRO 572 N -0.43 3.68 2.69 1.29 0.04 -1.26 -4.82 135.00 136.18 1d5a s PRO 572 Ca 0.13 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.19 1d5a s PRO 572 Cb -0.12 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.93 1d5a s PRO 572 CO 0.03 -0.69 0.00 0.41 0.04 0.00 0.00 177.00 176.79 1d5a n GLY 573 N 0.59 -0.50 0.82 0.56 0.00 -1.26 -3.90 105.19 101.51 1d5a n GLY 573 Ca 0.07 -1.10 0.10 0.00 0.00 0.00 0.00 46.02 45.09 1d5a n GLY 573 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1d5a n LEU 574 N 0.00 2.44 -4.72 0.99 4.32 -1.26 -4.93 117.00 113.83 1d5a n LEU 574 Ca 0.00 -1.11 -0.41 0.00 -0.02 0.00 0.00 56.01 54.47 1d5a n LEU 574 Cb 0.00 -0.23 -0.04 0.00 -1.62 0.00 0.00 43.42 41.53 1d5a n LEU 574 CO 0.00 0.56 0.61 -1.48 -1.22 0.00 0.00 177.39 175.86 1d5a s LEU 575 N -1.32 4.42 0.16 2.23 2.34 -1.25 -4.83 118.68 120.43 1d5a s LEU 575 Ca 0.34 1.62 -0.04 0.00 0.06 0.00 0.00 54.13 56.11 1d5a s LEU 575 Cb 0.18 -3.47 -0.03 0.00 -0.56 0.00 0.00 46.19 42.31 1d5a s LEU 575 CO 0.26 -0.13 0.16 -1.61 -1.06 0.00 0.00 176.35 173.97 1d5a s GLU 576 N 0.47 1.09 -0.01 1.48 2.02 -1.19 -4.79 118.70 117.77 1d5a s GLU 576 Ca 0.47 -1.40 0.00 0.00 0.02 0.00 0.00 54.97 54.06 1d5a s GLU 576 Cb -0.21 0.30 -0.04 0.00 0.10 0.00 0.00 34.13 34.28 1d5a s GLU 576 CO 0.27 -0.36 0.04 -0.51 0.02 0.00 0.00 175.26 174.72 1d5a s LEU 577 N -3.05 3.71 0.03 1.80 1.43 -1.26 -0.78 118.68 120.56 1d5a s LEU 577 Ca 0.25 0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.49 1d5a s LEU 577 Cb 0.06 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 1d5a s LEU 577 CO 0.04 0.29 -0.15 -1.61 0.23 0.00 0.00 176.35 175.15 1d5a s GLU 578 N -1.57 1.05 -0.53 1.70 2.02 -0.03 -4.95 118.70 116.39 1d5a s GLU 578 Ca 0.20 -0.71 -0.27 0.00 0.02 0.00 0.00 54.97 54.21 1d5a s GLU 578 Cb -0.12 -1.06 -0.01 0.00 0.10 0.00 0.00 34.13 33.04 1d5a s GLU 578 CO 0.11 0.27 1.74 -0.47 0.02 0.00 0.00 175.26 176.93 1d5a s TYR 579 N -0.70 1.84 -0.00 1.61 5.04 -1.26 -0.89 117.35 123.00 1d5a s TYR 579 Ca 0.03 0.67 0.07 0.00 -2.44 0.00 0.00 57.07 55.41 1d5a s TYR 579 Cb -0.07 -4.17 -0.24 0.00 0.35 0.00 0.00 41.96 37.83 1d5a s TYR 579 CO 0.01 -2.38 0.82 1.49 -1.34 0.00 0.00 175.55 174.15 1d5a h GLU 580 N 13.54 0.06 0.00 4.97 4.22 -1.48 -3.48 114.58 132.42 1d5a h GLU 580 Ca -0.28 -0.11 0.00 0.00 0.08 0.00 0.00 59.36 59.05 1d5a h GLU 580 Cb 1.15 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1d5a h GLU 580 CO 1.16 0.77 0.00 0.41 -2.18 0.00 0.00 179.01 179.18 1d5a n GLY 581 N 1.56 1.70 3.45 1.92 0.00 -1.21 -4.99 105.19 107.62 1d5a n GLY 581 Ca -0.14 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 1d5a n GLY 581 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1d5a s PHE 582 N -2.00 2.60 -0.03 1.61 5.36 -1.26 -0.67 117.98 123.60 1d5a s PHE 582 Ca 0.00 -0.23 0.03 0.00 -0.96 0.00 0.00 56.93 55.77 1d5a s PHE 582 Cb 0.00 -1.54 -0.00 0.00 -0.34 0.00 0.00 43.02 41.14 1d5a s PHE 582 CO 0.00 0.19 -0.11 0.71 -1.46 0.00 0.00 175.22 174.55 1d5a s TYR 583 N -0.81 1.12 0.10 10.12 1.51 0.25 -4.43 117.35 125.21 1d5a s TYR 583 Ca 0.13 -0.28 -0.20 0.00 -1.01 0.00 0.00 57.07 55.71 1d5a s TYR 583 Cb -0.10 -0.77 -0.08 0.00 -0.11 0.00 0.00 41.96 40.89 1d5a s TYR 583 CO 0.03 -0.10 1.69 -0.09 -1.11 0.00 0.00 175.55 175.96 1d5a h ARG 584 N 6.27 0.27 -4.12 -0.62 9.65 -1.47 0.06 114.38 124.42 1d5a h ARG 584 Ca -0.33 -0.04 -0.15 0.00 -1.10 0.00 0.00 59.98 58.37 1d5a h ARG 584 Cb 1.17 -0.05 -0.12 0.00 -1.39 0.00 0.00 29.97 29.58 1d5a h ARG 584 CO 0.49 0.28 -0.38 1.03 2.80 0.00 0.00 179.97 184.19 1d5a s ARG 585 N -5.79 1.33 -0.30 0.20 0.52 -1.25 -1.26 118.95 112.40 1d5a s ARG 585 Ca -0.13 -1.42 -0.38 0.00 -0.52 0.00 0.00 55.73 53.27 1d5a s ARG 585 Cb 0.08 0.36 0.16 0.00 0.52 0.00 0.00 34.95 36.07 1d5a s ARG 585 CO 0.70 -0.50 1.40 0.20 0.02 0.00 0.00 175.30 177.12 1d5a s GLY 586 N -3.08 -0.17 -0.00 -3.53 0.00 -0.59 -2.72 107.32 97.23 1d5a s GLY 586 Ca 0.29 2.00 -0.06 0.00 0.00 0.00 0.00 44.72 46.96 1d5a s GLY 586 CO 0.09 0.67 0.11 -0.11 0.00 0.00 0.00 173.10 173.86 1d5a s PHE 587 N -1.95 0.04 -0.21 1.90 -0.12 -0.78 -1.85 117.98 115.02 1d5a s PHE 587 Ca 0.12 -0.11 0.01 0.00 -0.05 0.00 0.00 56.93 56.90 1d5a s PHE 587 Cb -0.01 -0.05 0.05 0.00 -0.63 0.00 0.00 43.02 42.37 1d5a s PHE 587 CO -0.02 -0.23 -0.10 -0.06 -0.05 0.00 0.00 175.22 174.76 1d5a s PHE 588 N -1.14 2.43 -0.03 3.49 0.40 -1.26 -2.29 117.98 119.58 1d5a s PHE 588 Ca -0.12 -1.63 -0.05 0.00 -0.60 0.00 0.00 56.93 54.52 1d5a s PHE 588 Cb -0.07 -1.64 -0.03 0.00 0.51 0.00 0.00 43.02 41.80 1d5a s PHE 588 CO 0.01 -0.75 0.36 0.28 0.70 0.00 0.00 175.22 175.82 1d5a h VAL 589 N 6.45 0.00 -2.72 -0.44 2.07 -1.57 -3.43 116.25 116.60 1d5a h VAL 589 Ca -0.26 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 1d5a h VAL 589 Cb 1.09 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1d5a h VAL 589 CO 0.46 0.00 0.10 1.07 0.02 0.00 0.00 177.57 179.22 1d5a n THR 590 N -3.58 0.00 0.00 2.57 5.66 -1.05 -4.75 114.28 113.13 1d5a n THR 590 Ca -0.02 -0.69 0.00 0.00 -3.05 0.00 0.00 64.05 60.29 1d5a n THR 590 Cb 0.08 0.59 0.00 0.00 -1.55 0.00 0.00 70.33 69.45 1d5a n THR 590 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1d5a n LYS 591 N -0.32 0.00 -2.65 1.09 5.02 -1.26 -0.80 118.16 119.25 1d5a n LYS 591 Ca -0.04 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.15 1d5a n LYS 591 Cb 0.34 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.38 1d5a n LYS 591 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1d5a n LYS 592 N -1.35 1.50 -3.73 1.97 4.81 -1.26 -4.92 118.16 115.18 1d5a n LYS 592 Ca 0.00 -3.44 -0.22 0.00 -0.87 0.00 0.00 58.31 53.78 1d5a n LYS 592 Cb 0.00 -1.41 -0.18 0.00 0.02 0.00 0.00 35.03 33.47 1d5a n LYS 592 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1d5a s LYS 593 N -3.24 0.34 0.26 1.64 1.02 0.02 -4.42 119.74 115.36 1d5a s LYS 593 Ca 0.30 0.18 -0.21 0.00 0.02 0.00 0.00 55.97 56.26 1d5a s LYS 593 Cb 0.44 -0.88 0.05 0.00 -0.52 0.00 0.00 37.83 36.92 1d5a s LYS 593 CO 0.01 -0.34 0.87 1.52 -0.92 0.00 0.00 175.35 176.49 1d5a s TYR 594 N 2.05 -0.02 -0.13 3.18 -0.85 -1.04 -1.45 117.35 119.09 1d5a s TYR 594 Ca 0.05 -0.45 -0.09 0.00 -0.52 0.00 0.00 57.07 56.06 1d5a s TYR 594 Cb -0.12 0.73 0.04 0.00 0.38 0.00 0.00 41.96 42.99 1d5a s TYR 594 CO -0.05 -1.17 0.31 0.00 -1.52 0.00 0.00 175.55 173.13 1d5a s ALA 595 N -2.88 -0.77 0.12 9.51 0.00 -0.97 -1.47 121.76 125.30 1d5a s ALA 595 Ca 0.15 1.09 0.01 0.00 0.00 0.00 0.00 51.96 53.21 1d5a s ALA 595 Cb -0.04 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 1d5a s ALA 595 CO 0.07 -0.19 -0.02 0.14 0.00 0.00 0.00 175.76 175.75 1d5a s VAL 596 N 0.85 0.53 -0.03 0.00 -7.23 -0.68 -1.87 120.40 111.98 1d5a s VAL 596 Ca -0.06 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 1d5a s VAL 596 Cb -0.07 -1.86 0.03 0.00 0.56 0.00 0.00 36.38 35.05 1d5a s VAL 596 CO -0.06 -0.70 0.01 -0.51 -0.31 0.00 0.00 175.10 173.53 1d5a s ILE 597 N -3.74 0.09 0.00 -0.62 2.07 -1.10 -0.67 121.20 117.23 1d5a s ILE 597 Ca 0.17 0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.54 1d5a s ILE 597 Cb 0.06 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.45 1d5a s ILE 597 CO -0.02 0.12 0.00 -0.90 -1.91 0.00 0.00 174.94 172.24 1d5a n ASP 598 N 4.14 0.00 0.12 4.50 3.85 -1.06 -1.46 116.55 126.63 1d5a n ASP 598 Ca -0.27 -0.94 0.12 0.00 -0.71 0.00 0.00 54.79 52.99 1d5a n ASP 598 Cb 0.50 0.00 0.45 0.00 -1.35 0.00 0.00 41.12 40.73 1d5a n ASP 598 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1d5a n GLU 599 N -0.94 0.23 0.00 0.11 1.02 -1.26 -2.44 120.64 117.36 1d5a n GLU 599 Ca 0.00 0.32 0.13 0.00 -0.02 0.00 0.00 57.16 57.59 1d5a n GLU 599 Cb 0.00 -1.84 0.33 0.00 -0.02 0.00 0.00 31.44 29.91 1d5a n GLU 599 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1d5a n GLU 600 N -2.25 1.27 -2.56 3.49 1.02 -1.26 -4.96 120.64 115.40 1d5a n GLU 600 Ca 0.04 -0.84 -0.04 0.00 -0.02 0.00 0.00 57.16 56.29 1d5a n GLU 600 Cb 0.32 -1.48 0.01 0.00 -0.02 0.00 0.00 31.44 30.27 1d5a n GLU 600 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1d5a n ASP 601 N -0.13 -2.61 -4.58 1.62 9.92 -1.02 -5.04 116.55 114.70 1d5a n ASP 601 Ca 0.14 -0.08 -0.37 0.00 -0.53 0.00 0.00 54.79 53.95 1d5a n ASP 601 Cb 0.39 -1.34 -0.11 0.00 -0.64 0.00 0.00 41.12 39.42 1d5a n ASP 601 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 1d5a s LYS 602 N -5.00 3.92 -0.15 -1.24 2.47 -1.26 -4.90 119.74 113.58 1d5a s LYS 602 Ca 0.08 -0.35 -0.20 0.00 -1.56 0.00 0.00 55.97 53.95 1d5a s LYS 602 Cb -0.04 -3.51 -0.03 0.00 -1.46 0.00 0.00 37.83 32.79 1d5a s LYS 602 CO 0.10 -0.07 0.57 0.42 0.16 0.00 0.00 175.35 176.53 1d5a s ILE 603 N 1.40 5.10 -0.29 5.43 1.09 -1.26 -2.56 121.20 130.11 1d5a s ILE 603 Ca 0.07 1.10 -0.02 0.00 -1.10 0.00 0.00 60.65 60.70 1d5a s ILE 603 Cb -0.15 -3.90 0.04 0.00 -1.06 0.00 0.00 42.46 37.40 1d5a s ILE 603 CO 0.07 0.22 -0.01 -0.89 -0.10 0.00 0.00 174.94 174.23 1d5a s THR 604 N 1.22 3.02 0.51 2.92 2.01 0.15 -4.98 115.64 120.49 1d5a s THR 604 Ca 0.28 -1.26 0.08 0.00 0.31 0.00 0.00 61.69 61.10 1d5a s THR 604 Cb -0.16 -2.68 0.03 0.00 0.01 0.00 0.00 72.50 69.71 1d5a s THR 604 CO 0.11 -0.02 0.53 0.42 -0.69 0.00 0.00 174.62 174.97 1d5a s THR 605 N 1.29 2.20 -0.30 -0.82 -4.23 -1.26 -1.69 115.64 110.82 1d5a s THR 605 Ca -0.04 -1.26 -0.05 0.00 -1.18 0.00 0.00 61.69 59.16 1d5a s THR 605 Cb -0.19 -2.46 0.19 0.00 1.34 0.00 0.00 72.50 71.38 1d5a s THR 605 CO -0.02 0.00 0.81 -0.60 -0.54 0.00 0.00 174.62 174.27 1d5a s ARG 606 N -4.36 0.38 -1.04 3.99 3.52 -0.54 -4.95 118.95 115.95 1d5a s ARG 606 Ca 0.48 0.58 0.00 0.00 -0.13 0.00 0.00 55.73 56.66 1d5a s ARG 606 Cb -0.04 0.31 0.00 0.00 -1.56 0.00 0.00 34.95 33.66 1d5a s ARG 606 CO 0.29 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.68 1d5a n GLY 607 N 5.40 1.03 0.48 8.12 0.00 -1.26 -2.49 105.19 116.46 1d5a n GLY 607 Ca -0.00 -0.56 0.06 0.00 0.00 0.00 0.00 46.02 45.51 1d5a n GLY 607 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1d5a n LEU 608 N -1.17 1.39 -3.68 0.99 7.99 -1.26 -4.79 117.00 116.47 1d5a n LEU 608 Ca -0.10 -0.67 -0.13 0.00 -0.01 0.00 0.00 56.01 55.10 1d5a n LEU 608 Cb 0.36 -0.15 -0.13 0.00 -0.11 0.00 0.00 43.42 43.39 1d5a n LEU 608 CO 0.15 0.33 -0.11 -1.83 -1.51 0.00 0.00 177.39 174.43 1d5a s GLU 609 N -1.69 0.19 0.36 3.23 4.04 -1.26 -4.62 118.70 118.94 1d5a s GLU 609 Ca 0.21 0.73 -0.24 0.00 0.04 0.00 0.00 54.97 55.71 1d5a s GLU 609 Cb 0.11 -0.02 -0.15 0.00 0.02 0.00 0.00 34.13 34.09 1d5a s GLU 609 CO 0.16 -0.25 0.40 -0.89 -1.84 0.00 0.00 175.26 172.84 1d5a n ILE 610 N 5.04 1.42 -2.24 1.83 5.41 -1.26 -4.80 119.36 124.76 1d5a n ILE 610 Ca -0.12 -0.50 -0.39 0.00 1.00 0.00 0.00 62.75 62.74 1d5a n ILE 610 Cb 0.51 -0.25 -0.03 0.00 -0.71 0.00 0.00 39.64 39.16 1d5a n ILE 610 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 1d5a s VAL 611 N -1.42 3.50 0.30 1.39 -7.23 -1.26 -4.99 120.40 110.69 1d5a s VAL 611 Ca 0.62 0.29 0.10 0.00 -1.81 0.00 0.00 61.98 61.18 1d5a s VAL 611 Cb -0.69 -4.32 -0.06 0.00 0.56 0.00 0.00 36.38 31.87 1d5a s VAL 611 CO 0.59 -1.27 -0.14 -0.13 -0.31 0.00 0.00 175.10 173.84 1d5a s ARG 612 N 6.52 1.68 0.00 4.82 0.52 -1.26 -5.01 118.95 126.22 1d5a s ARG 612 Ca 0.55 -1.82 0.03 0.00 -0.52 0.00 0.00 55.73 53.97 1d5a s ARG 612 Cb -0.11 -1.61 0.07 0.00 0.52 0.00 0.00 34.95 33.82 1d5a s ARG 612 CO 0.19 0.21 0.99 0.54 0.02 0.00 0.00 175.30 177.25 1d5a n ARG 613 N -0.66 2.42 -3.49 3.54 1.74 -1.26 -4.88 116.66 114.07 1d5a n ARG 613 Ca -0.05 -1.50 -0.29 0.00 -0.77 0.00 0.00 57.85 55.24 1d5a n ARG 613 Cb 0.62 -1.07 -0.13 0.00 -1.02 0.00 0.00 32.46 30.86 1d5a n ARG 613 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1d5a s ASP 614 N -0.88 3.18 0.21 0.55 -4.77 -1.26 -2.97 116.67 110.73 1d5a s ASP 614 Ca 0.06 -1.86 0.11 0.00 -3.30 0.00 0.00 52.55 47.55 1d5a s ASP 614 Cb 0.03 -0.39 -0.05 0.00 -1.09 0.00 0.00 42.92 41.43 1d5a s ASP 614 CO 0.04 -0.36 -0.21 0.26 0.70 0.00 0.00 175.17 175.61 1d5a s TRP 615 N 1.44 2.14 0.52 2.11 0.52 -1.26 -5.05 118.94 119.37 1d5a s TRP 615 Ca 0.15 -0.39 0.05 0.00 0.02 0.00 0.00 56.10 55.93 1d5a s TRP 615 Cb -0.20 -1.02 0.04 0.00 -1.15 0.00 0.00 33.47 31.14 1d5a s TRP 615 CO -0.13 0.51 0.72 -1.54 0.02 0.00 0.00 176.95 176.54 1d5a s SER 616 N -2.95 5.29 -0.01 2.95 1.04 -1.26 -4.06 113.70 114.70 1d5a s SER 616 Ca 0.22 -0.36 -0.23 0.00 0.48 0.00 0.00 55.95 56.07 1d5a s SER 616 Cb -0.06 -0.49 -0.19 0.00 0.10 0.00 0.00 66.02 65.38 1d5a s SER 616 CO 0.10 -1.11 1.21 -0.08 0.98 0.00 0.00 173.24 174.34 1d5a h GLU 617 N 0.24 0.21 -0.94 4.02 4.57 -1.71 -2.55 114.58 118.42 1d5a h GLU 617 Ca -0.38 -0.14 0.09 0.00 -1.18 0.00 0.00 59.36 57.75 1d5a h GLU 617 Cb 1.29 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 29.82 1d5a h GLU 617 CO 0.46 0.75 0.59 0.97 -1.18 0.00 0.00 179.01 180.59 1d5a h ILE 618 N -0.30 0.98 0.13 2.32 6.09 -1.72 0.23 117.51 125.24 1d5a h ILE 618 Ca -0.00 -0.34 -0.01 0.00 -1.37 0.00 0.00 64.86 63.14 1d5a h ILE 618 Cb 0.75 -0.10 0.00 0.00 0.47 0.00 0.00 36.82 37.94 1d5a h ILE 618 CO 0.03 0.18 -0.06 0.00 -3.07 0.00 0.00 178.15 175.23 1d5a h ALA 619 N 1.48 -0.17 -0.85 0.18 0.00 -1.85 -0.97 119.26 117.09 1d5a h ALA 619 Ca 0.44 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.21 1d5a h ALA 619 Cb 0.33 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1d5a h ALA 619 CO -0.22 -0.39 0.52 0.87 0.00 0.00 0.00 179.25 180.03 1d5a h LYS 620 N -0.58 0.93 -0.25 0.00 1.57 -1.08 -2.56 116.57 114.60 1d5a h LYS 620 Ca -0.02 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 1d5a h LYS 620 Cb 0.45 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1d5a h LYS 620 CO 0.03 0.62 -0.42 1.49 -0.57 0.00 0.00 179.45 180.59 1d5a h GLU 621 N 0.96 0.60 -0.25 3.15 4.81 -0.53 -3.16 114.58 120.16 1d5a h GLU 621 Ca 0.37 -0.32 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 1d5a h GLU 621 Cb 0.15 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 1d5a h GLU 621 CO -0.17 0.92 -0.26 1.15 -0.73 0.00 0.00 179.01 179.92 1d5a h THR 622 N 0.49 1.31 -0.65 0.32 2.02 -0.83 -2.77 112.91 112.80 1d5a h THR 622 Ca 0.04 -1.42 0.01 0.00 0.77 0.00 0.00 66.41 65.81 1d5a h THR 622 Cb 0.94 1.66 -0.04 0.00 -1.74 0.00 0.00 68.15 68.97 1d5a h THR 622 CO 0.08 0.45 0.42 -0.61 0.37 0.00 0.00 175.52 176.23 1d5a h GLN 623 N 0.33 0.82 -0.36 6.66 4.15 -1.53 -0.42 115.11 124.77 1d5a h GLN 623 Ca 0.04 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 1d5a h GLN 623 Cb 0.82 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.30 1d5a h GLN 623 CO 0.06 0.54 0.10 0.00 -1.93 0.00 0.00 178.83 177.61 1d5a h ALA 624 N 1.25 1.51 0.00 3.38 0.00 -1.55 0.20 119.26 124.05 1d5a h ALA 624 Ca 0.24 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 1d5a h ALA 624 Cb -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1d5a h ALA 624 CO -0.07 0.37 -0.77 -0.09 0.00 0.00 0.00 179.25 178.69 1d5a h ARG 625 N 0.51 0.00 -0.17 0.00 2.43 -1.09 -0.02 114.38 116.04 1d5a h ARG 625 Ca 0.12 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 59.07 1d5a h ARG 625 Cb 0.18 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1d5a h ARG 625 CO -0.01 0.77 -0.76 0.28 -1.51 0.00 0.00 179.97 178.75 1d5a h VAL 626 N 0.00 1.28 -0.16 0.20 2.07 -0.17 -1.80 116.25 117.67 1d5a h VAL 626 Ca -0.01 -1.95 -0.12 0.00 0.82 0.00 0.00 66.70 65.44 1d5a h VAL 626 Cb 1.40 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 1d5a h VAL 626 CO 0.10 0.62 -0.39 -0.07 0.02 0.00 0.00 177.57 177.85 1d5a h LEU 627 N 0.56 0.61 -0.97 2.57 3.38 -0.60 -2.68 115.31 118.18 1d5a h LEU 627 Ca -0.05 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 1d5a h LEU 627 Cb 1.38 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 1d5a h LEU 627 CO 0.16 1.08 0.56 -0.08 0.09 0.00 0.00 178.44 180.24 1d5a h GLU 628 N 0.18 1.27 -0.23 1.13 4.81 -1.04 -0.85 114.58 119.85 1d5a h GLU 628 Ca -0.00 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1d5a h GLU 628 Cb 1.00 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 1d5a h GLU 628 CO 0.08 0.89 0.14 0.00 -0.73 0.00 0.00 179.01 179.40 1d5a h ALA 629 N 1.33 0.29 0.27 2.92 0.00 -1.28 -1.05 119.26 121.74 1d5a h ALA 629 Ca 0.33 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1d5a h ALA 629 Cb -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1d5a h ALA 629 CO -0.06 -0.21 -0.13 0.82 0.00 0.00 0.00 179.25 179.67 1d5a h ILE 630 N 0.29 0.57 -0.01 0.00 2.04 -1.19 -2.37 117.51 116.84 1d5a h ILE 630 Ca 0.08 -0.86 -0.22 0.00 1.00 0.00 0.00 64.86 64.87 1d5a h ILE 630 Cb 0.01 0.93 0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1d5a h ILE 630 CO -0.02 0.13 -0.84 -0.07 0.00 0.00 0.00 178.15 177.36 1d5a h LEU 631 N -0.92 0.74 0.14 1.44 3.38 -1.25 0.19 115.31 119.02 1d5a h LEU 631 Ca -0.04 -0.74 -0.31 0.00 0.09 0.00 0.00 57.88 56.88 1d5a h LEU 631 Cb 0.50 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1d5a h LEU 631 CO 0.06 1.39 -1.48 0.50 0.09 0.00 0.00 178.44 179.00 1d5a h LYS 632 N 0.18 0.29 0.00 1.13 3.64 -1.35 -3.38 116.57 117.08 1d5a h LYS 632 Ca -0.10 -0.50 0.00 0.00 -1.27 0.00 0.00 60.65 58.78 1d5a h LYS 632 Cb 1.51 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.52 1d5a h LYS 632 CO 0.16 1.18 -1.51 0.72 -2.27 0.00 0.00 179.45 177.74 1d5a n HIS 633 N -3.50 0.00 -2.27 1.91 8.25 -1.03 -4.99 115.22 113.59 1d5a n HIS 633 Ca -0.15 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.12 1d5a n HIS 633 Cb 1.05 -0.28 -0.02 0.00 1.12 0.00 0.00 29.99 31.86 1d5a n HIS 633 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1d5a n GLY 634 N 1.42 -0.18 3.00 -1.41 0.00 0.65 -4.95 105.19 103.71 1d5a n GLY 634 Ca -0.01 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 1d5a n GLY 634 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1d5a s ASP 635 N -2.23 4.64 0.18 1.61 -1.08 -0.99 -4.95 116.67 113.86 1d5a s ASP 635 Ca 0.00 -3.01 -0.10 0.00 -0.52 0.00 0.00 52.55 48.92 1d5a s ASP 635 Cb 0.00 -1.71 0.10 0.00 -1.46 0.00 0.00 42.92 39.85 1d5a s ASP 635 CO 0.00 -0.27 1.73 0.58 0.52 0.00 0.00 175.17 177.73 1d5a h VAL 636 N 5.36 1.24 -0.50 1.11 2.07 -1.88 -2.97 116.25 120.70 1d5a h VAL 636 Ca -0.05 -0.80 0.05 0.00 0.82 0.00 0.00 66.70 66.72 1d5a h VAL 636 Cb 0.90 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 1d5a h VAL 636 CO 0.70 0.31 0.22 -0.33 0.02 0.00 0.00 177.57 178.49 1d5a h GLU 637 N 0.94 0.42 -0.73 1.57 5.08 -1.97 -1.83 114.58 118.06 1d5a h GLU 637 Ca 0.22 -0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.64 1d5a h GLU 637 Cb 0.25 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 1d5a h GLU 637 CO -0.01 0.27 0.48 1.49 -1.00 0.00 0.00 179.01 180.24 1d5a h GLU 638 N 0.43 0.62 0.00 2.33 4.57 -1.92 0.97 114.58 121.58 1d5a h GLU 638 Ca 0.23 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.37 1d5a h GLU 638 Cb 0.19 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1d5a h GLU 638 CO -0.19 0.41 0.00 0.00 -1.18 0.00 0.00 179.01 178.05 1d5a h ALA 639 N 1.63 1.00 0.14 2.92 0.00 -1.23 -1.83 119.26 121.89 1d5a h ALA 639 Ca 0.33 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.94 1d5a h ALA 639 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1d5a h ALA 639 CO -0.12 0.00 -1.54 0.28 0.00 0.00 0.00 179.25 177.87 1d5a h VAL 640 N 0.00 0.98 -0.63 0.00 2.07 -0.72 -3.15 116.25 114.80 1d5a h VAL 640 Ca 0.00 -2.43 0.06 0.00 0.82 0.00 0.00 66.70 65.16 1d5a h VAL 640 Cb 0.40 2.71 -0.06 0.00 -1.52 0.00 0.00 31.29 32.83 1d5a h VAL 640 CO 0.00 0.76 0.33 -0.09 0.02 0.00 0.00 177.57 178.58 1d5a h ARG 641 N -0.17 0.59 0.18 1.57 2.43 -1.02 -2.44 114.38 115.52 1d5a h ARG 641 Ca -0.32 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.81 1d5a h ARG 641 Cb 1.87 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 31.28 1d5a h ARG 641 CO 0.09 0.39 -0.19 0.82 -1.51 0.00 0.00 179.97 179.57 1d5a h ILE 642 N 0.60 0.00 -0.83 1.20 2.04 -1.46 -1.20 117.51 117.87 1d5a h ILE 642 Ca 0.29 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.33 1d5a h ILE 642 Cb 0.21 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.14 1d5a h ILE 642 CO -0.20 0.00 -0.10 0.58 0.00 0.00 0.00 178.15 178.43 1d5a h VAL 643 N -0.37 0.21 -0.24 1.67 2.07 -1.47 0.16 116.25 118.27 1d5a h VAL 643 Ca -0.02 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.52 1d5a h VAL 643 Cb 0.32 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1d5a h VAL 643 CO -0.03 0.01 0.06 0.11 0.02 0.00 0.00 177.57 177.73 1d5a h LYS 644 N 0.03 0.15 -0.88 1.57 1.57 -1.27 -1.91 116.57 115.83 1d5a h LYS 644 Ca 0.43 -0.01 0.19 0.00 -1.87 0.00 0.00 60.65 59.39 1d5a h LYS 644 Cb 0.73 -0.03 -0.11 0.00 0.08 0.00 0.00 32.23 32.90 1d5a h LYS 644 CO -0.80 0.10 0.43 1.49 -0.57 0.00 0.00 179.45 180.09 1d5a h GLU 645 N 0.15 0.50 -0.29 3.15 4.81 0.54 0.45 114.58 123.90 1d5a h GLU 645 Ca 0.11 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.25 1d5a h GLU 645 Cb 0.10 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1d5a h GLU 645 CO -0.13 0.33 -0.04 0.28 -0.73 0.00 0.00 179.01 178.72 1d5a h VAL 646 N 0.52 1.27 -0.04 0.32 2.07 -0.70 -2.66 116.25 117.04 1d5a h VAL 646 Ca 0.52 -1.03 -0.13 0.00 0.82 0.00 0.00 66.70 66.87 1d5a h VAL 646 Cb 0.88 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 1d5a h VAL 646 CO -0.45 0.33 -0.59 0.71 0.02 0.00 0.00 177.57 177.59 1d5a h THR 647 N 0.31 1.40 -0.16 2.57 1.35 -0.50 0.23 112.91 118.11 1d5a h THR 647 Ca 0.08 -2.00 -0.01 0.00 -0.55 0.00 0.00 66.41 63.93 1d5a h THR 647 Cb 0.50 2.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.96 1d5a h THR 647 CO 0.02 0.58 0.05 -0.08 -0.25 0.00 0.00 175.52 175.84 1d5a h GLU 648 N 0.09 0.25 -0.01 4.72 4.57 -0.10 -2.07 114.58 122.04 1d5a h GLU 648 Ca -0.01 -0.05 -0.25 0.00 -1.18 0.00 0.00 59.36 57.87 1d5a h GLU 648 Cb 1.07 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.64 1d5a h GLU 648 CO 0.08 0.37 -1.00 0.87 -1.18 0.00 0.00 179.01 178.16 1d5a h LYS 649 N 0.08 0.61 0.00 1.92 1.57 -1.44 -3.03 116.57 116.29 1d5a h LYS 649 Ca 0.05 -0.65 0.00 0.00 -1.87 0.00 0.00 60.65 58.18 1d5a h LYS 649 Cb 0.22 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1d5a h LYS 649 CO -0.00 1.25 0.00 -0.11 -0.57 0.00 0.00 179.45 180.02 1d5a n LEU 650 N -3.82 0.46 0.00 2.94 7.94 0.81 -1.30 117.00 124.02 1d5a n LEU 650 Ca -0.09 0.67 0.11 0.00 -1.11 0.00 0.00 56.01 55.58 1d5a n LEU 650 Cb 0.86 -0.67 -0.12 0.00 0.53 0.00 0.00 43.42 44.02 1d5a n LEU 650 CO 0.54 -0.69 -0.39 -0.24 -1.11 0.00 0.00 177.39 175.50 1d5a n SER 651 N -2.06 0.46 -0.54 1.96 2.88 -0.78 -4.00 113.62 111.53 1d5a n SER 651 Ca 0.00 -0.39 0.12 0.00 -1.33 0.00 0.00 58.87 57.27 1d5a n SER 651 Cb 0.11 1.46 0.12 0.00 -0.75 0.00 0.00 64.21 65.15 1d5a n SER 651 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1d5a n ARG 652 N -1.95 1.39 -2.90 -1.46 1.74 -0.42 -4.97 116.66 108.09 1d5a n ARG 652 Ca -0.00 -1.08 -0.11 0.00 -0.77 0.00 0.00 57.85 55.89 1d5a n ARG 652 Cb 0.46 -1.48 0.05 0.00 -1.02 0.00 0.00 32.46 30.47 1d5a n ARG 652 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1d5a n HIS 653 N 0.14 -1.34 -1.24 -1.55 8.25 -0.76 -4.96 115.22 113.75 1d5a n HIS 653 Ca 0.11 0.53 0.01 0.00 -0.26 0.00 0.00 57.72 58.12 1d5a n HIS 653 Cb 0.46 -3.51 0.22 0.00 1.12 0.00 0.00 29.99 28.29 1d5a n HIS 653 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1d5a n GLU 654 N -2.80 2.25 -4.45 -0.41 1.02 -0.98 -4.97 120.64 110.30 1d5a n GLU 654 Ca -0.10 -3.01 -0.33 0.00 -0.02 0.00 0.00 57.16 53.70 1d5a n GLU 654 Cb 0.57 -1.82 -0.15 0.00 -0.02 0.00 0.00 31.44 30.02 1d5a n GLU 654 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1d5a s VAL 655 N -3.06 2.75 0.63 2.62 1.01 -1.26 -4.95 120.40 118.13 1d5a s VAL 655 Ca 0.43 -0.74 -0.18 0.00 0.00 0.00 0.00 61.98 61.49 1d5a s VAL 655 Cb 0.37 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1d5a s VAL 655 CO 0.04 0.51 1.07 -2.65 0.00 0.00 0.00 175.10 174.07 1d5a n PRO 656 N 4.13 0.94 0.30 2.72 -0.02 -1.26 -4.90 135.00 136.91 1d5a n PRO 656 Ca -0.19 0.37 0.18 0.00 -2.02 0.00 0.00 63.50 61.84 1d5a n PRO 656 Cb 0.52 -2.29 0.94 0.00 -0.02 0.00 0.00 33.50 32.65 1d5a n PRO 656 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1d5a h PRO 657 N 0.44 0.00 -0.14 0.52 0.11 -1.99 -1.70 132.00 129.23 1d5a h PRO 657 Ca -0.49 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1d5a h PRO 657 Cb 1.36 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.46 1d5a h PRO 657 CO 0.51 0.03 -0.21 0.93 -0.21 0.00 0.00 178.00 179.06 1d5a h GLU 658 N 0.00 0.24 -0.66 1.05 5.08 -1.99 -1.66 114.58 116.64 1d5a h GLU 658 Ca -0.00 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1d5a h GLU 658 Cb 0.19 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1d5a h GLU 658 CO 0.00 0.44 0.04 1.63 -1.00 0.00 0.00 179.01 180.13 1d5a n LYS 659 N -4.20 4.31 0.00 2.33 5.02 -0.64 -4.00 118.16 120.98 1d5a n LYS 659 Ca -0.01 -2.80 0.00 0.00 -2.02 0.00 0.00 58.31 53.48 1d5a n LYS 659 Cb 0.33 -2.18 0.00 0.00 -0.02 0.00 0.00 35.03 33.16 1d5a n LYS 659 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1d5a n LEU 660 N 0.44 0.53 -4.78 -0.35 4.77 -0.65 -1.94 117.00 115.01 1d5a n LEU 660 Ca 0.27 -0.53 -0.36 0.00 -0.03 0.00 0.00 56.01 55.36 1d5a n LEU 660 Cb 1.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.19 1d5a n LEU 660 CO 0.31 0.13 0.76 -0.69 -1.33 0.00 0.00 177.39 176.57 1d5a s VAL 661 N -0.15 3.54 -0.29 4.08 1.01 -1.02 -4.70 120.40 122.87 1d5a s VAL 661 Ca 0.00 1.15 -0.00 0.00 0.00 0.00 0.00 61.98 63.12 1d5a s VAL 661 Cb 0.00 -3.57 0.09 0.00 0.00 0.00 0.00 36.38 32.90 1d5a s VAL 661 CO 0.00 -0.03 0.07 -0.63 0.00 0.00 0.00 175.10 174.51 1d5a s ILE 662 N -1.66 1.09 -0.73 2.22 1.01 -0.83 -2.90 121.20 119.41 1d5a s ILE 662 Ca 0.61 -1.40 -0.20 0.00 0.00 0.00 0.00 60.65 59.66 1d5a s ILE 662 Cb -0.23 -1.74 0.10 0.00 0.01 0.00 0.00 42.46 40.60 1d5a s ILE 662 CO 0.29 -0.54 0.93 -0.31 0.00 0.00 0.00 174.94 175.31 1d5a s TYR 663 N 1.53 2.95 0.35 3.97 1.51 -1.26 -3.31 117.35 123.08 1d5a s TYR 663 Ca 0.07 -0.98 -0.13 0.00 -1.01 0.00 0.00 57.07 55.01 1d5a s TYR 663 Cb -0.18 -4.19 -0.08 0.00 -0.11 0.00 0.00 41.96 37.40 1d5a s TYR 663 CO -0.19 -1.47 0.75 -2.00 -1.11 0.00 0.00 175.55 171.53 1d5a s GLU 664 N 3.09 3.92 0.00 -0.62 2.12 -0.71 -4.71 118.70 121.80 1d5a s GLU 664 Ca 0.22 0.59 0.00 0.00 0.36 0.00 0.00 54.97 56.14 1d5a s GLU 664 Cb -0.15 -2.42 0.00 0.00 0.26 0.00 0.00 34.13 31.82 1d5a s GLU 664 CO 0.02 0.09 0.00 0.00 -0.54 0.00 0.00 175.26 174.83 1d5a n ALA 665 N -0.71 0.00 0.00 6.30 0.00 -1.16 -2.21 120.51 122.74 1d5a n ALA 665 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1d5a n ALA 665 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1d5a n ALA 665 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d5a n GLY 677 N 0.00 0.10 2.03 0.00 0.00 -1.26 -3.64 105.19 102.42 1d5a n GLY 677 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 1d5a n GLY 677 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1d5a n PRO 678 N 0.00 0.25 0.00 1.61 -0.04 -1.20 -2.07 135.00 133.56 1d5a n PRO 678 Ca 0.00 -0.05 0.12 0.00 -0.04 0.00 0.00 63.50 63.52 1d5a n PRO 678 Cb 0.00 -1.45 0.12 0.00 -0.04 0.00 0.00 33.50 32.13 1d5a n PRO 678 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1d5a n HIS 679 N 2.16 0.00 -4.04 0.54 8.25 -1.26 -4.90 115.22 115.96 1d5a n HIS 679 Ca 0.02 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.15 1d5a n HIS 679 Cb 0.12 -0.04 -0.15 0.00 1.12 0.00 0.00 29.99 31.04 1d5a n HIS 679 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1d5a s VAL 680 N -2.48 2.50 0.00 1.59 1.01 -1.26 -5.05 120.40 116.71 1d5a s VAL 680 Ca 0.21 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1d5a s VAL 680 Cb 0.18 -2.17 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1d5a s VAL 680 CO 0.55 0.37 0.00 0.00 0.00 0.00 0.00 175.10 176.03 1d5a n ALA 681 N 4.64 1.32 0.00 5.51 0.00 -1.26 -4.14 120.51 126.58 1d5a n ALA 681 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1d5a n ALA 681 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1d5a n ALA 681 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d5a n ALA 694 N -1.45 0.00 -2.47 0.00 0.00 -1.26 -4.92 120.51 110.41 1d5a n ALA 694 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1d5a n ALA 694 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1d5a n ALA 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d5a s ALA 695 N -1.49 3.59 -0.57 0.00 0.00 -1.26 -4.34 121.76 117.69 1d5a s ALA 695 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.46 1d5a s ALA 695 Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 23.12 20.76 1d5a s ALA 695 CO 0.00 0.23 0.00 0.00 0.00 0.00 0.00 175.76 175.99 1d5a n ALA 696 N -0.93 -0.16 -2.46 0.00 0.00 -1.26 -5.04 120.51 110.65 1d5a n ALA 696 Ca -0.01 0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.31 1d5a n ALA 696 Cb 0.54 -1.00 -0.11 0.00 0.00 0.00 0.00 19.45 18.88 1d5a n ALA 696 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1d5a s THR 697 N -2.29 1.46 -0.37 0.00 2.01 -1.26 -5.12 115.64 110.06 1d5a s THR 697 Ca 0.00 -1.81 -0.14 0.00 0.31 0.00 0.00 61.69 60.05 1d5a s THR 697 Cb 0.00 -1.65 -0.00 0.00 0.01 0.00 0.00 72.50 70.86 1d5a s THR 697 CO 0.00 -0.42 0.28 -0.69 -0.69 0.00 0.00 174.62 173.10 1d5a s VAL 698 N -2.23 5.26 0.08 3.82 1.01 -1.24 -4.50 120.40 122.61 1d5a s VAL 698 Ca 0.12 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.79 1d5a s VAL 698 Cb -0.04 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 1d5a s VAL 698 CO 0.04 -0.13 -0.04 -0.51 0.00 0.00 0.00 175.10 174.45 1d5a s ILE 699 N 1.74 3.76 -0.04 2.22 2.07 -0.94 -4.89 121.20 125.13 1d5a s ILE 699 Ca 0.06 -1.05 0.07 0.00 -1.41 0.00 0.00 60.65 58.32 1d5a s ILE 699 Cb -0.18 -2.76 -0.02 0.00 0.13 0.00 0.00 42.46 39.63 1d5a s ILE 699 CO 0.11 0.15 -0.25 -0.94 -1.91 0.00 0.00 174.94 172.09 1d5a s SER 700 N -2.16 3.07 0.21 4.50 1.04 -1.26 -1.73 113.70 117.37 1d5a s SER 700 Ca 0.23 -0.48 -0.23 0.00 0.48 0.00 0.00 55.95 55.95 1d5a s SER 700 Cb -0.11 -0.56 0.05 0.00 0.10 0.00 0.00 66.02 65.50 1d5a s SER 700 CO 0.15 0.29 0.89 -0.72 0.98 0.00 0.00 173.24 174.83 1d5a s TYR 701 N -0.42 -0.10 -0.00 5.02 -0.85 -1.21 -3.74 117.35 116.04 1d5a s TYR 701 Ca 0.04 -0.29 -0.00 0.00 -0.52 0.00 0.00 57.07 56.30 1d5a s TYR 701 Cb -0.12 0.68 0.00 0.00 0.38 0.00 0.00 41.96 42.91 1d5a s TYR 701 CO 0.01 -1.02 0.01 -1.50 -1.52 0.00 0.00 175.55 171.53 1d5a s ILE 702 N -3.27 0.00 0.03 -3.49 2.07 -0.63 -1.97 121.20 113.94 1d5a s ILE 702 Ca 0.13 -0.02 -0.30 0.00 -1.41 0.00 0.00 60.65 59.05 1d5a s ILE 702 Cb -0.03 -0.03 -0.04 0.00 0.13 0.00 0.00 42.46 42.49 1d5a s ILE 702 CO 0.05 -0.01 1.06 -0.69 -1.91 0.00 0.00 174.94 173.44 1d5a s VAL 703 N -0.03 4.54 -0.20 4.00 1.01 -1.26 -2.25 120.40 126.20 1d5a s VAL 703 Ca -0.00 1.83 -0.08 0.00 0.00 0.00 0.00 61.98 63.73 1d5a s VAL 703 Cb -0.00 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 1d5a s VAL 703 CO -0.00 0.14 0.07 -0.76 0.00 0.00 0.00 175.10 174.56 1d5a s LEU 704 N 1.01 3.74 -0.80 3.92 1.43 -1.26 -3.18 118.68 123.53 1d5a s LEU 704 Ca 0.54 0.01 -0.25 0.00 -1.03 0.00 0.00 54.13 53.40 1d5a s LEU 704 Cb -0.24 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 1d5a s LEU 704 CO 0.29 0.11 1.97 -0.75 0.23 0.00 0.00 176.35 178.19 1d5a s LYS 705 N 0.75 2.50 0.00 1.70 2.20 0.31 -4.45 119.74 122.75 1d5a s LYS 705 Ca 0.04 0.06 0.00 0.00 -0.36 0.00 0.00 55.97 55.70 1d5a s LYS 705 Cb -0.13 -4.85 0.00 0.00 -1.51 0.00 0.00 37.83 31.34 1d5a s LYS 705 CO 0.02 -3.27 0.00 0.41 -0.36 0.00 0.00 175.35 172.15 1d5a n GLY 706 N 6.51 4.03 3.30 5.54 0.00 -1.26 -4.81 105.19 118.49 1d5a n GLY 706 Ca 0.35 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1d5a n GLY 706 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1d5a n PRO 707 N 0.00 -2.31 -0.83 1.61 -0.04 -1.26 -4.85 135.00 127.31 1d5a n PRO 707 Ca 0.00 -0.66 0.00 0.00 -0.04 0.00 0.00 63.50 62.80 1d5a n PRO 707 Cb 0.00 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 31.63 1d5a n PRO 707 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1d5a n GLY 708 N 1.78 -2.38 0.27 0.55 0.00 -1.26 -4.20 105.19 99.95 1d5a n GLY 708 Ca 0.03 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 1d5a n GLY 708 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1d5a h ARG 709 N 0.00 -0.65 -0.08 1.61 0.11 -1.99 -3.36 114.38 110.02 1d5a h ARG 709 Ca 0.00 0.04 0.01 0.00 0.10 0.00 0.00 59.98 60.13 1d5a h ARG 709 Cb 0.00 0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.22 1d5a h ARG 709 CO 0.00 -0.43 -0.05 0.28 0.10 0.00 0.00 179.97 179.87 1d5a n VAL 710 N -4.13 -0.05 0.00 0.08 0.31 -1.26 -4.76 118.33 108.51 1d5a n VAL 710 Ca -0.08 0.87 0.00 0.00 -0.01 0.00 0.00 64.34 65.11 1d5a n VAL 710 Cb 0.27 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 32.06 1d5a n VAL 710 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d5a n GLY 711 N -1.02 4.56 3.00 2.92 0.00 -1.26 -4.94 105.19 108.45 1d5a n GLY 711 Ca 0.00 -0.66 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 1d5a n GLY 711 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1d5a s ASP 712 N 1.00 -0.19 -0.45 1.61 1.01 -1.25 -4.14 116.67 114.26 1d5a s ASP 712 Ca 0.00 0.41 -0.27 0.00 0.71 0.00 0.00 52.55 53.41 1d5a s ASP 712 Cb 0.00 0.31 -0.07 0.00 1.01 0.00 0.00 42.92 44.17 1d5a s ASP 712 CO 0.00 -0.15 2.39 0.54 0.21 0.00 0.00 175.17 178.16 1d5a n ARG 713 N 4.10 1.19 -1.83 8.23 5.12 -0.88 -3.21 116.66 129.38 1d5a n ARG 713 Ca -0.25 0.10 -0.30 0.00 -1.93 0.00 0.00 57.85 55.47 1d5a n ARG 713 Cb 0.53 -3.37 0.06 0.00 -1.16 0.00 0.00 32.46 28.52 1d5a n ARG 713 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1d5a s ALA 714 N 11.44 2.75 0.10 7.54 0.00 -1.26 -4.30 121.76 138.04 1d5a s ALA 714 Ca 0.99 -0.36 0.03 0.00 0.00 0.00 0.00 51.96 52.63 1d5a s ALA 714 Cb -0.23 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1d5a s ALA 714 CO 0.28 -1.31 -0.09 0.96 0.00 0.00 0.00 175.76 175.60 1d5a s ILE 715 N -3.35 0.92 0.77 0.00 -4.36 -0.96 -4.66 121.20 109.57 1d5a s ILE 715 Ca 0.59 -1.76 -0.15 0.00 -0.26 0.00 0.00 60.65 59.07 1d5a s ILE 715 Cb -0.12 -1.49 -0.01 0.00 1.25 0.00 0.00 42.46 42.10 1d5a s ILE 715 CO 0.52 -0.65 0.63 -2.65 0.24 0.00 0.00 174.94 173.03 1d5a n PRO 716 N 0.33 0.21 0.07 0.37 -0.02 -1.26 -1.61 135.00 133.08 1d5a n PRO 716 Ca -0.14 0.12 0.06 0.00 -2.02 0.00 0.00 63.50 61.52 1d5a n PRO 716 Cb 0.59 -1.95 0.30 0.00 -0.02 0.00 0.00 33.50 32.42 1d5a n PRO 716 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1d5a n PHE 717 N -2.72 0.34 0.03 6.00 7.35 -1.25 -2.85 117.46 124.37 1d5a n PHE 717 Ca 0.10 0.16 -0.02 0.00 -0.76 0.00 0.00 57.45 56.94 1d5a n PHE 717 Cb 0.51 -0.76 -0.01 0.00 0.35 0.00 0.00 39.48 39.56 1d5a n PHE 717 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1d5a h ASP 718 N 0.00 -0.09 0.00 -2.13 3.32 -1.90 -3.30 116.42 112.33 1d5a h ASP 718 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d5a h ASP 718 Cb 0.08 0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1d5a h ASP 718 CO 0.00 0.03 0.00 -0.62 -1.72 0.00 0.00 179.24 176.93 1d5a n GLU 719 N -2.81 0.25 -3.27 3.56 1.02 -1.13 -4.65 120.64 113.61 1d5a n GLU 719 Ca -0.01 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.70 1d5a n GLU 719 Cb 0.04 -1.07 -0.08 0.00 -0.02 0.00 0.00 31.44 30.31 1d5a n GLU 719 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1d5a s PHE 720 N -1.42 3.15 -0.38 -0.32 5.36 -1.20 -4.94 117.98 118.23 1d5a s PHE 720 Ca 0.00 -0.20 -0.08 0.00 -0.96 0.00 0.00 56.93 55.70 1d5a s PHE 720 Cb 0.00 -2.98 0.06 0.00 -0.34 0.00 0.00 43.02 39.75 1d5a s PHE 720 CO 0.00 -0.70 0.18 0.34 -1.46 0.00 0.00 175.22 173.59 1d5a s ASP 721 N 1.84 5.48 0.00 6.13 2.15 -1.26 -4.96 116.67 126.05 1d5a s ASP 721 Ca 0.15 -1.32 0.00 0.00 0.43 0.00 0.00 52.55 51.82 1d5a s ASP 721 Cb -0.16 -1.93 0.00 0.00 -0.30 0.00 0.00 42.92 40.53 1d5a s ASP 721 CO 0.15 -0.43 0.02 -0.81 -0.17 0.00 0.00 175.17 173.93 1d5a n PRO 722 N 4.86 0.02 0.00 4.34 -0.04 -1.26 -0.32 135.00 142.59 1d5a n PRO 722 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1d5a n PRO 722 Cb 0.44 -1.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 1d5a n PRO 722 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d5a n ALA 723 N -0.44 1.47 0.00 0.55 0.00 -1.26 -4.80 120.51 116.02 1d5a n ALA 723 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1d5a n ALA 723 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1d5a n ALA 723 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1d5a n LYS 724 N -0.13 4.63 -4.30 0.00 4.81 0.27 -5.11 118.16 118.32 1d5a n LYS 724 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 1d5a n LYS 724 Cb 0.23 -0.42 -0.09 0.00 0.02 0.00 0.00 35.03 34.77 1d5a n LYS 724 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1d5a s HIS 725 N -0.09 2.94 -0.05 5.64 3.76 0.56 -5.01 115.29 123.03 1d5a s HIS 725 Ca 0.00 -0.02 0.06 0.00 -0.15 0.00 0.00 55.06 54.94 1d5a s HIS 725 Cb 0.00 -1.58 -0.01 0.00 1.11 0.00 0.00 32.58 32.10 1d5a s HIS 725 CO 0.00 0.43 -0.23 1.03 -0.85 0.00 0.00 174.74 175.12 1d5a s ARG 726 N -1.80 2.51 -0.05 1.40 1.81 -1.26 -4.71 118.95 116.85 1d5a s ARG 726 Ca 0.21 -0.87 -0.04 0.00 -1.72 0.00 0.00 55.73 53.30 1d5a s ARG 726 Cb -0.11 -2.19 -0.04 0.00 -0.45 0.00 0.00 34.95 32.15 1d5a s ARG 726 CO 0.12 0.44 0.17 1.52 -0.68 0.00 0.00 175.30 176.86 1d5a s TYR 727 N -0.29 3.57 -0.58 -0.53 -0.85 -1.26 0.11 117.35 117.53 1d5a s TYR 727 Ca 0.00 0.42 -0.26 0.00 -0.52 0.00 0.00 57.07 56.72 1d5a s TYR 727 Cb -0.13 -1.87 -0.05 0.00 0.38 0.00 0.00 41.96 40.30 1d5a s TYR 727 CO 0.03 0.68 2.11 0.34 -1.52 0.00 0.00 175.55 177.19 1d5a s ASP 728 N -1.59 4.87 0.58 -0.18 -1.08 -1.19 -4.38 116.67 113.69 1d5a s ASP 728 Ca 0.23 0.60 0.33 0.00 -0.52 0.00 0.00 52.55 53.19 1d5a s ASP 728 Cb -0.12 -2.52 1.82 0.00 -1.46 0.00 0.00 42.92 40.63 1d5a s ASP 728 CO 0.13 -2.65 2.20 0.00 0.52 0.00 0.00 175.17 175.37 1d5a h ALA 729 N 16.73 1.26 -0.79 3.66 0.00 -1.94 -1.93 119.26 136.25 1d5a h ALA 729 Ca -0.23 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.33 1d5a h ALA 729 Cb 1.20 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.80 1d5a h ALA 729 CO 1.19 0.05 0.37 -1.91 0.00 0.00 0.00 179.25 178.95 1d5a n GLU 730 N -3.51 3.11 -0.00 0.00 2.13 -1.26 -3.44 120.64 117.66 1d5a n GLU 730 Ca -0.02 -3.07 -0.00 0.00 0.66 0.00 0.00 57.16 54.72 1d5a n GLU 730 Cb 0.15 -2.17 -0.00 0.00 0.27 0.00 0.00 31.44 29.69 1d5a n GLU 730 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1d5a n TYR 731 N -0.55 0.00 1.37 4.31 9.36 -0.74 -4.35 117.16 126.56 1d5a n TYR 731 Ca 0.46 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.82 1d5a n TYR 731 Cb 1.45 -0.02 0.53 0.00 -0.63 0.00 0.00 39.34 40.68 1d5a n TYR 731 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1d5a n TYR 732 N -2.31 0.00 -0.08 2.98 4.02 -1.16 -2.41 117.16 118.20 1d5a n TYR 732 Ca -0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.77 1d5a n TYR 732 Cb 0.51 -0.14 -0.07 0.00 -0.02 0.00 0.00 39.34 39.62 1d5a n TYR 732 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1d5a n ILE 733 N -0.77 0.87 -0.06 -0.72 5.41 -1.22 -1.88 119.36 121.00 1d5a n ILE 733 Ca 0.14 -0.33 -0.14 0.00 1.00 0.00 0.00 62.75 63.43 1d5a n ILE 733 Cb 0.30 -1.08 -0.14 0.00 -0.71 0.00 0.00 39.64 38.01 1d5a n ILE 733 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1d5a n GLU 734 N -3.00 0.68 0.00 0.38 4.07 -1.26 -2.26 120.64 119.25 1d5a n GLU 734 Ca -0.27 0.18 0.06 0.00 -0.06 0.00 0.00 57.16 57.07 1d5a n GLU 734 Cb 0.78 -1.65 -0.01 0.00 -0.06 0.00 0.00 31.44 30.50 1d5a n GLU 734 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1d5a n ASN 735 N -3.11 1.23 0.02 4.31 5.15 -1.05 -4.45 115.26 117.35 1d5a n ASN 735 Ca -0.30 -1.11 0.00 0.00 -0.60 0.00 0.00 54.58 52.57 1d5a n ASN 735 Cb 1.07 0.53 0.00 0.00 -0.53 0.00 0.00 39.78 40.85 1d5a n ASN 735 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 1d5a n GLN 736 N -0.34 0.00 -0.12 1.20 -0.06 -1.01 -4.75 117.38 112.30 1d5a n GLN 736 Ca 0.04 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.94 1d5a n GLN 736 Cb 0.24 -0.14 0.03 0.00 -4.06 0.00 0.00 30.24 26.30 1d5a n GLN 736 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1d5a h VAL 737 N 0.00 1.27 0.03 1.69 2.07 -1.53 -3.22 116.25 116.57 1d5a h VAL 737 Ca 0.00 -1.43 -0.00 0.00 0.82 0.00 0.00 66.70 66.09 1d5a h VAL 737 Cb 0.00 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1d5a h VAL 737 CO 0.00 0.48 -0.02 -0.07 0.02 0.00 0.00 177.57 177.99 1d5a h LEU 738 N 0.75 -0.04 -0.89 2.57 3.38 -1.71 -2.98 115.31 116.39 1d5a h LEU 738 Ca 0.09 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1d5a h LEU 738 Cb 0.84 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1d5a h LEU 738 CO 0.07 0.47 0.09 -0.81 0.09 0.00 0.00 178.44 178.35 1d5a n PRO 739 N -4.87 0.09 0.04 1.13 -0.04 -1.25 0.76 135.00 130.86 1d5a n PRO 739 Ca -0.09 0.56 -0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1d5a n PRO 739 Cb 0.26 -1.87 -0.13 0.00 -0.04 0.00 0.00 33.50 31.72 1d5a n PRO 739 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d5a h ALA 740 N 1.75 0.43 -0.00 0.55 0.00 -1.53 -3.39 119.26 117.06 1d5a h ALA 740 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.81 1d5a h ALA 740 Cb 0.17 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1d5a h ALA 740 CO 0.00 1.29 -0.31 1.33 0.00 0.00 0.00 179.25 181.57 1d5a n VAL 741 N -3.31 0.00 -0.13 0.00 0.24 0.84 -4.78 118.33 111.18 1d5a n VAL 741 Ca -0.09 -0.35 -0.03 0.00 -2.04 0.00 0.00 64.34 61.83 1d5a n VAL 741 Cb 1.00 1.00 -0.03 0.00 -1.47 0.00 0.00 33.84 34.34 1d5a n VAL 741 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1d5a n GLU 742 N -1.13 -0.14 -0.33 7.34 1.02 0.23 -2.08 120.64 125.56 1d5a n GLU 742 Ca 0.01 1.10 0.12 0.00 -0.02 0.00 0.00 57.16 58.38 1d5a n GLU 742 Cb 0.10 -1.64 0.30 0.00 -0.02 0.00 0.00 31.44 30.19 1d5a n GLU 742 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1d5a h ARG 743 N 0.00 0.61 0.34 3.49 9.65 -1.85 0.11 114.38 126.73 1d5a h ARG 743 Ca 0.05 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 1d5a h ARG 743 Cb 0.13 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 1d5a h ARG 743 CO -0.29 0.40 -0.16 0.82 2.80 0.00 0.00 179.97 183.54 1d5a h ILE 744 N 0.63 0.48 0.00 1.20 2.04 -1.68 -2.86 117.51 117.32 1d5a h ILE 744 Ca 0.56 -0.71 -0.04 0.00 1.00 0.00 0.00 64.86 65.67 1d5a h ILE 744 Cb 0.92 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 1d5a h ILE 744 CO -0.42 0.10 -0.18 -0.07 0.00 0.00 0.00 178.15 177.59 1d5a h LEU 745 N -0.95 0.00 -0.97 1.44 3.38 -1.38 -1.97 115.31 114.86 1d5a h LEU 745 Ca -0.05 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.83 1d5a h LEU 745 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1d5a h LEU 745 CO 0.08 0.18 -0.30 -0.09 0.09 0.00 0.00 178.44 178.40 1d5a h ARG 746 N 0.00 0.38 0.00 1.13 1.12 -0.91 -1.19 114.38 114.91 1d5a h ARG 746 Ca -0.00 -0.15 0.00 0.00 -1.11 0.00 0.00 59.98 58.72 1d5a h ARG 746 Cb 0.47 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.41 1d5a h ARG 746 CO 0.02 0.64 0.00 0.00 -3.11 0.00 0.00 179.97 177.53 1d5a n ALA 747 N -2.48 1.78 -0.15 2.80 0.00 -0.74 -1.86 120.51 119.85 1d5a n ALA 747 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 53.44 53.42 1d5a n ALA 747 Cb 0.42 -1.26 0.14 0.00 0.00 0.00 0.00 19.45 18.75 1d5a n ALA 747 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1d5a n PHE 748 N -1.45 0.42 0.00 0.00 3.01 -0.60 -4.58 117.46 114.27 1d5a n PHE 748 Ca 0.05 -0.49 0.00 0.00 1.01 0.00 0.00 57.45 58.02 1d5a n PHE 748 Cb 0.18 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 1d5a n PHE 748 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1d5a n GLY 749 N 0.44 0.19 3.83 1.37 0.00 -0.78 -5.09 105.19 105.14 1d5a n GLY 749 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1d5a n GLY 749 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d5a s TYR 750 N -2.00 3.73 0.38 1.61 1.51 -0.55 -4.96 117.35 117.07 1d5a s TYR 750 Ca 0.00 1.08 0.08 0.00 -1.01 0.00 0.00 57.07 57.22 1d5a s TYR 750 Cb 0.00 -2.36 -0.04 0.00 -0.11 0.00 0.00 41.96 39.45 1d5a s TYR 750 CO 0.00 0.60 0.23 1.03 -1.11 0.00 0.00 175.55 176.29 1d5a s ARG 751 N -1.24 2.40 0.55 -0.62 0.52 -1.26 -3.13 118.95 116.17 1d5a s ARG 751 Ca 0.28 -1.62 0.29 0.00 -0.52 0.00 0.00 55.73 54.16 1d5a s ARG 751 Cb -0.17 -2.19 1.46 0.00 0.52 0.00 0.00 34.95 34.56 1d5a s ARG 751 CO 0.16 -0.04 1.93 0.87 0.02 0.00 0.00 175.30 178.25 1d5a h LYS 752 N 1.35 0.00 -0.70 3.54 1.57 -1.98 -0.61 116.57 119.74 1d5a h LYS 752 Ca -0.43 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.33 1d5a h LYS 752 Cb 1.26 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.53 1d5a h LYS 752 CO 0.63 0.00 0.36 0.93 -0.57 0.00 0.00 179.45 180.81 1d5a h GLU 753 N 0.00 0.99 0.00 3.15 5.08 -2.01 -2.19 114.58 119.60 1d5a h GLU 753 Ca 0.30 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1d5a h GLU 753 Cb 1.28 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1d5a h GLU 753 CO -0.00 0.76 0.00 -0.25 -1.00 0.00 0.00 179.01 178.52 1d5a n ASP 754 N -4.47 0.00 -0.04 1.42 8.00 -0.24 -3.39 116.55 117.83 1d5a n ASP 754 Ca 0.06 -0.56 0.01 0.00 0.71 0.00 0.00 54.79 55.00 1d5a n ASP 754 Cb 0.11 -0.12 -0.11 0.00 -0.02 0.00 0.00 41.12 40.97 1d5a n ASP 754 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1d5a n LEU 755 N -1.12 0.00 0.00 0.64 4.77 -0.87 -4.97 117.00 115.45 1d5a n LEU 755 Ca 0.18 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.30 1d5a n LEU 755 Cb 0.15 0.16 0.85 0.00 -2.33 0.00 0.00 43.42 42.25 1d5a n LEU 755 CO 0.18 0.16 1.02 0.54 -1.33 0.00 0.00 177.39 177.96