#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wm1 n LYS 2 N 0.00 0.00 -4.53 2.12 4.76 -1.25 -4.57 118.16 114.69 2wm1 n LYS 2 Ca 0.00 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 2wm1 n LYS 2 Cb 0.00 0.00 -0.11 0.00 -1.84 0.00 0.00 35.03 33.08 2wm1 n LYS 2 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2wm1 s ILE 3 N 0.00 3.71 -0.35 -0.18 1.01 0.33 -0.59 121.20 125.12 2wm1 s ILE 3 Ca 0.00 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.04 2wm1 s ILE 3 Cb 0.00 -2.57 0.10 0.00 0.01 0.00 0.00 42.46 40.00 2wm1 s ILE 3 CO 0.00 0.49 0.08 -0.62 0.00 0.00 0.00 174.94 174.89 2wm1 s ASP 4 N -1.14 4.88 0.09 3.58 -1.08 -0.06 -4.59 116.67 118.35 2wm1 s ASP 4 Ca 0.15 -2.05 0.19 0.00 -0.52 0.00 0.00 52.55 50.32 2wm1 s ASP 4 Cb -0.11 -1.68 0.80 0.00 -1.46 0.00 0.00 42.92 40.47 2wm1 s ASP 4 CO 0.05 -0.41 1.60 0.00 0.52 0.00 0.00 175.17 176.93 2wm1 n ILE 5 N 4.36 0.84 -3.71 4.11 0.13 -0.72 -1.36 119.36 123.01 2wm1 n ILE 5 Ca 0.01 0.19 -0.30 0.00 -1.10 0.00 0.00 62.75 61.56 2wm1 n ILE 5 Cb 0.42 -0.98 -0.14 0.00 -0.84 0.00 0.00 39.64 38.10 2wm1 n ILE 5 CO 0.00 0.00 0.00 -2.28 2.80 0.00 0.00 176.55 177.07 2wm1 s HIS 6 N -3.10 1.85 -0.04 9.51 2.46 -1.26 -4.68 115.29 120.03 2wm1 s HIS 6 Ca 0.07 -2.13 -0.17 0.00 0.47 0.00 0.00 55.06 53.30 2wm1 s HIS 6 Cb 0.10 -1.79 0.03 0.00 -0.13 0.00 0.00 32.58 30.79 2wm1 s HIS 6 CO 0.34 -0.83 0.38 -1.54 -2.47 0.00 0.00 174.74 170.62 2wm1 s SER 7 N 0.91 -0.29 0.03 9.88 1.04 -1.21 0.05 113.70 124.11 2wm1 s SER 7 Ca 0.14 0.28 0.08 0.00 0.48 0.00 0.00 55.95 56.93 2wm1 s SER 7 Cb -0.21 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.30 2wm1 s SER 7 CO -0.10 -0.43 -0.23 -1.00 0.98 0.00 0.00 173.24 172.46 2wm1 s HIS 8 N -1.10 2.03 0.03 5.02 3.76 -0.41 -2.06 115.29 122.57 2wm1 s HIS 8 Ca -0.11 -0.39 -0.14 0.00 -0.15 0.00 0.00 55.06 54.27 2wm1 s HIS 8 Cb -0.04 -1.24 0.02 0.00 1.11 0.00 0.00 32.58 32.43 2wm1 s HIS 8 CO 0.05 0.08 0.30 -1.50 -0.85 0.00 0.00 174.74 172.81 2wm1 s ILE 9 N -0.74 0.08 0.22 0.60 2.07 -0.14 -4.37 121.20 118.92 2wm1 s ILE 9 Ca 0.09 -0.65 0.08 0.00 -1.41 0.00 0.00 60.65 58.76 2wm1 s ILE 9 Cb -0.09 -0.87 -0.05 0.00 0.13 0.00 0.00 42.46 41.58 2wm1 s ILE 9 CO 0.01 -0.36 -0.13 -0.76 -1.91 0.00 0.00 174.94 171.79 2wm1 s LEU 10 N -1.90 2.54 0.51 8.50 1.43 -0.46 -3.79 118.68 125.51 2wm1 s LEU 10 Ca -0.07 -1.05 -0.23 0.00 -1.03 0.00 0.00 54.13 51.75 2wm1 s LEU 10 Cb -0.02 -0.70 -0.06 0.00 0.03 0.00 0.00 46.19 45.45 2wm1 s LEU 10 CO -0.02 -0.18 1.38 -2.84 0.23 0.00 0.00 176.35 174.92 2wm1 s PRO 11 N -3.65 3.33 0.12 1.29 0.02 -1.26 -4.41 135.00 130.43 2wm1 s PRO 11 Ca 0.24 2.30 -0.23 0.00 0.02 0.00 0.00 61.00 63.33 2wm1 s PRO 11 Cb -0.00 -2.39 -0.05 0.00 0.02 0.00 0.00 34.50 32.07 2wm1 s PRO 11 CO 0.08 -1.06 1.19 0.36 -0.33 0.00 0.00 177.00 177.24 2wm1 n LYS 12 N -0.74 -0.33 -3.91 5.54 2.85 -1.26 -4.74 118.16 115.57 2wm1 n LYS 12 Ca 0.09 1.16 -0.09 0.00 -1.05 0.00 0.00 58.31 58.42 2wm1 n LYS 12 Cb 0.44 -1.71 -0.09 0.00 -0.65 0.00 0.00 35.03 33.02 2wm1 n LYS 12 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2wm1 s GLU 13 N -5.31 0.68 0.14 -1.58 2.02 -1.26 -5.00 118.70 108.39 2wm1 s GLU 13 Ca -0.09 -0.83 -0.03 0.00 0.02 0.00 0.00 54.97 54.04 2wm1 s GLU 13 Cb 0.08 0.27 -0.03 0.00 0.10 0.00 0.00 34.13 34.55 2wm1 s GLU 13 CO 0.47 -0.18 0.12 1.67 0.02 0.00 0.00 175.26 177.35 2wm1 s TRP 14 N -3.06 0.74 1.00 1.61 -2.14 -1.26 -5.13 118.94 110.71 2wm1 s TRP 14 Ca -0.01 -1.11 -0.13 0.00 2.66 0.00 0.00 56.10 57.51 2wm1 s TRP 14 Cb 0.01 -0.37 0.11 0.00 -3.10 0.00 0.00 33.47 30.13 2wm1 s TRP 14 CO -0.07 -0.58 0.60 -2.30 -2.66 0.00 0.00 176.95 171.94 2wm1 n PRO 15 N -0.13 -0.82 -1.94 3.25 -0.02 -1.26 -4.92 135.00 129.16 2wm1 n PRO 15 Ca -0.06 -0.20 -0.40 0.00 -2.02 0.00 0.00 63.50 60.83 2wm1 n PRO 15 Cb 0.64 -2.00 -0.03 0.00 -0.02 0.00 0.00 33.50 32.09 2wm1 n PRO 15 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2wm1 s ASP 16 N -2.19 5.41 0.27 2.55 -1.08 -1.26 -4.89 116.67 115.48 2wm1 s ASP 16 Ca 0.61 0.88 0.09 0.00 -0.52 0.00 0.00 52.55 53.61 2wm1 s ASP 16 Cb -0.21 -2.52 0.37 0.00 -1.46 0.00 0.00 42.92 39.10 2wm1 s ASP 16 CO 0.65 -2.17 1.62 -0.07 0.52 0.00 0.00 175.17 175.72 2wm1 h LEU 17 N 15.73 0.06 -0.57 -1.34 3.38 -1.91 -1.07 115.31 129.59 2wm1 h LEU 17 Ca -0.29 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 2wm1 h LEU 17 Cb 1.18 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2wm1 h LEU 17 CO 1.13 0.64 0.36 0.50 0.09 0.00 0.00 178.44 181.15 2wm1 h LYS 18 N 0.04 0.77 -0.35 1.13 3.64 -1.90 -0.43 116.57 119.47 2wm1 h LYS 18 Ca -0.01 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.21 2wm1 h LYS 18 Cb 1.05 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 2wm1 h LYS 18 CO 0.08 0.54 -0.18 0.87 -2.27 0.00 0.00 179.45 178.49 2wm1 h LYS 19 N 0.78 0.74 -0.81 1.90 1.57 -1.78 0.20 116.57 119.16 2wm1 h LYS 19 Ca 0.21 -0.33 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 2wm1 h LYS 19 Cb -0.04 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 2wm1 h LYS 19 CO -0.04 0.94 0.47 -0.09 -0.57 0.00 0.00 179.45 180.16 2wm1 h ARG 20 N 0.52 1.11 0.00 3.15 2.43 -0.91 -3.33 114.38 117.35 2wm1 h ARG 20 Ca 0.08 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2wm1 h ARG 20 Cb 0.72 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2wm1 h ARG 20 CO 0.05 0.79 -1.35 1.19 -1.51 0.00 0.00 179.97 179.14 2wm1 n PHE 21 N -4.36 0.00 -0.32 2.20 0.99 -0.20 -5.03 117.46 110.74 2wm1 n PHE 21 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.54 2wm1 n PHE 21 Cb 0.08 -0.20 0.00 0.00 -1.00 0.00 0.00 39.48 38.36 2wm1 n PHE 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2wm1 n GLY 22 N 1.90 0.82 3.49 1.37 0.00 0.69 -5.07 105.19 108.39 2wm1 n GLY 22 Ca -0.01 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 2wm1 n GLY 22 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wm1 s TYR 23 N -2.00 -0.58 0.00 1.61 -0.85 -1.16 -5.04 117.35 109.32 2wm1 s TYR 23 Ca 0.00 0.78 0.00 0.00 -0.52 0.00 0.00 57.07 57.33 2wm1 s TYR 23 Cb 0.00 0.47 0.00 0.00 0.38 0.00 0.00 41.96 42.81 2wm1 s TYR 23 CO 0.00 -0.67 0.00 0.41 -1.52 0.00 0.00 175.55 173.77 2wm1 n GLY 24 N 0.41 -0.69 0.00 5.49 0.00 -1.26 -4.33 105.19 104.82 2wm1 n GLY 24 Ca -0.17 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.12 2wm1 n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm1 n GLY 25 N 5.00 0.43 3.95 -0.02 0.00 -1.26 -5.01 105.19 108.28 2wm1 n GLY 25 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2wm1 n GLY 25 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2wm1 s TRP 26 N -2.00 3.06 0.16 1.61 0.52 -1.26 -4.85 118.94 116.19 2wm1 s TRP 26 Ca 0.00 0.26 0.05 0.00 0.02 0.00 0.00 56.10 56.42 2wm1 s TRP 26 Cb 0.00 -2.67 -0.04 0.00 -1.15 0.00 0.00 33.47 29.61 2wm1 s TRP 26 CO 0.00 -0.77 0.15 0.54 0.02 0.00 0.00 176.95 176.89 2wm1 s VAL 27 N -2.81 4.55 0.04 4.03 0.11 -1.26 -3.71 120.40 121.37 2wm1 s VAL 27 Ca 0.54 -1.04 -0.03 0.00 -2.93 0.00 0.00 61.98 58.52 2wm1 s VAL 27 Cb -0.10 -3.32 -0.03 0.00 -1.53 0.00 0.00 36.38 31.40 2wm1 s VAL 27 CO 0.40 -0.10 0.02 -1.10 -3.33 0.00 0.00 175.10 170.99 2wm1 s GLN 28 N -3.10 0.57 -0.14 1.54 -1.52 -0.56 -4.86 119.66 111.59 2wm1 s GLN 28 Ca 0.31 -0.97 -0.02 0.00 -1.95 0.00 0.00 55.36 52.73 2wm1 s GLN 28 Cb -0.10 0.21 -0.02 0.00 -0.22 0.00 0.00 33.01 32.88 2wm1 s GLN 28 CO 0.24 -0.12 -0.09 -1.17 -0.25 0.00 0.00 175.29 173.90 2wm1 s LEU 29 N -2.45 2.96 -0.19 2.90 2.96 -1.26 -1.26 118.68 122.35 2wm1 s LEU 29 Ca -0.00 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.68 2wm1 s LEU 29 Cb 0.02 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 45.06 2wm1 s LEU 29 CO -0.07 0.17 -0.12 -1.10 -1.32 0.00 0.00 176.35 173.91 2wm1 s GLN 30 N 0.36 2.16 -0.74 1.98 -1.52 0.12 -4.93 119.66 117.10 2wm1 s GLN 30 Ca -0.08 -0.78 -0.25 0.00 -1.95 0.00 0.00 55.36 52.30 2wm1 s GLN 30 Cb -0.15 -2.36 0.05 0.00 -0.22 0.00 0.00 33.01 30.33 2wm1 s GLN 30 CO 0.04 -0.37 1.19 -1.01 -0.25 0.00 0.00 175.29 174.89 2wm1 s HIS 31 N 1.40 2.44 -0.06 0.91 3.76 -1.26 -0.75 115.29 121.74 2wm1 s HIS 31 Ca 0.01 -0.29 0.07 0.00 -0.15 0.00 0.00 55.06 54.69 2wm1 s HIS 31 Cb -0.15 -4.52 -0.24 0.00 1.11 0.00 0.00 32.58 28.78 2wm1 s HIS 31 CO -0.09 -1.92 0.61 1.12 -0.85 0.00 0.00 174.74 173.61 2wm1 h HIS 32 N 9.84 0.13 -3.85 1.40 2.07 -1.90 -3.49 115.15 119.34 2wm1 h HIS 32 Ca -0.24 -0.09 -0.09 0.00 -2.85 0.00 0.00 60.37 57.09 2wm1 h HIS 32 Cb 1.05 -0.01 -0.14 0.00 2.57 0.00 0.00 27.41 30.89 2wm1 h HIS 32 CO 1.09 1.20 -0.39 0.45 -3.07 0.00 0.00 177.93 177.21 2wm1 s SER 33 N -6.35 0.14 0.11 3.10 0.15 -1.19 -5.06 113.70 104.59 2wm1 s SER 33 Ca -0.09 -0.71 -0.31 0.00 0.70 0.00 0.00 55.95 55.54 2wm1 s SER 33 Cb 0.08 0.34 -0.09 0.00 -1.71 0.00 0.00 66.02 64.63 2wm1 s SER 33 CO 0.81 -0.74 1.69 -0.54 1.20 0.00 0.00 173.24 175.66 2wm1 s LYS 34 N -3.88 4.18 -1.56 5.44 -0.14 -1.26 -0.96 119.74 121.55 2wm1 s LYS 34 Ca 0.07 2.42 0.00 0.00 -1.36 0.00 0.00 55.97 57.10 2wm1 s LYS 34 Cb 0.05 -3.49 0.00 0.00 -1.68 0.00 0.00 37.83 32.71 2wm1 s LYS 34 CO -0.09 -0.74 0.00 0.41 -0.76 0.00 0.00 175.35 174.17 2wm1 n GLY 35 N 4.01 1.31 2.95 -3.33 0.00 -1.26 -5.00 105.19 103.87 2wm1 n GLY 35 Ca 0.16 -0.30 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 2wm1 n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wm1 s GLU 36 N -3.48 0.12 0.04 1.61 2.02 -0.14 -1.97 118.70 116.91 2wm1 s GLU 36 Ca 0.00 -0.04 -0.09 0.00 0.02 0.00 0.00 54.97 54.86 2wm1 s GLU 36 Cb 0.00 0.05 0.00 0.00 0.10 0.00 0.00 34.13 34.28 2wm1 s GLU 36 CO 0.00 -0.02 0.17 0.00 0.02 0.00 0.00 175.26 175.43 2wm1 s ALA 37 N -0.25 -0.31 -0.09 5.21 0.00 -0.70 -2.98 121.76 122.64 2wm1 s ALA 37 Ca -0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 51.96 51.59 2wm1 s ALA 37 Cb -0.02 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 2wm1 s ALA 37 CO 0.00 -0.34 -0.02 0.15 0.00 0.00 0.00 175.76 175.55 2wm1 s LYS 38 N -2.50 3.06 -0.16 0.00 1.02 0.07 -1.24 119.74 120.00 2wm1 s LYS 38 Ca -0.06 -0.45 -0.15 0.00 0.02 0.00 0.00 55.97 55.34 2wm1 s LYS 38 Cb -0.01 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2wm1 s LYS 38 CO -0.04 0.62 0.33 -0.51 -0.92 0.00 0.00 175.35 174.83 2wm1 s LEU 39 N -0.65 4.23 0.10 3.17 1.43 -0.18 0.10 118.68 126.88 2wm1 s LEU 39 Ca 0.10 0.55 0.06 0.00 -1.03 0.00 0.00 54.13 53.81 2wm1 s LEU 39 Cb -0.12 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.64 2wm1 s LEU 39 CO 0.02 0.06 -0.16 -1.48 0.23 0.00 0.00 176.35 175.03 2wm1 s LEU 40 N 0.61 2.33 -0.28 1.79 2.34 -0.39 -1.11 118.68 123.97 2wm1 s LEU 40 Ca 0.18 -0.70 0.03 0.00 0.06 0.00 0.00 54.13 53.69 2wm1 s LEU 40 Cb -0.13 -0.62 0.07 0.00 -0.56 0.00 0.00 46.19 44.95 2wm1 s LEU 40 CO 0.05 -0.07 -0.04 -0.75 -1.06 0.00 0.00 176.35 174.48 2wm1 s LYS 41 N -2.11 1.81 0.00 1.48 2.20 -0.83 -1.49 119.74 120.79 2wm1 s LYS 41 Ca 0.04 -1.39 0.00 0.00 -0.36 0.00 0.00 55.97 54.26 2wm1 s LYS 41 Cb -0.08 -2.86 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 2wm1 s LYS 41 CO 0.03 -0.70 0.00 -0.25 -0.36 0.00 0.00 175.35 174.07 2wm1 n ASP 42 N 4.46 -6.62 0.00 1.43 9.92 -1.24 -3.60 116.55 120.90 2wm1 n ASP 42 Ca -0.08 0.74 0.00 0.00 -0.53 0.00 0.00 54.79 54.92 2wm1 n ASP 42 Cb 0.42 -1.38 0.00 0.00 -0.64 0.00 0.00 41.12 39.52 2wm1 n ASP 42 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wm1 n GLY 43 N 2.10 1.37 3.70 0.44 0.00 -1.26 -4.92 105.19 106.62 2wm1 n GLY 43 Ca 0.00 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2wm1 n GLY 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wm1 n LYS 44 N 0.00 2.70 -1.96 1.61 5.02 -1.24 -4.87 118.16 119.42 2wm1 n LYS 44 Ca 0.00 0.98 -0.42 0.00 -2.02 0.00 0.00 58.31 56.85 2wm1 n LYS 44 Cb 0.00 -2.84 -0.03 0.00 -0.02 0.00 0.00 35.03 32.14 2wm1 n LYS 44 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wm1 s VAL 45 N 2.04 3.34 -0.30 -0.18 1.01 -1.26 -1.97 120.40 123.09 2wm1 s VAL 45 Ca 0.80 0.58 0.03 0.00 0.00 0.00 0.00 61.98 63.39 2wm1 s VAL 45 Cb -0.52 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 32.50 2wm1 s VAL 45 CO 0.36 -0.03 0.52 2.22 0.00 0.00 0.00 175.10 178.17 2wm1 n PHE 46 N 6.52 0.00 -3.61 5.22 1.16 -0.27 -4.99 117.46 121.49 2wm1 n PHE 46 Ca 0.17 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.64 2wm1 n PHE 46 Cb 0.42 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.22 2wm1 n PHE 46 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 2wm1 s ARG 47 N -0.34 0.63 -0.13 3.97 3.52 -1.18 -5.01 118.95 120.41 2wm1 s ARG 47 Ca 0.03 0.52 -0.01 0.00 -0.13 0.00 0.00 55.73 56.14 2wm1 s ARG 47 Cb 0.02 0.30 -0.02 0.00 -1.56 0.00 0.00 34.95 33.69 2wm1 s ARG 47 CO 0.04 -0.12 -0.10 0.08 -0.81 0.00 0.00 175.30 174.39 2wm1 s VAL 48 N -0.19 3.32 0.21 7.11 1.01 -1.26 -1.01 120.40 129.59 2wm1 s VAL 48 Ca 0.00 -0.57 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2wm1 s VAL 48 Cb -0.03 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 2wm1 s VAL 48 CO -0.02 0.52 -0.12 0.68 0.00 0.00 0.00 175.10 176.17 2wm1 s VAL 49 N 0.23 1.61 0.37 2.92 -7.23 -0.37 -5.01 120.40 112.92 2wm1 s VAL 49 Ca -0.07 -2.17 0.07 0.00 -1.81 0.00 0.00 61.98 58.01 2wm1 s VAL 49 Cb -0.15 -2.08 -0.01 0.00 0.56 0.00 0.00 36.38 34.70 2wm1 s VAL 49 CO 0.04 -0.57 0.46 -0.13 -0.31 0.00 0.00 175.10 174.59 2wm1 s ARG 50 N -3.68 2.90 0.32 4.82 0.52 -1.26 -1.72 118.95 120.85 2wm1 s ARG 50 Ca 0.23 -1.18 0.06 0.00 -0.52 0.00 0.00 55.73 54.32 2wm1 s ARG 50 Cb 0.01 -2.69 0.88 0.00 0.52 0.00 0.00 34.95 33.66 2wm1 s ARG 50 CO 0.07 -0.05 1.54 -1.91 0.02 0.00 0.00 175.30 174.97 2wm1 n GLU 51 N -1.64 -0.07 0.00 3.54 2.13 -0.83 -1.39 120.64 122.37 2wm1 n GLU 51 Ca 0.02 1.45 0.03 0.00 0.66 0.00 0.00 57.16 59.31 2wm1 n GLU 51 Cb 0.59 -2.36 0.13 0.00 0.27 0.00 0.00 31.44 30.07 2wm1 n GLU 51 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2wm1 n ASN 52 N -5.42 0.00 0.11 4.31 6.94 -1.26 -1.11 115.26 118.84 2wm1 n ASN 52 Ca 0.26 0.14 0.12 0.00 -0.02 0.00 0.00 54.58 55.08 2wm1 n ASN 52 Cb 0.87 -0.23 0.19 0.00 -2.36 0.00 0.00 39.78 38.26 2wm1 n ASN 52 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wm1 n TRP 54 N -2.46 0.00 -3.32 0.00 4.27 -0.26 -1.36 117.44 114.31 2wm1 n TRP 54 Ca 0.03 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.21 2wm1 n TRP 54 Cb 0.48 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.35 2wm1 n TRP 54 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 2wm1 s ASP 55 N -0.55 6.18 0.35 -0.67 -1.08 -0.58 -4.63 116.67 115.69 2wm1 s ASP 55 Ca 0.00 -0.90 0.02 0.00 -0.52 0.00 0.00 52.55 51.16 2wm1 s ASP 55 Cb 0.00 -2.22 0.65 0.00 -1.46 0.00 0.00 42.92 39.89 2wm1 s ASP 55 CO 0.00 -0.64 2.01 -0.65 0.52 0.00 0.00 175.17 176.41 2wm1 h PRO 56 N 8.77 0.81 -0.35 4.34 0.11 -1.92 -1.61 132.00 142.15 2wm1 h PRO 56 Ca -0.27 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.81 2wm1 h PRO 56 Cb 1.11 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.01 2wm1 h PRO 56 CO 0.84 0.54 0.19 0.93 -0.21 0.00 0.00 178.00 180.29 2wm1 h GLU 57 N 0.84 0.38 -0.74 1.05 5.08 -1.99 0.14 114.58 119.35 2wm1 h GLU 57 Ca 0.22 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2wm1 h GLU 57 Cb -0.09 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.04 2wm1 h GLU 57 CO -0.05 0.25 0.45 0.28 -1.00 0.00 0.00 179.01 178.95 2wm1 h VAL 58 N 0.40 1.21 -0.24 3.13 2.07 -1.75 -2.42 116.25 118.64 2wm1 h VAL 58 Ca 0.14 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 2wm1 h VAL 58 Cb 0.03 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2wm1 h VAL 58 CO -0.08 0.21 0.08 0.03 0.02 0.00 0.00 177.57 177.83 2wm1 h ARG 59 N 1.01 0.37 -0.91 1.57 3.08 -0.97 -2.19 114.38 116.35 2wm1 h ARG 59 Ca 0.27 -0.08 0.07 0.00 0.07 0.00 0.00 59.98 60.31 2wm1 h ARG 59 Cb -0.05 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 29.89 2wm1 h ARG 59 CO -0.05 0.44 0.59 0.82 -1.07 0.00 0.00 179.97 180.71 2wm1 h ILE 60 N 0.22 1.06 -0.34 2.04 5.03 -0.56 0.14 117.51 125.11 2wm1 h ILE 60 Ca 0.08 -0.35 -0.06 0.00 -0.12 0.00 0.00 64.86 64.41 2wm1 h ILE 60 Cb 0.22 -0.06 -0.01 0.00 -3.03 0.00 0.00 36.82 33.94 2wm1 h ILE 60 CO -0.00 0.19 -0.02 -0.09 -0.68 0.00 0.00 178.15 177.55 2wm1 h ARG 61 N 1.03 0.62 -0.23 2.37 2.43 -1.22 -1.07 114.38 118.30 2wm1 h ARG 61 Ca 0.40 -0.20 -0.11 0.00 -0.81 0.00 0.00 59.98 59.25 2wm1 h ARG 61 Cb 0.21 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2wm1 h ARG 61 CO -0.15 0.75 -0.31 0.93 -1.51 0.00 0.00 179.97 179.67 2wm1 h GLU 62 N 0.42 0.48 -0.61 0.20 5.08 -0.97 -1.61 114.58 117.57 2wm1 h GLU 62 Ca 0.10 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2wm1 h GLU 62 Cb 0.48 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2wm1 h GLU 62 CO 0.02 0.74 0.29 0.52 -1.00 0.00 0.00 179.01 179.58 2wm1 h MET 63 N 0.42 0.88 -0.17 2.33 2.86 -0.61 -2.69 114.93 117.94 2wm1 h MET 63 Ca 0.05 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2wm1 h MET 63 Cb 0.76 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 2wm1 h MET 63 CO 0.06 0.71 0.11 -0.44 1.06 0.00 0.00 176.91 178.41 2wm1 h ASP 64 N 0.84 0.20 -0.59 1.22 3.32 -0.90 0.14 116.42 120.65 2wm1 h ASP 64 Ca 0.21 -0.03 0.14 0.00 0.02 0.00 0.00 57.03 57.38 2wm1 h ASP 64 Cb 0.13 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 2wm1 h ASP 64 CO -0.03 0.17 0.41 1.56 -1.72 0.00 0.00 179.24 179.63 2wm1 h GLN 65 N 0.21 0.16 -0.01 3.56 4.20 -1.25 -2.51 115.11 119.46 2wm1 h GLN 65 Ca 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2wm1 h GLN 65 Cb 0.00 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2wm1 h GLN 65 CO -0.01 0.10 -0.34 1.63 -0.67 0.00 0.00 178.83 179.54 2wm1 n LYS 66 N -4.42 1.54 -1.39 1.46 4.76 -0.77 -4.98 118.16 114.36 2wm1 n LYS 66 Ca 0.11 -0.98 0.00 0.00 -2.87 0.00 0.00 58.31 54.56 2wm1 n LYS 66 Cb 0.55 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 32.39 2wm1 n LYS 66 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wm1 n GLY 67 N 1.23 0.49 3.63 0.72 0.00 0.29 -4.75 105.19 106.81 2wm1 n GLY 67 Ca 0.08 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 2wm1 n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wm1 s VAL 68 N -2.00 5.28 -0.15 1.61 1.01 -0.09 -3.97 120.40 122.10 2wm1 s VAL 68 Ca 0.00 0.36 -0.20 0.00 0.00 0.00 0.00 61.98 62.14 2wm1 s VAL 68 Cb 0.00 -3.59 -0.17 0.00 0.00 0.00 0.00 36.38 32.62 2wm1 s VAL 68 CO 0.00 0.27 0.41 0.74 0.00 0.00 0.00 175.10 176.51 2wm1 h THR 69 N 5.18 1.08 -3.98 3.92 2.02 -1.11 -3.40 112.91 116.62 2wm1 h THR 69 Ca -0.36 -1.92 -0.46 0.00 0.77 0.00 0.00 66.41 64.44 2wm1 h THR 69 Cb 1.17 2.15 -0.30 0.00 -1.74 0.00 0.00 68.15 69.43 2wm1 h THR 69 CO 0.64 0.37 -0.80 0.68 0.37 0.00 0.00 175.52 176.78 2wm1 s VAL 70 N -2.12 0.97 -0.17 3.16 -7.23 -1.08 -4.40 120.40 109.52 2wm1 s VAL 70 Ca -0.17 -0.49 -0.07 0.00 -1.81 0.00 0.00 61.98 59.44 2wm1 s VAL 70 Cb 0.00 -0.83 -0.04 0.00 0.56 0.00 0.00 36.38 36.07 2wm1 s VAL 70 CO 0.49 0.28 0.07 -1.10 -0.31 0.00 0.00 175.10 174.53 2wm1 s GLN 71 N -0.05 3.84 -0.29 4.82 -0.21 -0.04 -0.88 119.66 126.85 2wm1 s GLN 71 Ca 0.00 -0.32 -0.29 0.00 0.02 0.00 0.00 55.36 54.78 2wm1 s GLN 71 Cb -0.07 -3.18 0.01 0.00 1.00 0.00 0.00 33.01 30.77 2wm1 s GLN 71 CO 0.00 0.37 1.05 0.00 -2.12 0.00 0.00 175.29 174.60 2wm1 s ALA 72 N 0.09 3.57 -0.14 6.09 0.00 -0.46 -2.15 121.76 128.75 2wm1 s ALA 72 Ca 0.06 0.01 -0.16 0.00 0.00 0.00 0.00 51.96 51.87 2wm1 s ALA 72 Cb -0.12 -3.62 -0.04 0.00 0.00 0.00 0.00 23.12 19.34 2wm1 s ALA 72 CO 0.01 -1.32 0.38 -0.51 0.00 0.00 0.00 175.76 174.31 2wm1 s LEU 73 N 3.47 4.26 0.12 0.00 1.43 0.35 -3.35 118.68 124.96 2wm1 s LEU 73 Ca 0.44 0.65 0.01 0.00 -1.03 0.00 0.00 54.13 54.21 2wm1 s LEU 73 Cb -0.13 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 2wm1 s LEU 73 CO 0.12 0.06 -0.03 -0.94 0.23 0.00 0.00 176.35 175.79 2wm1 s SER 74 N 0.52 0.98 0.95 2.29 1.04 -0.87 -0.78 113.70 117.83 2wm1 s SER 74 Ca 0.21 -1.07 -0.12 0.00 0.48 0.00 0.00 55.95 55.45 2wm1 s SER 74 Cb -0.14 0.14 0.16 0.00 0.10 0.00 0.00 66.02 66.27 2wm1 s SER 74 CO 0.07 -0.54 1.10 0.28 0.98 0.00 0.00 173.24 175.13 2wm1 s THR 75 N -3.72 2.26 0.05 2.02 -1.32 -1.26 -0.97 115.64 112.71 2wm1 s THR 75 Ca 0.16 0.08 -0.31 0.00 -1.21 0.00 0.00 61.69 60.42 2wm1 s THR 75 Cb 0.06 -2.64 -0.06 0.00 -1.51 0.00 0.00 72.50 68.34 2wm1 s THR 75 CO -0.02 -0.11 1.37 -0.69 -2.21 0.00 0.00 174.62 172.96 2wm1 s VAL 76 N -3.03 3.59 0.57 5.08 1.01 -1.25 -4.63 120.40 121.74 2wm1 s VAL 76 Ca 0.64 1.07 0.28 0.00 0.00 0.00 0.00 61.98 63.97 2wm1 s VAL 76 Cb -0.17 -3.69 0.38 0.00 0.00 0.00 0.00 36.38 32.90 2wm1 s VAL 76 CO 0.56 0.04 2.00 -0.65 0.00 0.00 0.00 175.10 177.05 2wm1 h PRO 77 N 7.31 0.00 0.00 2.72 0.11 -1.95 0.44 132.00 140.63 2wm1 h PRO 77 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2wm1 h PRO 77 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2wm1 h PRO 77 CO 0.88 0.00 0.00 -0.24 -0.21 0.00 0.00 178.00 178.43 2wm1 h VAL 78 N 0.00 0.00 0.00 3.15 3.04 -1.98 0.43 116.25 120.89 2wm1 h VAL 78 Ca 0.19 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.67 2wm1 h VAL 78 Cb 0.90 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 31.38 2wm1 h VAL 78 CO -0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.57 176.79 2wm1 n MET 79 N -3.08 0.09 -0.25 4.17 2.81 0.14 -4.15 117.12 116.86 2wm1 n MET 79 Ca -0.02 0.20 0.02 0.00 -1.81 0.00 0.00 57.70 56.09 2wm1 n MET 79 Cb 0.16 -1.64 0.09 0.00 -0.71 0.00 0.00 33.22 31.13 2wm1 n MET 79 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 2wm1 h PHE 80 N 0.00 -0.32 -5.88 2.03 0.04 -1.07 -3.46 116.94 108.29 2wm1 h PHE 80 Ca 0.00 0.06 -0.40 0.00 2.80 0.00 0.00 57.97 60.44 2wm1 h PHE 80 Cb 0.45 0.25 0.12 0.00 2.20 0.00 0.00 35.95 38.97 2wm1 h PHE 80 CO 0.00 -0.30 -0.71 0.43 -0.60 0.00 0.00 178.31 177.13 2wm1 n SER 81 N -5.45 -5.25 0.21 2.17 7.64 -1.26 -4.88 113.62 106.81 2wm1 n SER 81 Ca 0.10 -0.59 0.15 0.00 1.01 0.00 0.00 58.87 59.54 2wm1 n SER 81 Cb 0.38 -4.88 0.60 0.00 -1.01 0.00 0.00 64.21 59.30 2wm1 n SER 81 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 2wm1 h TYR 82 N -2.47 0.00 0.00 1.43 0.05 -1.94 -2.79 116.97 111.26 2wm1 h TYR 82 Ca -0.58 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.20 2wm1 h TYR 82 Cb 1.36 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.10 2wm1 h TYR 82 CO 0.50 0.00 0.00 0.11 -1.05 0.00 0.00 178.16 177.72 2wm1 h TRP 83 N 0.00 0.00 -3.80 4.88 5.08 -2.00 -3.43 115.95 116.68 2wm1 h TRP 83 Ca 0.00 0.00 -0.29 0.00 1.08 0.00 0.00 58.89 59.68 2wm1 h TRP 83 Cb 0.44 0.00 0.09 0.00 -3.00 0.00 0.00 29.16 26.69 2wm1 h TRP 83 CO 0.00 0.00 0.20 0.00 -1.28 0.00 0.00 178.44 177.36 2wm1 n ALA 84 N -1.96 -0.59 -1.77 0.11 0.00 -1.05 -5.01 120.51 110.24 2wm1 n ALA 84 Ca 0.03 -1.21 -0.40 0.00 0.00 0.00 0.00 53.44 51.86 2wm1 n ALA 84 Cb 0.36 0.04 -0.00 0.00 0.00 0.00 0.00 19.45 19.85 2wm1 n ALA 84 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wm1 s LYS 85 N -4.66 3.99 0.28 0.00 1.02 -1.26 -4.87 119.74 114.25 2wm1 s LYS 85 Ca 0.48 2.23 0.00 0.00 0.02 0.00 0.00 55.97 58.71 2wm1 s LYS 85 Cb -0.02 -2.80 0.52 0.00 -0.52 0.00 0.00 37.83 35.01 2wm1 s LYS 85 CO 0.33 -0.50 1.84 -1.35 -0.92 0.00 0.00 175.35 174.75 2wm1 h PRO 86 N 2.75 0.97 -0.00 -1.68 0.11 -1.95 -1.86 132.00 130.35 2wm1 h PRO 86 Ca -0.50 -0.06 -0.17 0.00 0.11 0.00 0.00 66.00 65.38 2wm1 h PRO 86 Cb 1.25 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 2wm1 h PRO 86 CO 0.63 0.64 -0.79 0.93 -0.21 0.00 0.00 178.00 179.20 2wm1 h GLU 87 N 1.00 0.05 -0.14 1.05 4.39 -1.99 -1.88 114.58 117.07 2wm1 h GLU 87 Ca 0.48 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 60.05 2wm1 h GLU 87 Cb 0.44 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2wm1 h GLU 87 CO -0.25 0.81 -0.25 -0.44 -1.16 0.00 0.00 179.01 177.72 2wm1 h ASP 88 N 0.03 0.46 -0.78 1.42 3.32 -1.84 -0.36 116.42 118.67 2wm1 h ASP 88 Ca -0.02 -0.55 0.03 0.00 0.02 0.00 0.00 57.03 56.51 2wm1 h ASP 88 Cb 1.39 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 40.77 2wm1 h ASP 88 CO 0.11 0.92 0.50 0.74 -1.72 0.00 0.00 179.24 179.78 2wm1 h THR 89 N 0.01 1.14 -0.51 0.35 2.02 -1.36 -1.68 112.91 112.87 2wm1 h THR 89 Ca 0.01 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 2wm1 h THR 89 Cb 0.83 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2wm1 h THR 89 CO 0.06 0.18 0.26 0.25 0.37 0.00 0.00 175.52 176.64 2wm1 h LEU 90 N 0.99 0.66 -0.31 2.58 5.85 -1.24 0.15 115.31 123.98 2wm1 h LEU 90 Ca 0.31 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.95 2wm1 h LEU 90 Cb -0.02 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2wm1 h LEU 90 CO -0.10 0.59 0.09 -1.13 -0.34 0.00 0.00 178.44 177.55 2wm1 h ASN 91 N 0.68 0.07 -0.80 1.25 -0.73 -0.66 0.40 115.58 115.78 2wm1 h ASN 91 Ca 0.18 0.04 0.03 0.00 1.87 0.00 0.00 56.30 58.42 2wm1 h ASN 91 Cb 0.10 0.04 -0.05 0.00 0.27 0.00 0.00 38.32 38.68 2wm1 h ASN 91 CO -0.02 0.07 0.52 0.25 -0.37 0.00 0.00 177.43 177.87 2wm1 h LEU 92 N 0.21 0.86 -0.52 0.34 5.85 -1.18 -2.26 115.31 118.61 2wm1 h LEU 92 Ca 0.14 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.93 2wm1 h LEU 92 Cb 0.13 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 2wm1 h LEU 92 CO -0.17 0.60 0.19 0.00 -0.34 0.00 0.00 178.44 178.72 2wm1 h GLN 94 N 0.37 1.19 -0.22 0.00 4.20 -0.69 0.25 115.11 120.22 2wm1 h GLN 94 Ca 0.25 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 2wm1 h GLN 94 Cb 0.28 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 2wm1 h GLN 94 CO -0.26 0.97 0.08 1.25 -0.67 0.00 0.00 178.83 180.20 2wm1 h LEU 95 N 1.16 0.30 -0.47 1.46 6.46 -1.03 -0.98 115.31 122.21 2wm1 h LEU 95 Ca 0.26 -0.18 -0.11 0.00 -0.12 0.00 0.00 57.88 57.73 2wm1 h LEU 95 Cb 0.23 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 2wm1 h LEU 95 CO -0.02 0.40 -0.15 -0.07 -0.62 0.00 0.00 178.44 177.99 2wm1 h LEU 96 N 0.19 0.95 -0.25 2.25 3.38 -1.09 -1.55 115.31 119.18 2wm1 h LEU 96 Ca 0.07 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 2wm1 h LEU 96 Cb 0.20 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2wm1 h LEU 96 CO -0.00 1.11 0.14 0.78 0.09 0.00 0.00 178.44 180.55 2wm1 h ASN 97 N 0.78 0.31 -0.87 -0.43 -0.26 -0.91 -1.34 115.58 112.87 2wm1 h ASN 97 Ca 0.12 -0.09 -0.01 0.00 -0.56 0.00 0.00 56.30 55.76 2wm1 h ASN 97 Cb 0.71 -0.08 -0.04 0.00 -1.06 0.00 0.00 38.32 37.85 2wm1 h ASN 97 CO 0.05 0.31 0.52 0.78 -1.06 0.00 0.00 177.43 178.03 2wm1 h ASN 98 N 0.29 1.05 -0.48 5.81 2.35 -1.12 0.12 115.58 123.59 2wm1 h ASN 98 Ca 0.09 -0.07 0.03 0.00 -0.55 0.00 0.00 56.30 55.80 2wm1 h ASN 98 Cb 0.07 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.14 2wm1 h ASN 98 CO -0.01 0.81 0.27 -0.78 -1.65 0.00 0.00 177.43 176.06 2wm1 h ASP 99 N 1.19 0.42 -0.35 5.81 3.58 -1.09 -0.55 116.42 125.43 2wm1 h ASP 99 Ca 0.31 0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.72 2wm1 h ASP 99 Cb -0.04 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 2wm1 h ASP 99 CO -0.06 0.29 0.01 0.25 -2.88 0.00 0.00 179.24 176.86 2wm1 h LEU 100 N 0.53 0.60 -0.96 2.28 5.85 -0.81 -2.18 115.31 120.61 2wm1 h LEU 100 Ca 0.20 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 2wm1 h LEU 100 Cb 0.06 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 2wm1 h LEU 100 CO -0.11 0.75 0.47 0.00 -0.34 0.00 0.00 178.44 179.20 2wm1 h ALA 101 N 0.87 1.20 -0.29 1.25 0.00 -0.36 -1.65 119.26 120.29 2wm1 h ALA 101 Ca 0.10 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.93 2wm1 h ALA 101 Cb 0.43 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2wm1 h ALA 101 CO 0.02 0.64 0.04 0.77 0.00 0.00 0.00 179.25 180.72 2wm1 h SER 102 N 1.20 -0.02 -0.63 0.00 0.02 -0.84 -0.91 113.55 112.37 2wm1 h SER 102 Ca 0.30 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.34 2wm1 h SER 102 Cb 0.03 0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 2wm1 h SER 102 CO -0.05 0.02 0.38 0.74 -1.14 0.00 0.00 176.83 176.79 2wm1 h THR 103 N 0.14 1.05 -0.48 -2.27 2.02 -1.11 -2.38 112.91 109.89 2wm1 h THR 103 Ca 0.14 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 2wm1 h THR 103 Cb 0.16 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 2wm1 h THR 103 CO -0.19 0.13 0.26 0.58 0.37 0.00 0.00 175.52 176.67 2wm1 h VAL 104 N 0.74 1.17 -0.88 3.16 2.07 -0.86 -2.54 116.25 119.10 2wm1 h VAL 104 Ca 0.26 -0.43 0.07 0.00 0.82 0.00 0.00 66.70 67.42 2wm1 h VAL 104 Cb 0.06 0.59 -0.06 0.00 -1.52 0.00 0.00 31.29 30.35 2wm1 h VAL 104 CO -0.12 0.18 0.55 0.58 0.02 0.00 0.00 177.57 178.78 2wm1 h VAL 105 N 0.63 1.03 0.00 2.57 2.07 -0.97 -1.94 116.25 119.64 2wm1 h VAL 105 Ca 0.17 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 2wm1 h VAL 105 Cb 0.05 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.78 2wm1 h VAL 105 CO -0.03 0.18 -0.11 0.28 0.02 0.00 0.00 177.57 177.91 2wm1 h SER 106 N 0.99 0.00 -1.66 0.57 0.02 -1.01 -3.34 113.55 109.11 2wm1 h SER 106 Ca 0.39 0.00 -0.44 0.00 -0.84 0.00 0.00 61.79 60.90 2wm1 h SER 106 Cb 0.20 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 62.38 2wm1 h SER 106 CO -0.18 0.11 -1.07 -1.22 -1.14 0.00 0.00 176.83 173.33 2wm1 n TYR 107 N -3.60 -0.37 0.77 3.45 4.01 -0.84 -4.99 117.16 115.59 2wm1 n TYR 107 Ca -0.02 -3.52 0.08 0.00 -0.16 0.00 0.00 57.90 54.29 2wm1 n TYR 107 Cb 0.24 -0.07 0.41 0.00 -0.31 0.00 0.00 39.34 39.61 2wm1 n TYR 107 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2wm1 n PRO 108 N 0.36 0.23 -0.01 -0.72 -0.04 -0.79 -1.02 135.00 133.01 2wm1 n PRO 108 Ca 0.22 0.13 0.10 0.00 -0.04 0.00 0.00 63.50 63.91 2wm1 n PRO 108 Cb 0.66 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.71 2wm1 n PRO 108 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2wm1 n ARG 109 N -1.29 1.87 -0.01 0.54 1.85 -1.26 -4.50 116.66 113.86 2wm1 n ARG 109 Ca 0.08 -1.75 0.03 0.00 -1.00 0.00 0.00 57.85 55.21 2wm1 n ARG 109 Cb 0.13 -1.40 -0.07 0.00 -1.05 0.00 0.00 32.46 30.08 2wm1 n ARG 109 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2wm1 n ARG 110 N 1.16 0.62 -4.15 2.89 5.12 -0.18 -4.72 116.66 117.39 2wm1 n ARG 110 Ca 0.12 -0.07 -0.16 0.00 -1.93 0.00 0.00 57.85 55.82 2wm1 n ARG 110 Cb 0.51 -1.20 -0.11 0.00 -1.16 0.00 0.00 32.46 30.50 2wm1 n ARG 110 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2wm1 s PHE 111 N -2.53 1.06 0.20 -1.55 0.08 -1.03 -0.86 117.98 113.35 2wm1 s PHE 111 Ca -0.03 -0.54 0.02 0.00 0.12 0.00 0.00 56.93 56.50 2wm1 s PHE 111 Cb 0.05 -0.59 -0.05 0.00 -0.57 0.00 0.00 43.02 41.86 2wm1 s PHE 111 CO 0.35 0.01 0.02 0.14 -0.10 0.00 0.00 175.22 175.64 2wm1 s VAL 112 N -1.73 0.70 -0.04 -0.44 -7.23 -0.92 -4.76 120.40 105.98 2wm1 s VAL 112 Ca -0.01 -1.99 0.05 0.00 -1.81 0.00 0.00 61.98 58.22 2wm1 s VAL 112 Cb -0.07 -2.24 -0.02 0.00 0.56 0.00 0.00 36.38 34.60 2wm1 s VAL 112 CO 0.01 -0.37 -0.19 -0.83 -0.31 0.00 0.00 175.10 173.42 2wm1 s GLY 113 N -3.22 1.43 -0.24 2.32 0.00 -1.26 -0.50 107.32 105.86 2wm1 s GLY 113 Ca 0.27 -1.03 0.02 0.00 0.00 0.00 0.00 44.72 43.98 2wm1 s GLY 113 CO 0.06 -0.80 -0.13 1.08 0.00 0.00 0.00 173.10 173.32 2wm1 s LEU 114 N -0.63 3.07 0.90 0.66 1.43 0.04 -3.70 118.68 120.44 2wm1 s LEU 114 Ca 0.10 -1.13 -0.11 0.00 -1.03 0.00 0.00 54.13 51.95 2wm1 s LEU 114 Cb -0.11 -1.55 0.19 0.00 0.03 0.00 0.00 46.19 44.76 2wm1 s LEU 114 CO 0.00 -0.13 1.23 -0.83 0.23 0.00 0.00 176.35 176.85 2wm1 s GLY 115 N 1.18 1.79 0.07 -3.19 0.00 -1.01 -4.37 107.32 101.79 2wm1 s GLY 115 Ca -0.04 -1.45 0.09 0.00 0.00 0.00 0.00 44.72 43.32 2wm1 s GLY 115 CO -0.07 -0.71 -0.25 -1.08 0.00 0.00 0.00 173.10 170.99 2wm1 s THR 116 N -3.68 2.02 0.10 0.90 -1.32 -1.26 -1.47 115.64 110.93 2wm1 s THR 116 Ca 0.73 -1.46 0.07 0.00 -1.21 0.00 0.00 61.69 59.82 2wm1 s THR 116 Cb -0.03 -1.76 -0.03 0.00 -1.51 0.00 0.00 72.50 69.16 2wm1 s THR 116 CO 0.51 0.21 -0.18 -0.76 -2.21 0.00 0.00 174.62 172.19 2wm1 s LEU 117 N -1.51 2.31 -1.37 9.08 1.43 -1.26 -4.86 118.68 122.50 2wm1 s LEU 117 Ca 0.11 -0.68 -0.16 0.00 -1.03 0.00 0.00 54.13 52.37 2wm1 s LEU 117 Cb -0.10 -0.73 0.03 0.00 0.03 0.00 0.00 46.19 45.43 2wm1 s LEU 117 CO 0.03 -0.01 2.07 -0.81 0.23 0.00 0.00 176.35 177.87 2wm1 n PRO 118 N 1.08 2.84 0.30 1.29 -0.04 -1.26 -4.80 135.00 134.40 2wm1 n PRO 118 Ca -0.20 -2.74 0.17 0.00 -0.04 0.00 0.00 63.50 60.70 2wm1 n PRO 118 Cb 0.54 -3.33 0.92 0.00 -0.04 0.00 0.00 33.50 31.59 2wm1 n PRO 118 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2wm1 h MET 119 N 6.62 0.00 0.00 0.54 2.86 -1.94 -0.63 114.93 122.38 2wm1 h MET 119 Ca 0.52 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.16 2wm1 h MET 119 Cb 0.71 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.37 2wm1 h MET 119 CO 1.76 0.04 0.00 0.00 1.06 0.00 0.00 176.91 179.77 2wm1 n GLN 120 N -3.46 0.12 -3.68 1.72 0.00 -1.26 -4.20 117.38 106.63 2wm1 n GLN 120 Ca -0.02 0.38 -0.30 0.00 0.00 0.00 0.00 57.00 57.06 2wm1 n GLN 120 Cb 0.16 -1.74 -0.14 0.00 0.00 0.00 0.00 30.24 28.51 2wm1 n GLN 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2wm1 s ALA 121 N -3.22 1.53 0.42 2.61 0.00 -0.24 -5.02 121.76 117.84 2wm1 s ALA 121 Ca 0.05 -1.86 0.09 0.00 0.00 0.00 0.00 51.96 50.23 2wm1 s ALA 121 Cb 0.09 -1.66 0.91 0.00 0.00 0.00 0.00 23.12 22.45 2wm1 s ALA 121 CO 0.33 -1.81 2.03 -1.35 0.00 0.00 0.00 175.76 174.96 2wm1 h PRO 122 N 7.67 0.50 -0.46 0.00 0.11 -1.75 -0.98 132.00 137.10 2wm1 h PRO 122 Ca -0.09 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.92 2wm1 h PRO 122 Cb 0.99 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 2wm1 h PRO 122 CO 0.45 0.33 0.01 1.49 -0.21 0.00 0.00 178.00 180.07 2wm1 h GLU 123 N 0.52 0.80 -0.33 1.05 4.81 -1.93 -1.09 114.58 118.41 2wm1 h GLU 123 Ca 0.20 -0.25 -0.10 0.00 -0.13 0.00 0.00 59.36 59.07 2wm1 h GLU 123 Cb 0.14 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2wm1 h GLU 123 CO -0.05 0.85 -0.22 -0.07 -0.73 0.00 0.00 179.01 178.79 2wm1 h LEU 124 N 0.65 0.64 -0.50 1.64 3.38 -1.64 -2.61 115.31 116.87 2wm1 h LEU 124 Ca 0.13 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 2wm1 h LEU 124 Cb 0.49 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2wm1 h LEU 124 CO 0.02 0.85 -0.06 0.00 0.09 0.00 0.00 178.44 179.34 2wm1 h ALA 125 N 1.20 0.68 -0.62 1.53 0.00 -0.99 -0.81 119.26 120.25 2wm1 h ALA 125 Ca 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2wm1 h ALA 125 Cb 0.69 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2wm1 h ALA 125 CO 0.05 0.54 0.35 0.28 0.00 0.00 0.00 179.25 180.47 2wm1 h VAL 126 N 0.78 1.19 -0.45 0.00 2.07 -1.14 0.04 116.25 118.74 2wm1 h VAL 126 Ca 0.13 -0.47 -0.11 0.00 0.82 0.00 0.00 66.70 67.07 2wm1 h VAL 126 Cb 0.60 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2wm1 h VAL 126 CO 0.04 0.21 -0.15 0.11 0.02 0.00 0.00 177.57 177.79 2wm1 h LYS 127 N 0.84 0.85 -0.01 1.57 1.79 -1.22 -1.05 116.57 119.33 2wm1 h LYS 127 Ca 0.22 -0.31 -0.18 0.00 -2.18 0.00 0.00 60.65 58.20 2wm1 h LYS 127 Cb 0.02 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.61 2wm1 h LYS 127 CO -0.04 0.94 -0.79 1.49 -1.08 0.00 0.00 179.45 179.97 2wm1 h GLU 128 N 0.75 0.16 -0.04 3.15 4.57 -1.02 -2.66 114.58 119.49 2wm1 h GLU 128 Ca 0.12 -0.16 -0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2wm1 h GLU 128 Cb 0.67 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.30 2wm1 h GLU 128 CO 0.05 0.87 0.02 1.98 -1.18 0.00 0.00 179.01 180.75 2wm1 h MET 129 N 0.10 0.06 -0.94 1.92 4.05 -0.86 -1.16 114.93 118.09 2wm1 h MET 129 Ca -0.03 -0.01 0.17 0.00 -0.28 0.00 0.00 59.70 59.56 2wm1 h MET 129 Cb 1.39 -0.01 -0.10 0.00 -0.80 0.00 0.00 31.60 32.07 2wm1 h MET 129 CO 0.12 0.13 0.54 0.93 0.23 0.00 0.00 176.91 178.86 2wm1 h GLU 130 N -0.03 0.69 -0.10 0.39 5.08 -1.15 -1.54 114.58 117.92 2wm1 h GLU 130 Ca 0.01 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2wm1 h GLU 130 Cb 0.09 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 2wm1 h GLU 130 CO -0.00 0.46 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.36 2wm1 h ARG 131 N 0.71 0.19 -0.67 2.33 2.43 -1.33 0.14 114.38 118.19 2wm1 h ARG 131 Ca 0.53 -0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.68 2wm1 h ARG 131 Cb 0.79 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.28 2wm1 h ARG 131 CO -0.38 0.48 0.39 0.00 -1.51 0.00 0.00 179.97 178.95 2wm1 h VAL 133 N 0.73 0.52 -0.19 0.00 2.07 -1.29 0.05 116.25 118.13 2wm1 h VAL 133 Ca 0.29 -1.04 -0.18 0.00 0.82 0.00 0.00 66.70 66.59 2wm1 h VAL 133 Cb 0.14 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.80 2wm1 h VAL 133 CO -0.16 0.14 -0.62 0.11 0.02 0.00 0.00 177.57 177.06 2wm1 h LYS 134 N -0.98 0.67 0.00 1.57 1.79 -1.01 -3.16 116.57 115.46 2wm1 h LYS 134 Ca -0.03 -0.47 -0.36 0.00 -2.18 0.00 0.00 60.65 57.62 2wm1 h LYS 134 Cb 0.44 0.07 -0.06 0.00 -1.58 0.00 0.00 32.23 31.09 2wm1 h LYS 134 CO 0.04 1.09 -2.35 0.39 -1.08 0.00 0.00 179.45 177.54 2wm1 n GLU 135 N -3.95 0.68 0.05 3.15 1.02 0.28 -4.59 120.64 117.28 2wm1 n GLU 135 Ca -0.04 0.10 0.11 0.00 -0.02 0.00 0.00 57.16 57.31 2wm1 n GLU 135 Cb 0.65 -1.48 -0.05 0.00 -0.02 0.00 0.00 31.44 30.55 2wm1 n GLU 135 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2wm1 n LEU 136 N -3.09 0.53 -0.27 -4.62 4.77 -0.76 -4.98 117.00 108.58 2wm1 n LEU 136 Ca -0.40 0.13 -0.04 0.00 -0.03 0.00 0.00 56.01 55.68 2wm1 n LEU 136 Cb 0.99 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 42.01 2wm1 n LEU 136 CO 0.28 -0.07 -0.03 0.61 -1.33 0.00 0.00 177.39 176.85 2wm1 n GLY 137 N 1.26 0.66 3.77 -0.72 0.00 -0.22 -4.96 105.19 104.97 2wm1 n GLY 137 Ca -0.01 -0.86 -0.39 0.00 0.00 0.00 0.00 46.02 44.76 2wm1 n GLY 137 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wm1 s PHE 138 N -2.12 3.04 -1.00 1.61 0.08 -0.17 -4.93 117.98 114.49 2wm1 s PHE 138 Ca 0.00 1.50 0.27 0.00 0.12 0.00 0.00 56.93 58.82 2wm1 s PHE 138 Cb 0.00 -3.52 0.92 0.00 -0.57 0.00 0.00 43.02 39.85 2wm1 s PHE 138 CO 0.00 -1.57 1.70 -0.35 -0.10 0.00 0.00 175.22 174.91 2wm1 n PRO 139 N 0.33 0.00 -2.83 0.24 -0.04 -1.24 -4.36 135.00 127.10 2wm1 n PRO 139 Ca 0.03 -0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.50 2wm1 n PRO 139 Cb 0.45 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.41 2wm1 n PRO 139 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wm1 n GLY 140 N 1.50 0.44 3.06 0.55 0.00 -1.26 -1.61 105.19 107.87 2wm1 n GLY 140 Ca 0.06 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 2wm1 n GLY 140 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wm1 s VAL 141 N -2.09 0.28 -0.21 1.61 -7.23 0.05 -2.40 120.40 110.41 2wm1 s VAL 141 Ca 0.14 -1.47 -0.08 0.00 -1.81 0.00 0.00 61.98 58.76 2wm1 s VAL 141 Cb -0.00 -1.06 -0.04 0.00 0.56 0.00 0.00 36.38 35.84 2wm1 s VAL 141 CO -0.00 -0.77 0.07 -1.58 -0.31 0.00 0.00 175.10 172.51 2wm1 s GLN 142 N -2.91 3.88 0.23 4.82 0.74 -0.54 -0.53 119.66 125.35 2wm1 s GLN 142 Ca -0.01 -0.38 0.06 0.00 0.05 0.00 0.00 55.36 55.08 2wm1 s GLN 142 Cb 0.00 -3.27 -0.05 0.00 1.10 0.00 0.00 33.01 30.79 2wm1 s GLN 142 CO -0.05 0.11 -0.09 0.96 -0.55 0.00 0.00 175.29 175.66 2wm1 s ILE 143 N 0.83 1.53 0.68 -2.34 -4.36 -0.42 -4.55 121.20 112.56 2wm1 s ILE 143 Ca 0.04 -2.14 -0.11 0.00 -0.26 0.00 0.00 60.65 58.19 2wm1 s ILE 143 Cb -0.14 -2.20 0.00 0.00 1.25 0.00 0.00 42.46 41.37 2wm1 s ILE 143 CO 0.02 -0.47 1.06 -0.83 0.24 0.00 0.00 174.94 174.96 2wm1 s GLY 144 N -3.34 1.63 0.56 6.27 0.00 -1.26 -0.57 107.32 110.61 2wm1 s GLY 144 Ca 0.25 -0.35 0.33 0.00 0.00 0.00 0.00 44.72 44.95 2wm1 s GLY 144 CO 0.08 -0.01 2.09 -0.91 0.00 0.00 0.00 173.10 174.35 2wm1 h THR 145 N -0.53 0.24 -3.47 0.90 1.35 -1.77 -3.43 112.91 106.19 2wm1 h THR 145 Ca -0.45 -0.45 -0.05 0.00 -0.55 0.00 0.00 66.41 64.91 2wm1 h THR 145 Cb 1.24 1.36 -0.11 0.00 -1.73 0.00 0.00 68.15 68.91 2wm1 h THR 145 CO 0.63 0.06 -0.08 -1.38 -0.25 0.00 0.00 175.52 174.50 2wm1 s HIS 146 N -3.95 0.01 -0.37 4.73 -3.43 -1.26 -4.29 115.29 106.73 2wm1 s HIS 146 Ca -0.02 -0.36 0.01 0.00 -0.80 0.00 0.00 55.06 53.89 2wm1 s HIS 146 Cb 0.11 0.25 0.12 0.00 -1.43 0.00 0.00 32.58 31.63 2wm1 s HIS 146 CO 0.53 -0.83 0.15 0.08 -2.00 0.00 0.00 174.74 172.67 2wm1 s VAL 147 N -3.89 1.17 0.00 -5.38 1.01 0.17 -4.98 120.40 108.49 2wm1 s VAL 147 Ca 0.10 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.14 2wm1 s VAL 147 Cb 0.01 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.53 2wm1 s VAL 147 CO -0.03 -0.77 0.00 0.59 0.00 0.00 0.00 175.10 174.89 2wm1 n ASN 148 N 4.25 0.00 -0.32 3.32 5.03 -1.26 -0.97 115.26 125.31 2wm1 n ASN 148 Ca 0.03 0.00 0.14 0.00 0.87 0.00 0.00 54.58 55.62 2wm1 n ASN 148 Cb 0.39 0.00 0.55 0.00 -1.02 0.00 0.00 39.78 39.70 2wm1 n ASN 148 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 2wm1 n GLU 149 N 10.17 1.26 -2.90 3.52 4.07 -1.26 -4.84 120.64 130.66 2wm1 n GLU 149 Ca 0.00 -0.65 -0.41 0.00 -0.06 0.00 0.00 57.16 56.04 2wm1 n GLU 149 Cb 0.00 -1.49 -0.04 0.00 -0.06 0.00 0.00 31.44 29.85 2wm1 n GLU 149 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 2wm1 s TRP 150 N -2.18 3.42 0.78 4.31 0.51 -0.15 -5.07 118.94 120.56 2wm1 s TRP 150 Ca 0.35 1.23 -0.07 0.00 -2.12 0.00 0.00 56.10 55.49 2wm1 s TRP 150 Cb 0.21 -3.00 0.12 0.00 -0.81 0.00 0.00 33.47 29.99 2wm1 s TRP 150 CO 0.40 -0.24 1.10 -0.51 -0.51 0.00 0.00 176.95 177.19 2wm1 s ASP 151 N 1.16 4.15 0.00 2.95 1.01 -1.26 0.43 116.67 125.11 2wm1 s ASP 151 Ca 0.38 0.11 0.29 0.00 0.71 0.00 0.00 52.55 54.04 2wm1 s ASP 151 Cb -0.16 -0.49 1.68 0.00 1.01 0.00 0.00 42.92 44.95 2wm1 s ASP 151 CO 0.12 -2.02 2.06 0.18 0.21 0.00 0.00 175.17 175.72 2wm1 n LEU 152 N -3.13 0.00 0.12 1.23 4.32 -1.26 -1.80 117.00 116.47 2wm1 n LEU 152 Ca 0.13 0.06 0.12 0.00 -0.02 0.00 0.00 56.01 56.29 2wm1 n LEU 152 Cb 0.60 -0.06 0.46 0.00 -1.62 0.00 0.00 43.42 42.81 2wm1 n LEU 152 CO 0.47 -0.00 0.86 -0.46 -1.22 0.00 0.00 177.39 177.04 2wm1 n ASN 153 N -1.06 0.67 -4.67 -1.43 6.94 -1.25 -4.65 115.26 109.81 2wm1 n ASN 153 Ca 0.20 0.63 -0.43 0.00 -0.02 0.00 0.00 54.58 54.96 2wm1 n ASN 153 Cb 0.13 -0.78 -0.03 0.00 -2.36 0.00 0.00 39.78 36.73 2wm1 n ASN 153 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wm1 n ALA 154 N -1.76 1.69 -0.08 -2.53 0.00 -0.74 -4.86 120.51 112.23 2wm1 n ALA 154 Ca 0.03 0.27 0.24 0.00 0.00 0.00 0.00 53.44 53.98 2wm1 n ALA 154 Cb 0.29 -2.61 0.71 0.00 0.00 0.00 0.00 19.45 17.84 2wm1 n ALA 154 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2wm1 h GLN 155 N 9.48 0.00 0.00 0.00 4.20 -1.91 0.01 115.11 126.88 2wm1 h GLN 155 Ca -0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.23 2wm1 h GLN 155 Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.02 2wm1 h GLN 155 CO 0.94 0.00 0.00 0.93 -0.67 0.00 0.00 178.83 180.03 2wm1 h GLU 156 N 0.00 0.00 -0.00 1.46 3.07 -1.98 -2.21 114.58 114.92 2wm1 h GLU 156 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 2wm1 h GLU 156 Cb 1.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.26 2wm1 h GLU 156 CO -0.00 0.00 -0.70 1.28 -1.40 0.00 0.00 179.01 178.19 2wm1 n LEU 157 N -2.69 0.90 -0.32 1.33 4.77 -0.01 -4.41 117.00 116.56 2wm1 n LEU 157 Ca -0.01 -0.31 0.12 0.00 -0.03 0.00 0.00 56.01 55.78 2wm1 n LEU 157 Cb 0.11 -0.11 0.34 0.00 -2.33 0.00 0.00 43.42 41.44 2wm1 n LEU 157 CO 0.17 0.21 1.22 -0.26 -1.33 0.00 0.00 177.39 177.40 2wm1 h PHE 158 N 0.31 0.95 -0.25 -1.77 -1.00 -1.47 0.97 116.94 114.68 2wm1 h PHE 158 Ca 0.00 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.81 2wm1 h PHE 158 Cb 0.52 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.78 2wm1 h PHE 158 CO 0.00 0.30 0.16 -1.35 -1.61 0.00 0.00 178.31 175.81 2wm1 h PRO 159 N 0.75 0.31 -0.42 1.51 0.11 -1.79 -0.11 132.00 132.36 2wm1 h PRO 159 Ca 0.51 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.51 2wm1 h PRO 159 Cb 0.79 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 2wm1 h PRO 159 CO -0.28 0.21 -0.09 0.28 -0.21 0.00 0.00 178.00 177.91 2wm1 h VAL 160 N 0.32 1.27 -0.45 3.15 2.07 -1.12 -0.43 116.25 121.06 2wm1 h VAL 160 Ca 0.09 -1.17 -0.10 0.00 0.82 0.00 0.00 66.70 66.34 2wm1 h VAL 160 Cb -0.02 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2wm1 h VAL 160 CO -0.02 0.40 -0.11 1.88 0.02 0.00 0.00 177.57 179.73 2wm1 h TYR 161 N 0.62 0.92 -0.17 1.57 0.05 -0.97 -1.11 116.97 117.87 2wm1 h TYR 161 Ca 0.11 -0.17 -0.02 0.00 0.05 0.00 0.00 58.73 58.70 2wm1 h TYR 161 Cb 0.61 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 38.11 2wm1 h TYR 161 CO 0.05 0.89 0.04 0.00 -1.05 0.00 0.00 178.16 178.10 2wm1 h ALA 162 N 1.12 0.23 -0.91 3.88 0.00 -0.97 -1.83 119.26 120.78 2wm1 h ALA 162 Ca 0.12 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.97 2wm1 h ALA 162 Cb 0.61 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 2wm1 h ALA 162 CO 0.04 -0.13 0.59 0.00 0.00 0.00 0.00 179.25 179.75 2wm1 h ALA 163 N 0.85 1.55 -0.40 0.00 0.00 -0.85 -2.12 119.26 118.29 2wm1 h ALA 163 Ca 0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2wm1 h ALA 163 Cb 0.26 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2wm1 h ALA 163 CO 0.00 0.30 0.13 0.00 0.00 0.00 0.00 179.25 179.68 2wm1 h ALA 164 N 1.52 0.52 -0.24 0.00 0.00 -0.94 0.96 119.26 121.09 2wm1 h ALA 164 Ca 0.40 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.19 2wm1 h ALA 164 Cb 0.27 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 2wm1 h ALA 164 CO -0.16 0.15 0.01 0.93 0.00 0.00 0.00 179.25 180.18 2wm1 h GLU 165 N 0.50 0.08 -0.33 0.00 5.08 -0.99 0.52 114.58 119.44 2wm1 h GLU 165 Ca 0.13 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2wm1 h GLU 165 Cb 0.24 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2wm1 h GLU 165 CO -0.01 0.06 0.06 0.00 -1.00 0.00 0.00 179.01 178.12 2wm1 h ARG 166 N 0.09 0.54 0.00 2.33 3.08 -1.08 -2.99 114.38 116.35 2wm1 h ARG 166 Ca 0.11 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2wm1 h ARG 166 Cb 0.14 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2wm1 h ARG 166 CO -0.18 0.62 0.00 1.28 -1.07 0.00 0.00 179.97 180.62 2wm1 n LEU 167 N -4.61 0.00 -3.87 3.04 4.77 0.30 -4.92 117.00 111.72 2wm1 n LEU 167 Ca -0.02 0.21 -0.25 0.00 -0.03 0.00 0.00 56.01 55.92 2wm1 n LEU 167 Cb 0.21 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2wm1 n LEU 167 CO 0.38 -0.01 -0.12 0.29 -1.33 0.00 0.00 177.39 176.60 2wm1 n LYS 168 N -1.21 -4.17 -3.55 3.23 5.02 -0.11 -4.97 118.16 112.40 2wm1 n LYS 168 Ca 0.16 0.51 -0.39 0.00 -2.02 0.00 0.00 58.31 56.57 2wm1 n LYS 168 Cb 0.20 -4.93 -0.11 0.00 -0.02 0.00 0.00 35.03 30.17 2wm1 n LYS 168 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wm1 s SER 170 N 1.74 5.94 -0.18 0.00 0.01 -0.63 -4.72 113.70 115.86 2wm1 s SER 170 Ca 0.07 1.92 0.00 0.00 1.31 0.00 0.00 55.95 59.26 2wm1 s SER 170 Cb -0.17 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.52 2wm1 s SER 170 CO 0.11 -1.06 -0.17 -0.76 0.41 0.00 0.00 173.24 171.77 2wm1 s LEU 171 N -4.04 2.31 -0.34 2.44 1.43 -0.11 -0.77 118.68 119.60 2wm1 s LEU 171 Ca 0.67 -0.57 -0.11 0.00 -1.03 0.00 0.00 54.13 53.08 2wm1 s LEU 171 Cb -0.18 -1.53 -0.00 0.00 0.03 0.00 0.00 46.19 44.51 2wm1 s LEU 171 CO 0.29 0.02 0.20 0.12 0.23 0.00 0.00 176.35 177.22 2wm1 s PHE 172 N 1.19 3.21 -0.25 0.29 5.36 0.31 -1.08 117.98 127.01 2wm1 s PHE 172 Ca 0.02 -0.54 -0.16 0.00 -0.96 0.00 0.00 56.93 55.29 2wm1 s PHE 172 Cb -0.14 -2.43 -0.03 0.00 -0.34 0.00 0.00 43.02 40.08 2wm1 s PHE 172 CO -0.08 -0.48 0.41 0.08 -1.46 0.00 0.00 175.22 173.70 2wm1 s VAL 173 N 1.64 5.15 -0.13 3.12 1.01 0.29 -1.31 120.40 130.18 2wm1 s VAL 173 Ca 0.05 0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.73 2wm1 s VAL 173 Cb -0.18 -3.74 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2wm1 s VAL 173 CO 0.08 0.16 -0.21 -2.28 0.00 0.00 0.00 175.10 172.84 2wm1 s HIS 174 N 1.97 2.65 0.45 5.22 2.46 0.27 -1.25 115.29 127.06 2wm1 s HIS 174 Ca 0.17 -1.15 -0.25 0.00 0.47 0.00 0.00 55.06 54.30 2wm1 s HIS 174 Cb -0.16 -1.79 -0.08 0.00 -0.13 0.00 0.00 32.58 30.43 2wm1 s HIS 174 CO 0.09 -0.50 1.40 -1.25 -2.47 0.00 0.00 174.74 172.02 2wm1 s PRO 175 N 0.60 3.69 0.22 2.88 0.04 -1.26 -2.25 135.00 138.92 2wm1 s PRO 175 Ca -0.12 2.37 -0.22 0.00 0.04 0.00 0.00 61.00 63.07 2wm1 s PRO 175 Cb -0.16 -2.64 0.05 0.00 0.04 0.00 0.00 34.50 31.79 2wm1 s PRO 175 CO 0.03 -0.80 0.89 1.67 0.04 0.00 0.00 177.00 178.83 2wm1 s TRP 176 N -1.22 -0.09 -1.48 0.56 1.48 -1.26 -4.87 118.94 112.06 2wm1 s TRP 176 Ca 0.61 -0.31 -0.08 0.00 -1.06 0.00 0.00 56.10 55.26 2wm1 s TRP 176 Cb -0.43 0.69 0.06 0.00 -1.16 0.00 0.00 33.47 32.63 2wm1 s TRP 176 CO 0.55 -1.04 0.71 -3.47 -4.06 0.00 0.00 176.95 169.64 2wm1 n ASP 177 N -0.67 -2.34 -4.81 -2.66 2.03 -1.26 -4.84 116.55 102.00 2wm1 n ASP 177 Ca -0.05 -0.90 -0.31 0.00 0.52 0.00 0.00 54.79 54.04 2wm1 n ASP 177 Cb 0.60 -3.45 0.06 0.00 -0.72 0.00 0.00 41.12 37.61 2wm1 n ASP 177 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2wm1 s MET 178 N -6.52 2.84 0.25 -0.67 -1.94 -1.26 -5.01 119.30 106.98 2wm1 s MET 178 Ca 0.33 0.99 -0.31 0.00 -1.71 0.00 0.00 55.69 54.99 2wm1 s MET 178 Cb -0.17 -1.98 -0.12 0.00 2.01 0.00 0.00 34.83 34.57 2wm1 s MET 178 CO 0.86 -1.18 1.65 0.94 -0.01 0.00 0.00 175.02 177.28 2wm1 n GLN 179 N -3.18 2.71 -0.00 2.03 7.27 -1.26 -4.91 117.38 120.04 2wm1 n GLN 179 Ca 0.08 0.97 0.02 0.00 0.07 0.00 0.00 57.00 58.14 2wm1 n GLN 179 Cb 0.53 -2.78 -0.02 0.00 2.41 0.00 0.00 30.24 30.38 2wm1 n GLN 179 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 2wm1 n MET 180 N 2.98 4.77 -3.52 3.69 2.81 -1.26 -4.64 117.12 121.95 2wm1 n MET 180 Ca 0.12 -0.01 -0.19 0.00 -1.81 0.00 0.00 57.70 55.82 2wm1 n MET 180 Cb 0.36 -0.76 -0.04 0.00 -0.71 0.00 0.00 33.22 32.07 2wm1 n MET 180 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2wm1 n ASP 181 N -1.18 2.76 0.00 7.83 5.75 -1.26 -3.75 116.55 126.70 2wm1 n ASP 181 Ca 0.01 -2.30 0.00 0.00 -0.01 0.00 0.00 54.79 52.49 2wm1 n ASP 181 Cb 0.07 0.19 0.00 0.00 -1.03 0.00 0.00 41.12 40.35 2wm1 n ASP 181 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wm1 n GLY 182 N 1.39 3.08 0.31 6.12 0.00 -1.26 -2.15 105.19 112.67 2wm1 n GLY 182 Ca -0.11 -0.24 0.20 0.00 0.00 0.00 0.00 46.02 45.86 2wm1 n GLY 182 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wm1 h ARG 183 N 0.00 0.00 -0.00 1.61 3.08 -2.00 -2.59 114.38 114.48 2wm1 h ARG 183 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2wm1 h ARG 183 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2wm1 h ARG 183 CO 0.00 0.01 -0.19 -1.33 -1.07 0.00 0.00 179.97 177.40 2wm1 n MET 184 N -3.15 0.44 -0.79 0.04 2.81 -0.92 -4.28 117.12 111.28 2wm1 n MET 184 Ca -0.01 -0.17 -0.08 0.00 -1.81 0.00 0.00 57.70 55.62 2wm1 n MET 184 Cb 0.18 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.08 2wm1 n MET 184 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wm1 n ALA 185 N -1.13 5.32 -3.46 3.04 0.00 -0.98 -4.08 120.51 119.22 2wm1 n ALA 185 Ca 0.11 -1.22 -0.12 0.00 0.00 0.00 0.00 53.44 52.21 2wm1 n ALA 185 Cb 0.31 -2.00 -0.03 0.00 0.00 0.00 0.00 19.45 17.73 2wm1 n ALA 185 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2wm1 s LYS 186 N 0.93 1.09 -1.80 0.00 -2.85 -1.26 -4.98 119.74 110.87 2wm1 s LYS 186 Ca 0.45 -0.29 0.00 0.00 -1.00 0.00 0.00 55.97 55.13 2wm1 s LYS 186 Cb 0.21 0.50 0.00 0.00 -2.06 0.00 0.00 37.83 36.49 2wm1 s LYS 186 CO 0.00 -0.45 0.00 0.66 0.10 0.00 0.00 175.35 175.66 2wm1 n TYR 187 N -0.10 -0.41 -2.26 1.78 0.53 -1.26 -1.72 117.16 113.72 2wm1 n TYR 187 Ca -0.15 0.00 -0.19 0.00 -1.02 0.00 0.00 57.90 56.55 2wm1 n TYR 187 Cb 0.63 -3.24 -0.02 0.00 -1.03 0.00 0.00 39.34 35.67 2wm1 n TYR 187 CO 0.00 0.00 0.00 1.87 -1.02 0.00 0.00 176.86 177.71 2wm1 n TRP 188 N -2.61 -0.94 -0.07 -0.72 -0.00 -1.26 -4.89 117.44 106.95 2wm1 n TRP 188 Ca -0.19 0.00 0.03 0.00 -0.00 0.00 0.00 57.50 57.35 2wm1 n TRP 188 Cb 0.61 -3.58 0.37 0.00 -0.00 0.00 0.00 31.31 28.71 2wm1 n TRP 188 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2wm1 h LEU 189 N 0.00 0.59 -0.97 5.87 3.38 -1.50 -1.65 115.31 121.02 2wm1 h LEU 189 Ca -0.43 -0.01 0.12 0.00 0.09 0.00 0.00 57.88 57.64 2wm1 h LEU 189 Cb 1.31 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.83 2wm1 h LEU 189 CO 0.53 0.42 0.60 -0.65 0.09 0.00 0.00 178.44 179.43 2wm1 h PRO 190 N 0.69 0.91 0.25 1.13 0.11 -1.83 0.17 132.00 133.44 2wm1 h PRO 190 Ca 0.20 -0.06 -0.34 0.00 0.11 0.00 0.00 66.00 65.91 2wm1 h PRO 190 Cb -0.05 -0.21 0.03 0.00 0.11 0.00 0.00 31.00 30.89 2wm1 h PRO 190 CO -0.04 0.61 -1.53 -1.49 -0.21 0.00 0.00 178.00 175.33 2wm1 h TRP 191 N 0.94 0.95 0.06 0.65 6.55 -1.85 0.12 115.95 123.38 2wm1 h TRP 191 Ca 0.48 -0.69 -0.24 0.00 0.95 0.00 0.00 58.89 59.39 2wm1 h TRP 191 Cb 0.48 -0.04 -0.01 0.00 -0.86 0.00 0.00 29.16 28.74 2wm1 h TRP 191 CO -0.02 1.59 -1.09 -0.07 -1.05 0.00 0.00 178.44 177.80 2wm1 h LEU 192 N 0.14 0.25 0.00 -4.49 3.38 -1.12 -3.37 115.31 110.09 2wm1 h LEU 192 Ca -0.27 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.44 2wm1 h LEU 192 Cb 2.17 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.84 2wm1 h LEU 192 CO 0.26 1.17 -1.02 0.52 0.09 0.00 0.00 178.44 179.47 2wm1 n VAL 193 N -3.49 0.02 -0.23 1.22 0.31 0.46 -4.71 118.33 111.91 2wm1 n VAL 193 Ca -0.05 -0.01 -0.06 0.00 -0.01 0.00 0.00 64.34 64.21 2wm1 n VAL 193 Cb 0.96 -0.82 0.04 0.00 -0.91 0.00 0.00 33.84 33.11 2wm1 n VAL 193 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2wm1 h GLY 194 N 0.01 0.95 0.94 2.92 0.00 -0.66 -1.91 103.07 105.32 2wm1 h GLY 194 Ca -0.01 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 2wm1 h GLY 194 CO -0.00 0.41 -0.18 -0.33 0.00 0.00 0.00 176.54 176.44 2wm1 h MET 195 N 0.87 -0.49 -0.61 4.80 2.86 -1.16 0.71 114.93 121.91 2wm1 h MET 195 Ca 0.22 0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.91 2wm1 h MET 195 Cb 0.04 0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 2wm1 h MET 195 CO -0.04 -0.28 0.40 -1.35 1.06 0.00 0.00 176.91 176.70 2wm1 h PRO 196 N -0.58 0.78 -0.43 -0.22 0.11 -1.80 -1.26 132.00 128.60 2wm1 h PRO 196 Ca -0.05 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.96 2wm1 h PRO 196 Cb 0.43 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.35 2wm1 h PRO 196 CO 0.09 0.52 0.06 0.00 -0.21 0.00 0.00 178.00 178.45 2wm1 h ALA 197 N 1.63 0.57 -0.63 -0.75 0.00 -1.16 -2.16 119.26 116.76 2wm1 h ALA 197 Ca 0.23 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2wm1 h ALA 197 Cb -0.06 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.51 2wm1 h ALA 197 CO -0.05 0.30 0.32 0.93 0.00 0.00 0.00 179.25 180.75 2wm1 h GLU 198 N 0.58 0.57 -0.64 0.00 4.39 -0.12 -1.68 114.58 117.68 2wm1 h GLU 198 Ca 0.13 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 2wm1 h GLU 198 Cb 0.40 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 2wm1 h GLU 198 CO 0.01 0.38 0.21 1.15 -1.16 0.00 0.00 179.01 179.60 2wm1 h THR 199 N 0.59 1.24 -0.41 1.13 2.02 -1.12 -1.80 112.91 114.55 2wm1 h THR 199 Ca 0.29 -0.80 -0.15 0.00 0.77 0.00 0.00 66.41 66.53 2wm1 h THR 199 Cb 0.24 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 2wm1 h THR 199 CO -0.21 0.31 -0.35 0.74 0.37 0.00 0.00 175.52 176.38 2wm1 h THR 200 N 0.93 1.27 -0.84 3.16 2.02 -0.78 -0.92 112.91 117.75 2wm1 h THR 200 Ca 0.21 -1.52 -0.01 0.00 0.77 0.00 0.00 66.41 65.87 2wm1 h THR 200 Cb 0.25 1.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.94 2wm1 h THR 200 CO -0.01 0.51 0.50 0.40 0.37 0.00 0.00 175.52 177.29 2wm1 h ILE 201 N 0.79 1.23 -0.53 3.11 2.04 -1.17 -0.85 117.51 122.13 2wm1 h ILE 201 Ca 0.07 -0.53 -0.12 0.00 1.00 0.00 0.00 64.86 65.28 2wm1 h ILE 201 Cb 0.94 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2wm1 h ILE 201 CO 0.09 0.25 -0.13 0.00 0.00 0.00 0.00 178.15 178.36 2wm1 h ALA 202 N 1.38 0.73 -0.17 1.87 0.00 -0.88 -0.48 119.26 121.72 2wm1 h ALA 202 Ca 0.30 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2wm1 h ALA 202 Cb -0.03 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2wm1 h ALA 202 CO -0.05 0.67 -0.16 0.82 0.00 0.00 0.00 179.25 180.52 2wm1 h ILE 203 N 0.90 1.34 -0.92 0.00 2.04 -0.89 -2.21 117.51 117.77 2wm1 h ILE 203 Ca 0.13 -1.31 0.07 0.00 1.00 0.00 0.00 64.86 64.75 2wm1 h ILE 203 Cb 0.70 1.82 -0.06 0.00 -0.74 0.00 0.00 36.82 38.54 2wm1 h ILE 203 CO 0.05 0.39 0.60 0.00 0.00 0.00 0.00 178.15 179.19 2wm1 h SER 205 N 1.04 0.93 0.08 0.00 0.02 -0.86 -1.05 113.55 113.72 2wm1 h SER 205 Ca 0.40 -0.43 -0.18 0.00 -0.84 0.00 0.00 61.79 60.74 2wm1 h SER 205 Cb 0.21 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.48 2wm1 h SER 205 CO -0.15 1.17 -0.64 0.24 -1.14 0.00 0.00 176.83 176.31 2wm1 h MET 206 N 0.71 0.54 0.44 3.45 2.07 -1.32 0.02 114.93 120.84 2wm1 h MET 206 Ca 0.08 -0.39 -0.02 0.00 -2.07 0.00 0.00 59.70 57.30 2wm1 h MET 206 Cb 0.86 0.06 0.00 0.00 -1.87 0.00 0.00 31.60 30.66 2wm1 h MET 206 CO 0.08 1.00 -0.21 0.82 1.07 0.00 0.00 176.91 179.67 2wm1 h ILE 207 N 0.40 0.00 0.00 -1.22 2.04 -1.28 -0.96 117.51 116.48 2wm1 h ILE 207 Ca -0.01 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 2wm1 h ILE 207 Cb 1.21 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 2wm1 h ILE 207 CO 0.12 0.00 -0.02 0.24 0.00 0.00 0.00 178.15 178.49 2wm1 h MET 208 N -0.74 0.00 0.00 2.37 2.86 -1.28 -0.50 114.93 117.64 2wm1 h MET 208 Ca -0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2wm1 h MET 208 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 2wm1 h MET 208 CO 0.10 0.02 0.00 0.41 1.06 0.00 0.00 176.91 178.50 2wm1 n GLY 209 N 0.08 -1.03 2.12 8.32 0.00 -0.01 -3.18 105.19 111.50 2wm1 n GLY 209 Ca 0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 2wm1 n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm1 n GLY 210 N 0.92 0.52 0.14 -0.02 0.00 -0.19 -4.84 105.19 101.71 2wm1 n GLY 210 Ca 0.18 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 2wm1 n GLY 210 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wm1 h VAL 211 N 0.00 1.13 -0.05 1.61 2.07 -1.37 0.23 116.25 119.88 2wm1 h VAL 211 Ca -0.03 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 2wm1 h VAL 211 Cb 0.17 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2wm1 h VAL 211 CO 0.04 0.14 -0.47 -0.26 0.02 0.00 0.00 177.57 177.04 2wm1 h PHE 212 N 0.34 0.15 -0.22 1.57 0.04 -1.84 -0.24 116.94 116.73 2wm1 h PHE 212 Ca 0.10 -0.04 -0.07 0.00 2.80 0.00 0.00 57.97 60.75 2wm1 h PHE 212 Cb 0.08 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.19 2wm1 h PHE 212 CO -0.03 0.58 -0.15 1.49 -0.60 0.00 0.00 178.31 179.60 2wm1 h GLU 213 N 0.10 0.50 0.00 1.51 4.57 -1.81 -3.20 114.58 116.25 2wm1 h GLU 213 Ca 0.00 -0.23 -0.11 0.00 -1.18 0.00 0.00 59.36 57.84 2wm1 h GLU 213 Cb 0.87 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.44 2wm1 h GLU 213 CO 0.07 0.79 -0.67 0.87 -1.18 0.00 0.00 179.01 178.89 2wm1 h LYS 214 N 0.19 0.00 -2.17 1.92 6.56 -0.43 -3.37 116.57 119.27 2wm1 h LYS 214 Ca 0.04 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 59.05 2wm1 h LYS 214 Cb 0.67 0.00 -0.41 0.00 -0.57 0.00 0.00 32.23 31.92 2wm1 h LYS 214 CO 0.04 0.43 -0.73 1.19 -2.06 0.00 0.00 179.45 178.32 2wm1 n PHE 215 N -3.14 2.91 0.41 -1.35 3.72 -0.11 -4.94 117.46 114.95 2wm1 n PHE 215 Ca -0.00 -4.00 0.06 0.00 -0.05 0.00 0.00 57.45 53.45 2wm1 n PHE 215 Cb 0.74 -0.50 0.26 0.00 -0.94 0.00 0.00 39.48 39.04 2wm1 n PHE 215 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 2wm1 n PRO 216 N 0.59 0.00 0.00 -1.08 -0.04 -1.21 -1.66 135.00 131.61 2wm1 n PRO 216 Ca 0.29 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 64.16 2wm1 n PRO 216 Cb 0.44 -1.51 0.16 0.00 -0.04 0.00 0.00 33.50 32.56 2wm1 n PRO 216 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2wm1 n LYS 217 N -1.51 0.86 -1.81 0.54 5.02 -1.26 -4.94 118.16 115.06 2wm1 n LYS 217 Ca 0.03 -0.62 -0.42 0.00 -2.02 0.00 0.00 58.31 55.27 2wm1 n LYS 217 Cb 0.14 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 2wm1 n LYS 217 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2wm1 s LEU 218 N -2.57 4.39 -0.25 -0.35 2.96 -0.66 -4.89 118.68 117.30 2wm1 s LEU 218 Ca 0.19 2.63 -0.12 0.00 -0.22 0.00 0.00 54.13 56.61 2wm1 s LEU 218 Cb 0.18 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.26 2wm1 s LEU 218 CO 0.59 -0.96 0.23 -0.54 -1.32 0.00 0.00 176.35 174.35 2wm1 s LYS 219 N 2.84 4.03 -0.03 1.98 1.02 -1.26 -4.98 119.74 123.34 2wm1 s LYS 219 Ca 0.78 -0.18 0.03 0.00 0.02 0.00 0.00 55.97 56.62 2wm1 s LYS 219 Cb -0.43 -3.60 0.00 0.00 -0.52 0.00 0.00 37.83 33.28 2wm1 s LYS 219 CO 0.35 -0.09 -0.10 0.08 -0.92 0.00 0.00 175.35 174.67 2wm1 s VAL 220 N 1.50 0.85 -0.06 3.17 1.01 -1.26 -0.93 120.40 124.68 2wm1 s VAL 220 Ca 0.10 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.70 2wm1 s VAL 220 Cb -0.15 -0.75 0.01 0.00 0.00 0.00 0.00 36.38 35.49 2wm1 s VAL 220 CO 0.08 0.26 -0.14 0.00 0.00 0.00 0.00 175.10 175.30 2wm1 s PHE 222 N 0.43 3.57 0.78 0.00 0.08 -0.41 -0.54 117.98 121.89 2wm1 s PHE 222 Ca -0.11 0.46 -0.11 0.00 0.12 0.00 0.00 56.93 57.29 2wm1 s PHE 222 Cb -0.14 -1.90 0.06 0.00 -0.57 0.00 0.00 43.02 40.47 2wm1 s PHE 222 CO 0.03 0.68 1.09 0.00 -0.10 0.00 0.00 175.22 176.92 2wm1 s ALA 223 N -1.21 2.26 -1.34 5.36 0.00 -0.38 -1.67 121.76 124.77 2wm1 s ALA 223 Ca 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.10 2wm1 s ALA 223 Cb -0.13 -3.15 0.01 0.00 0.00 0.00 0.00 23.12 19.85 2wm1 s ALA 223 CO 0.13 -1.70 0.73 0.72 0.00 0.00 0.00 175.76 175.64 2wm1 n HIS 224 N -3.43 -1.96 -2.16 0.00 8.25 -1.26 -2.74 115.22 111.92 2wm1 n HIS 224 Ca 0.07 0.85 -0.19 0.00 -0.26 0.00 0.00 57.72 58.19 2wm1 n HIS 224 Cb 0.55 -4.32 -0.03 0.00 1.12 0.00 0.00 29.99 27.31 2wm1 n HIS 224 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2wm1 n GLY 225 N -1.61 0.15 2.01 -1.41 0.00 -1.21 -1.57 105.19 101.55 2wm1 n GLY 225 Ca -0.25 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.77 2wm1 n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm1 n GLY 226 N -0.79 0.47 7.00 -0.02 0.00 -1.11 -4.61 105.19 106.14 2wm1 n GLY 226 Ca -0.21 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2wm1 n GLY 226 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wm1 n GLY 227 N -2.96 3.44 0.05 -0.02 0.00 -0.61 -1.96 105.19 103.12 2wm1 n GLY 227 Ca -0.00 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.04 2wm1 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wm1 n ALA 228 N 11.82 3.04 -0.31 4.61 0.00 -1.23 -4.67 120.51 133.77 2wm1 n ALA 228 Ca 0.00 -0.27 0.10 0.00 0.00 0.00 0.00 53.44 53.27 2wm1 n ALA 228 Cb 0.00 -1.17 0.26 0.00 0.00 0.00 0.00 19.45 18.54 2wm1 n ALA 228 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2wm1 h PHE 229 N 0.00 0.84 -0.07 0.00 3.57 -1.70 -0.61 116.94 118.97 2wm1 h PHE 229 Ca 0.00 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2wm1 h PHE 229 Cb 0.68 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 2wm1 h PHE 229 CO 0.00 0.17 -0.07 -1.35 -2.23 0.00 0.00 178.31 174.82 2wm1 h PRO 230 N 0.64 0.10 0.04 6.41 0.11 -1.81 0.19 132.00 137.67 2wm1 h PRO 230 Ca 0.51 -0.01 -0.29 0.00 0.11 0.00 0.00 66.00 66.32 2wm1 h PRO 230 Cb 0.78 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.84 2wm1 h PRO 230 CO -0.39 0.19 -1.61 0.35 -0.21 0.00 0.00 178.00 176.33 2wm1 h PHE 231 N 0.10 0.14 -0.32 0.65 3.57 -1.52 -3.39 116.94 116.16 2wm1 h PHE 231 Ca 0.02 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2wm1 h PHE 231 Cb 0.20 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.94 2wm1 h PHE 231 CO 0.00 1.16 0.00 0.25 -2.23 0.00 0.00 178.31 177.49 2wm1 n THR 232 N -3.22 0.41 0.17 4.41 -2.24 -0.43 -4.38 114.28 109.00 2wm1 n THR 232 Ca -0.16 -0.70 0.15 0.00 -2.27 0.00 0.00 64.05 61.07 2wm1 n THR 232 Cb 1.03 1.07 0.72 0.00 -2.10 0.00 0.00 70.33 71.06 2wm1 n THR 232 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 2wm1 h VAL 233 N 4.52 0.76 -0.34 2.28 3.04 -1.16 -0.84 116.25 124.51 2wm1 h VAL 233 Ca 0.00 0.00 -0.15 0.00 -1.01 0.00 0.00 66.70 65.54 2wm1 h VAL 233 Cb 0.99 0.88 -0.00 0.00 -2.01 0.00 0.00 31.29 31.14 2wm1 h VAL 233 CO 0.00 0.00 -0.35 1.23 -1.01 0.00 0.00 177.57 177.44 2wm1 h GLY 234 N 0.00 0.92 0.87 3.17 0.00 -1.86 0.81 103.07 106.98 2wm1 h GLY 234 Ca 0.10 -0.95 -0.00 0.00 0.00 0.00 0.00 47.33 46.48 2wm1 h GLY 234 CO -0.00 0.85 0.01 -0.09 0.00 0.00 0.00 176.54 177.32 2wm1 h ARG 235 N 0.63 0.04 -0.49 4.80 2.43 -1.59 -0.98 114.38 119.22 2wm1 h ARG 235 Ca 0.05 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2wm1 h ARG 235 Cb 0.94 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.46 2wm1 h ARG 235 CO 0.09 0.17 0.30 0.82 -1.51 0.00 0.00 179.97 179.83 2wm1 h ILE 236 N -0.09 1.15 -0.31 1.20 2.04 -1.11 -0.50 117.51 119.89 2wm1 h ILE 236 Ca 0.01 -0.34 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 2wm1 h ILE 236 Cb 0.14 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 2wm1 h ILE 236 CO -0.00 0.15 -0.06 -1.28 0.00 0.00 0.00 178.15 176.96 2wm1 h SER 237 N 0.66 0.59 -0.56 1.72 0.87 -0.75 -2.04 113.55 114.04 2wm1 h SER 237 Ca 0.18 -0.35 -0.00 0.00 -1.23 0.00 0.00 61.79 60.38 2wm1 h SER 237 Cb -0.01 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 2wm1 h SER 237 CO -0.03 0.81 0.35 -0.74 -0.53 0.00 0.00 176.83 176.68 2wm1 h HIS 238 N 0.37 0.72 -0.66 2.24 -0.00 -1.04 -2.32 115.15 114.47 2wm1 h HIS 238 Ca 0.08 0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.40 2wm1 h HIS 238 Cb 0.54 -0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 27.68 2wm1 h HIS 238 CO 0.05 0.48 0.20 0.78 -0.00 0.00 0.00 177.93 179.44 2wm1 h GLY 239 N 0.75 1.11 0.70 5.26 0.00 -1.03 -1.88 103.07 107.97 2wm1 h GLY 239 Ca 0.20 -0.66 0.04 0.00 0.00 0.00 0.00 47.33 46.91 2wm1 h GLY 239 CO -0.04 0.62 0.13 -2.75 0.00 0.00 0.00 176.54 174.50 2wm1 h PHE 240 N 0.96 0.23 -0.82 5.60 3.57 -1.25 -0.69 116.94 124.55 2wm1 h PHE 240 Ca 0.21 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.76 2wm1 h PHE 240 Cb 0.31 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 2wm1 h PHE 240 CO 0.02 0.10 0.54 0.77 -2.23 0.00 0.00 178.31 177.51 2wm1 h SER 241 N 0.28 0.87 0.86 0.41 0.02 -1.10 -3.14 113.55 111.75 2wm1 h SER 241 Ca 0.16 -0.01 -0.23 0.00 -0.84 0.00 0.00 61.79 60.87 2wm1 h SER 241 Cb 0.13 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 2wm1 h SER 241 CO -0.16 0.60 -1.13 0.24 -1.14 0.00 0.00 176.83 175.24 2wm1 h MET 242 N 1.01 0.06 -2.07 3.45 2.86 -0.90 -3.39 114.93 115.95 2wm1 h MET 242 Ca 0.32 -0.11 -0.57 0.00 -2.06 0.00 0.00 59.70 57.29 2wm1 h MET 242 Cb 0.04 0.04 -0.40 0.00 0.06 0.00 0.00 31.60 31.34 2wm1 h MET 242 CO -0.10 1.01 -0.95 0.54 1.06 0.00 0.00 176.91 178.48 2wm1 n ARG 243 N -3.37 1.35 0.27 1.72 5.12 -0.31 -4.90 116.66 116.55 2wm1 n ARG 243 Ca -0.04 -3.72 0.12 0.00 -1.93 0.00 0.00 57.85 52.28 2wm1 n ARG 243 Cb 0.97 -1.59 0.74 0.00 -1.16 0.00 0.00 32.46 31.42 2wm1 n ARG 243 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2wm1 h PRO 244 N 3.94 0.00 -0.13 5.56 0.13 -1.76 0.06 132.00 139.81 2wm1 h PRO 244 Ca 0.11 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.27 2wm1 h PRO 244 Cb 0.81 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 2wm1 h PRO 244 CO 0.59 0.09 0.09 0.38 -0.23 0.00 0.00 178.00 178.91 2wm1 h ASP 245 N 0.00 0.03 0.24 1.44 2.03 -1.90 0.45 116.42 118.71 2wm1 h ASP 245 Ca -0.00 -0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.97 2wm1 h ASP 245 Cb 0.20 -0.01 -0.06 0.00 -0.83 0.00 0.00 39.33 38.64 2wm1 h ASP 245 CO 0.01 0.02 -2.06 0.18 -1.03 0.00 0.00 179.24 176.37 2wm1 n LEU 246 N -4.51 0.42 -0.01 0.15 4.77 -0.13 -4.76 117.00 112.93 2wm1 n LEU 246 Ca -0.00 0.20 0.02 0.00 -0.03 0.00 0.00 56.01 56.20 2wm1 n LEU 246 Cb 0.18 0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 2wm1 n LEU 246 CO 0.35 0.44 -0.59 0.00 -1.33 0.00 0.00 177.39 176.26 2wm1 n ALA 248 N -1.80 2.19 0.30 0.00 0.00 0.12 -4.67 120.51 116.65 2wm1 n ALA 248 Ca -0.03 -1.31 0.15 0.00 0.00 0.00 0.00 53.44 52.26 2wm1 n ALA 248 Cb 0.26 -0.28 0.50 0.00 0.00 0.00 0.00 19.45 19.92 2wm1 n ALA 248 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2wm1 h GLN 249 N 1.05 0.00 0.00 0.00 -0.00 -1.86 -3.14 115.11 111.16 2wm1 h GLN 249 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2wm1 h GLN 249 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.21 2wm1 h GLN 249 CO 0.02 0.00 -1.45 -0.25 -0.00 0.00 0.00 178.83 177.15 2wm1 n ASP 250 N -2.93 1.56 -3.15 0.06 8.00 -1.26 -4.95 116.55 113.88 2wm1 n ASP 250 Ca 0.02 -0.16 0.05 0.00 0.71 0.00 0.00 54.79 55.41 2wm1 n ASP 250 Cb 0.37 1.52 -0.00 0.00 -0.02 0.00 0.00 41.12 42.99 2wm1 n ASP 250 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2wm1 s ASN 251 N -3.37 -1.04 0.00 -2.24 2.47 -1.19 -4.45 114.94 105.13 2wm1 s ASN 251 Ca -0.03 0.22 0.21 0.00 0.42 0.00 0.00 52.86 53.68 2wm1 s ASN 251 Cb 0.09 1.70 0.93 0.00 -1.45 0.00 0.00 41.25 42.52 2wm1 s ASN 251 CO 0.58 -0.19 1.67 -0.81 -3.72 0.00 0.00 177.10 174.63 2wm1 n PRO 252 N 5.31 0.07 -2.55 0.43 -0.04 -1.22 -4.63 135.00 132.37 2wm1 n PRO 252 Ca 0.05 0.13 -0.41 0.00 -0.04 0.00 0.00 63.50 63.23 2wm1 n PRO 252 Cb 0.55 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 2wm1 n PRO 252 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2wm1 s MET 253 N -2.90 4.60 0.25 0.54 -1.94 -1.26 -4.99 119.30 113.60 2wm1 s MET 253 Ca 0.12 1.66 -0.31 0.00 -1.71 0.00 0.00 55.69 55.46 2wm1 s MET 253 Cb 0.14 -3.31 -0.12 0.00 2.01 0.00 0.00 34.83 33.55 2wm1 s MET 253 CO 0.36 0.07 1.56 -1.71 -0.01 0.00 0.00 175.02 175.30 2wm1 n ASN 254 N 2.60 3.48 -0.32 3.03 2.85 -1.26 -4.86 115.26 120.78 2wm1 n ASN 254 Ca 0.03 1.12 0.32 0.00 -0.11 0.00 0.00 54.58 55.94 2wm1 n ASN 254 Cb 0.47 -1.52 0.68 0.00 1.24 0.00 0.00 39.78 40.64 2wm1 n ASN 254 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wm1 h PRO 255 N 5.11 0.11 0.00 1.20 0.11 -1.92 0.85 132.00 137.46 2wm1 h PRO 255 Ca -0.45 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 2wm1 h PRO 255 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2wm1 h PRO 255 CO 0.82 0.07 -0.01 0.87 -0.21 0.00 0.00 178.00 179.55 2wm1 h LYS 256 N 0.11 0.00 0.00 1.05 1.57 -1.92 -0.27 116.57 117.11 2wm1 h LYS 256 Ca 0.58 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 2wm1 h LYS 256 Cb 2.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.37 2wm1 h LYS 256 CO -0.10 0.01 0.00 0.87 -0.57 0.00 0.00 179.45 179.66 2wm1 h LYS 257 N 0.00 0.00 -0.23 3.15 1.57 -1.18 -3.00 116.57 116.88 2wm1 h LYS 257 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wm1 h LYS 257 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2wm1 h LYS 257 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54 2wm1 n TYR 258 N -2.41 0.30 -2.28 -1.35 4.01 -0.11 -4.88 117.16 110.44 2wm1 n TYR 258 Ca 0.03 -0.15 -0.42 0.00 -0.16 0.00 0.00 57.90 57.20 2wm1 n TYR 258 Cb 0.30 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.31 2wm1 n TYR 258 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2wm1 s LEU 259 N -1.53 4.30 0.00 7.72 1.43 -1.14 -0.97 118.68 128.50 2wm1 s LEU 259 Ca 0.34 2.03 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 2wm1 s LEU 259 Cb 0.19 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.85 2wm1 s LEU 259 CO 0.27 -0.70 0.00 0.61 0.23 0.00 0.00 176.35 176.77 2wm1 n GLY 260 N 3.59 0.31 0.06 -3.19 0.00 -1.25 -4.96 105.19 99.74 2wm1 n GLY 260 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 2wm1 n GLY 260 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wm1 n SER 261 N 0.00 0.62 -4.10 1.61 7.64 -0.14 -4.98 113.62 114.28 2wm1 n SER 261 Ca 0.00 0.01 -0.10 0.00 1.01 0.00 0.00 58.87 59.79 2wm1 n SER 261 Cb 0.00 0.75 -0.09 0.00 -1.01 0.00 0.00 64.21 63.86 2wm1 n SER 261 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2wm1 s PHE 262 N -3.28 0.77 0.32 1.43 -0.12 -1.26 -4.77 117.98 111.07 2wm1 s PHE 262 Ca 0.01 -1.09 0.07 0.00 -0.05 0.00 0.00 56.93 55.87 2wm1 s PHE 262 Cb 0.13 -0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.18 2wm1 s PHE 262 CO 0.80 -0.67 0.33 0.71 -0.05 0.00 0.00 175.22 176.33 2wm1 s TYR 263 N -4.06 3.03 0.10 3.49 2.02 0.60 -4.91 117.35 117.62 2wm1 s TYR 263 Ca 0.27 -0.23 0.02 0.00 -0.37 0.00 0.00 57.07 56.76 2wm1 s TYR 263 Cb 0.05 -1.77 -0.04 0.00 -0.40 0.00 0.00 41.96 39.81 2wm1 s TYR 263 CO 0.06 0.21 -0.07 0.95 -1.57 0.00 0.00 175.55 175.12 2wm1 s THR 264 N -2.22 0.73 0.96 -0.71 -4.23 -0.44 -1.29 115.64 108.44 2wm1 s THR 264 Ca 0.40 -1.85 -0.15 0.00 -1.18 0.00 0.00 61.69 58.92 2wm1 s THR 264 Cb -0.07 -1.57 0.18 0.00 1.34 0.00 0.00 72.50 72.37 2wm1 s THR 264 CO 0.28 -0.80 1.23 1.51 -0.54 0.00 0.00 174.62 176.30 2wm1 s ASP 265 N -2.88 3.13 -0.13 3.99 1.47 -0.67 -1.00 116.67 120.59 2wm1 s ASP 265 Ca 0.10 0.55 0.16 0.00 1.18 0.00 0.00 52.55 54.54 2wm1 s ASP 265 Cb 0.03 -0.81 0.62 0.00 -0.34 0.00 0.00 42.92 42.42 2wm1 s ASP 265 CO -0.04 -2.75 1.53 0.00 0.68 0.00 0.00 175.17 174.60 2wm1 n ALA 266 N -3.83 3.01 -2.31 2.11 0.00 0.17 -3.29 120.51 116.38 2wm1 n ALA 266 Ca 0.12 -1.75 -0.43 0.00 0.00 0.00 0.00 53.44 51.38 2wm1 n ALA 266 Cb 0.60 -0.85 -0.00 0.00 0.00 0.00 0.00 19.45 19.20 2wm1 n ALA 266 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2wm1 n LEU 267 N 0.53 5.52 0.00 0.00 7.94 -1.26 -4.45 117.00 125.29 2wm1 n LEU 267 Ca 0.23 -3.98 0.00 0.00 -1.11 0.00 0.00 56.01 51.14 2wm1 n LEU 267 Cb 0.85 -1.72 0.00 0.00 0.53 0.00 0.00 43.42 43.08 2wm1 n LEU 267 CO 0.20 0.43 0.29 1.33 -1.11 0.00 0.00 177.39 178.54 2wm1 n VAL 268 N 6.01 0.33 0.00 1.96 0.24 -1.26 -3.98 118.33 121.62 2wm1 n VAL 268 Ca 0.50 -0.40 0.00 0.00 -2.04 0.00 0.00 64.34 62.40 2wm1 n VAL 268 Cb 0.44 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 2wm1 n VAL 268 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2wm1 n HIS 269 N -0.16 0.00 -4.10 6.34 8.25 -1.26 -4.75 115.22 119.54 2wm1 n HIS 269 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.12 2wm1 n HIS 269 Cb 0.31 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.35 2wm1 n HIS 269 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2wm1 s ASP 270 N 0.00 5.77 0.29 0.41 1.11 -1.26 -4.99 116.67 118.00 2wm1 s ASP 270 Ca 0.00 0.22 -0.01 0.00 0.18 0.00 0.00 52.55 52.93 2wm1 s ASP 270 Cb 0.00 -1.70 0.44 0.00 1.07 0.00 0.00 42.92 42.72 2wm1 s ASP 270 CO 0.00 0.31 1.89 1.55 1.18 0.00 0.00 175.17 180.10 2wm1 h PRO 271 N 4.42 0.91 -0.53 8.23 0.13 -1.93 -0.49 132.00 142.75 2wm1 h PRO 271 Ca -0.50 -0.13 -0.02 0.00 -0.87 0.00 0.00 66.00 64.47 2wm1 h PRO 271 Cb 1.19 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 2wm1 h PRO 271 CO 0.61 0.72 0.23 -0.07 -0.23 0.00 0.00 178.00 179.25 2wm1 h LEU 272 N 0.90 0.68 -0.17 1.56 3.38 -1.96 -1.48 115.31 118.21 2wm1 h LEU 272 Ca 0.22 -0.07 -0.22 0.00 0.09 0.00 0.00 57.88 57.89 2wm1 h LEU 272 Cb 0.12 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.71 2wm1 h LEU 272 CO -0.03 0.60 -0.78 0.28 0.09 0.00 0.00 178.44 178.60 2wm1 h SER 273 N 0.75 0.92 -0.77 -0.43 0.02 -1.66 -2.64 113.55 109.73 2wm1 h SER 273 Ca 0.18 -0.60 -0.04 0.00 -0.84 0.00 0.00 61.79 60.49 2wm1 h SER 273 Cb 0.12 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.36 2wm1 h SER 273 CO -0.02 1.40 0.33 0.25 -1.14 0.00 0.00 176.83 177.66 2wm1 h LEU 274 N 0.52 1.05 -0.47 5.07 5.85 -0.95 -1.94 115.31 124.44 2wm1 h LEU 274 Ca -0.05 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 2wm1 h LEU 274 Cb 1.41 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 2wm1 h LEU 274 CO 0.16 0.91 0.21 0.50 -0.34 0.00 0.00 178.44 179.89 2wm1 h LYS 275 N 1.12 0.69 -0.69 1.25 1.63 -1.25 -2.03 116.57 117.29 2wm1 h LYS 275 Ca 0.26 -0.11 -0.02 0.00 -0.85 0.00 0.00 60.65 59.94 2wm1 h LYS 275 Cb 0.17 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 31.65 2wm1 h LYS 275 CO -0.03 0.59 0.37 1.25 -3.45 0.00 0.00 179.45 178.19 2wm1 h LEU 276 N 0.62 0.87 -0.28 5.20 5.85 -1.33 -0.82 115.31 125.42 2wm1 h LEU 276 Ca 0.16 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.83 2wm1 h LEU 276 Cb 0.14 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 2wm1 h LEU 276 CO -0.02 0.72 -0.03 0.25 -0.34 0.00 0.00 178.44 179.02 2wm1 h LEU 277 N 0.95 -0.18 -0.63 2.25 5.85 -1.19 0.15 115.31 122.51 2wm1 h LEU 277 Ca 0.24 0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.90 2wm1 h LEU 277 Cb 0.05 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2wm1 h LEU 277 CO -0.04 -0.06 -0.41 0.71 -0.34 0.00 0.00 178.44 178.30 2wm1 h THR 278 N 0.04 1.30 -0.49 1.05 1.35 -1.15 0.26 112.91 115.26 2wm1 h THR 278 Ca 0.13 -1.59 -0.00 0.00 -0.55 0.00 0.00 66.41 64.41 2wm1 h THR 278 Cb 0.19 1.55 -0.02 0.00 -1.73 0.00 0.00 68.15 68.14 2wm1 h THR 278 CO -0.26 0.50 0.30 0.44 -0.25 0.00 0.00 175.52 176.26 2wm1 h ASP 279 N 0.50 0.58 0.00 5.36 3.32 -0.54 -0.21 116.42 125.43 2wm1 h ASP 279 Ca 0.04 -0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.88 2wm1 h ASP 279 Cb 0.93 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 2wm1 h ASP 279 CO 0.08 0.45 -1.19 0.52 -1.72 0.00 0.00 179.24 177.38 2wm1 n VAL 280 N -4.44 1.50 0.09 -1.35 0.31 -0.01 -4.55 118.33 109.88 2wm1 n VAL 280 Ca 0.04 0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.25 2wm1 n VAL 280 Cb 0.07 -2.14 -0.10 0.00 -0.91 0.00 0.00 33.84 30.77 2wm1 n VAL 280 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2wm1 h ILE 281 N -1.00 1.52 0.00 2.52 1.08 -0.58 -3.44 117.51 117.61 2wm1 h ILE 281 Ca -0.28 -2.97 0.00 0.00 -0.39 0.00 0.00 64.86 61.22 2wm1 h ILE 281 Cb 1.10 2.78 0.00 0.00 -3.07 0.00 0.00 36.82 37.63 2wm1 h ILE 281 CO -0.17 0.87 0.00 0.61 -0.69 0.00 0.00 178.15 178.77 2wm1 n GLY 282 N 1.31 3.17 0.27 5.37 0.00 -0.09 -3.88 105.19 111.34 2wm1 n GLY 282 Ca -0.06 -1.63 0.18 0.00 0.00 0.00 0.00 46.02 44.52 2wm1 n GLY 282 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wm1 h LYS 283 N 0.00 0.00 -0.02 1.61 1.57 -1.92 -2.46 116.57 115.35 2wm1 h LYS 283 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wm1 h LYS 283 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2wm1 h LYS 283 CO 0.00 0.00 -0.03 -0.25 -0.57 0.00 0.00 179.45 178.60 2wm1 n ASP 284 N -2.86 1.84 0.00 0.86 8.00 -1.26 -4.38 116.55 118.74 2wm1 n ASP 284 Ca -0.01 -1.57 0.00 0.00 0.71 0.00 0.00 54.79 53.92 2wm1 n ASP 284 Cb 0.16 0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.29 2wm1 n ASP 284 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2wm1 n LYS 285 N 0.39 1.58 -5.12 -1.24 4.76 -0.93 -4.83 118.16 112.76 2wm1 n LYS 285 Ca 0.17 -1.05 -0.32 0.00 -2.87 0.00 0.00 58.31 54.24 2wm1 n LYS 285 Cb 0.42 -0.87 -0.16 0.00 -1.84 0.00 0.00 35.03 32.58 2wm1 n LYS 285 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2wm1 s VAL 286 N -0.58 2.33 -0.12 -0.18 1.01 -1.24 -1.33 120.40 120.29 2wm1 s VAL 286 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.04 2wm1 s VAL 286 Cb 0.00 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.50 2wm1 s VAL 286 CO 0.00 0.56 -0.11 -0.63 0.00 0.00 0.00 175.10 174.92 2wm1 s ILE 287 N 0.10 1.27 -0.34 2.22 1.01 -0.17 -4.40 121.20 120.88 2wm1 s ILE 287 Ca -0.10 -0.45 -0.41 0.00 0.00 0.00 0.00 60.65 59.69 2wm1 s ILE 287 Cb -0.16 -1.23 -0.16 0.00 0.01 0.00 0.00 42.46 40.93 2wm1 s ILE 287 CO 0.06 0.41 1.83 -0.11 0.00 0.00 0.00 174.94 177.13 2wm1 n LEU 288 N 4.76 2.03 -4.03 2.97 7.94 -0.17 -0.65 117.00 129.86 2wm1 n LEU 288 Ca -0.15 0.96 -0.08 0.00 -1.11 0.00 0.00 56.01 55.63 2wm1 n LEU 288 Cb 0.50 -1.10 -0.10 0.00 0.53 0.00 0.00 43.42 43.25 2wm1 n LEU 288 CO 0.19 -0.56 -0.34 -0.83 -1.11 0.00 0.00 177.39 174.74 2wm1 s GLY 289 N 4.27 0.34 0.00 -3.96 0.00 -1.26 -1.75 107.32 104.96 2wm1 s GLY 289 Ca 1.03 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 44.87 2wm1 s GLY 289 CO 0.66 -0.98 0.00 2.41 0.00 0.00 0.00 173.10 175.19 2wm1 n THR 290 N 0.80 0.00 -2.19 0.90 -1.04 -1.15 -4.27 114.28 107.33 2wm1 n THR 290 Ca -0.19 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.62 2wm1 n THR 290 Cb 0.58 0.08 -0.03 0.00 -1.82 0.00 0.00 70.33 69.14 2wm1 n THR 290 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 2wm1 n ASP 291 N -1.54 -5.71 -4.69 8.00 2.03 0.11 -1.97 116.55 112.78 2wm1 n ASP 291 Ca 0.00 0.13 -0.44 0.00 0.52 0.00 0.00 54.79 55.00 2wm1 n ASP 291 Cb 0.13 -4.83 -0.02 0.00 -0.72 0.00 0.00 41.12 35.68 2wm1 n ASP 291 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wm1 n TYR 292 N -3.55 2.24 -1.12 -0.67 9.36 -1.22 -0.42 117.16 121.79 2wm1 n TYR 292 Ca -0.23 0.48 -0.16 0.00 3.32 0.00 0.00 57.90 61.30 2wm1 n TYR 292 Cb 0.68 -2.45 0.23 0.00 -0.63 0.00 0.00 39.34 37.18 2wm1 n TYR 292 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2wm1 n PRO 293 N 1.37 2.90 -3.01 2.98 -0.04 -1.26 -1.29 135.00 136.64 2wm1 n PRO 293 Ca 0.08 -3.01 -0.35 0.00 -0.04 0.00 0.00 63.50 60.18 2wm1 n PRO 293 Cb 0.34 -2.19 -0.06 0.00 -0.04 0.00 0.00 33.50 31.54 2wm1 n PRO 293 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2wm1 s PHE 294 N -3.13 3.55 0.56 0.54 2.99 0.44 -4.97 117.98 117.96 2wm1 s PHE 294 Ca 0.56 1.45 0.24 0.00 0.00 0.00 0.00 56.93 59.17 2wm1 s PHE 294 Cb 0.46 -2.68 1.59 0.00 0.00 0.00 0.00 43.02 42.38 2wm1 s PHE 294 CO 0.12 0.20 2.21 -1.00 -0.00 0.00 0.00 175.22 176.75 2wm1 h PRO 295 N 2.90 0.00 0.00 0.24 0.13 -1.98 -1.54 132.00 131.75 2wm1 h PRO 295 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2wm1 h PRO 295 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2wm1 h PRO 295 CO 0.65 0.00 0.00 -0.11 -0.23 0.00 0.00 178.00 178.31 2wm1 n LEU 296 N -4.15 0.00 0.00 1.56 0.00 -1.26 -4.83 117.00 108.32 2wm1 n LEU 296 Ca -0.03 0.03 -0.23 0.00 0.00 0.00 0.00 56.01 55.78 2wm1 n LEU 296 Cb 0.09 -0.03 0.15 0.00 0.00 0.00 0.00 43.42 43.64 2wm1 n LEU 296 CO 0.30 -0.01 0.66 0.61 0.00 0.00 0.00 177.39 178.95 2wm1 n GLY 297 N 0.53 -0.93 3.67 -3.96 0.00 -0.58 -5.01 105.19 98.92 2wm1 n GLY 297 Ca 0.18 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2wm1 n GLY 297 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wm1 s GLU 298 N -5.19 4.33 0.09 1.61 2.12 -0.83 -4.97 118.70 115.86 2wm1 s GLU 298 Ca 0.60 1.31 -0.14 0.00 0.36 0.00 0.00 54.97 57.10 2wm1 s GLU 298 Cb -0.02 -3.59 -0.17 0.00 0.26 0.00 0.00 34.13 30.61 2wm1 s GLU 298 CO 0.41 -0.45 1.28 -0.07 -0.54 0.00 0.00 175.26 175.90 2wm1 h LEU 299 N 8.68 0.90 -7.81 2.70 3.38 -1.92 -3.37 115.31 117.87 2wm1 h LEU 299 Ca -0.26 -0.64 -0.74 0.00 0.09 0.00 0.00 57.88 56.34 2wm1 h LEU 299 Cb 1.11 -0.27 -0.30 0.00 0.09 0.00 0.00 40.66 41.29 2wm1 h LEU 299 CO 0.90 1.39 -0.24 -1.61 0.09 0.00 0.00 178.44 178.98 2wm1 s GLU 300 N -3.71 2.85 0.23 1.13 0.41 -1.26 -5.08 118.70 113.27 2wm1 s GLU 300 Ca -0.11 -2.20 -0.32 0.00 -0.41 0.00 0.00 54.97 51.94 2wm1 s GLU 300 Cb 0.08 -4.03 -0.13 0.00 -1.78 0.00 0.00 34.13 28.27 2wm1 s GLU 300 CO 0.89 -1.22 1.55 -2.30 -0.49 0.00 0.00 175.26 173.69 2wm1 n PRO 301 N 4.22 2.35 0.00 0.39 -0.02 -1.26 -1.60 135.00 139.08 2wm1 n PRO 301 Ca 0.03 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 2wm1 n PRO 301 Cb 0.42 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 2wm1 n PRO 301 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wm1 n GLY 302 N 2.78 2.24 0.21 -1.23 0.00 -1.26 -3.60 105.19 104.33 2wm1 n GLY 302 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.08 2wm1 n GLY 302 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2wm1 h LYS 303 N 2.46 0.67 -0.28 1.61 3.64 -1.73 -1.54 116.57 121.40 2wm1 h LYS 303 Ca 0.00 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2wm1 h LYS 303 Cb 0.00 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.63 2wm1 h LYS 303 CO 0.00 0.44 0.02 1.25 -2.27 0.00 0.00 179.45 178.89 2wm1 h LEU 304 N 0.69 -0.07 -0.28 5.20 5.85 -1.92 -1.17 115.31 123.61 2wm1 h LEU 304 Ca 0.19 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.97 2wm1 h LEU 304 Cb -0.07 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2wm1 h LEU 304 CO -0.04 -0.00 0.17 0.40 -0.34 0.00 0.00 178.44 178.62 2wm1 h ILE 305 N 0.11 1.04 0.00 4.05 2.04 -1.91 -2.32 117.51 120.51 2wm1 h ILE 305 Ca 0.13 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.87 2wm1 h ILE 305 Cb 0.16 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 2wm1 h ILE 305 CO -0.21 0.06 0.00 -0.33 0.00 0.00 0.00 178.15 177.68 2wm1 h GLU 306 N 0.35 0.00 -0.03 2.37 5.08 -1.11 -2.25 114.58 118.98 2wm1 h GLU 306 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2wm1 h GLU 306 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2wm1 h GLU 306 CO -0.05 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.83 2wm1 n SER 307 N -3.06 0.73 -4.48 1.42 3.41 -0.46 -4.78 113.62 106.41 2wm1 n SER 307 Ca 0.00 -1.32 -0.43 0.00 -0.26 0.00 0.00 58.87 56.86 2wm1 n SER 307 Cb 0.27 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.17 2wm1 n SER 307 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2wm1 s MET 308 N -1.97 3.19 0.60 4.33 -1.94 -0.85 -4.88 119.30 117.78 2wm1 s MET 308 Ca 0.40 -0.61 0.38 0.00 -1.71 0.00 0.00 55.69 54.14 2wm1 s MET 308 Cb 0.20 -4.15 1.79 0.00 2.01 0.00 0.00 34.83 34.68 2wm1 s MET 308 CO 0.32 -1.66 2.14 1.05 -0.01 0.00 0.00 175.02 176.87 2wm1 h GLU 309 N 9.44 0.00 0.00 2.03 9.09 -1.90 -2.60 114.58 130.64 2wm1 h GLU 309 Ca -0.28 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.13 2wm1 h GLU 309 Cb 1.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.17 2wm1 h GLU 309 CO 1.13 0.01 0.00 0.39 0.05 0.00 0.00 179.01 180.59 2wm1 n GLU 310 N -3.11 0.05 -4.48 1.06 1.02 -1.26 -4.78 120.64 109.13 2wm1 n GLU 310 Ca -0.01 0.18 -0.34 0.00 -0.02 0.00 0.00 57.16 56.97 2wm1 n GLU 310 Cb 0.21 -1.58 -0.12 0.00 -0.02 0.00 0.00 31.44 29.93 2wm1 n GLU 310 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2wm1 s PHE 311 N -3.05 3.00 1.03 -0.32 0.08 -0.98 -5.11 117.98 112.62 2wm1 s PHE 311 Ca 0.10 -0.21 -0.17 0.00 0.12 0.00 0.00 56.93 56.77 2wm1 s PHE 311 Cb 0.13 -1.88 0.22 0.00 -0.57 0.00 0.00 43.02 40.92 2wm1 s PHE 311 CO 0.41 0.08 1.23 0.16 -0.10 0.00 0.00 175.22 177.00 2wm1 s ASP 312 N -0.01 2.47 0.26 1.36 1.47 -1.26 -4.81 116.67 116.15 2wm1 s ASP 312 Ca 0.00 0.46 0.08 0.00 1.18 0.00 0.00 52.55 54.28 2wm1 s ASP 312 Cb -0.13 -0.63 0.32 0.00 -0.34 0.00 0.00 42.92 42.14 2wm1 s ASP 312 CO 0.03 -3.15 1.60 -0.08 0.68 0.00 0.00 175.17 174.25 2wm1 h GLU 313 N -1.92 0.09 -0.19 2.11 4.57 -1.99 -1.66 114.58 115.59 2wm1 h GLU 313 Ca -0.45 -0.06 -0.17 0.00 -1.18 0.00 0.00 59.36 57.50 2wm1 h GLU 313 Cb 1.27 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.86 2wm1 h GLU 313 CO 0.40 0.67 -0.59 1.49 -1.18 0.00 0.00 179.01 179.80 2wm1 h GLU 314 N 0.06 0.60 -0.13 1.92 4.81 -1.99 -2.23 114.58 117.63 2wm1 h GLU 314 Ca -0.01 -0.40 -0.01 0.00 -0.13 0.00 0.00 59.36 58.81 2wm1 h GLU 314 Cb 1.09 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2wm1 h GLU 314 CO 0.08 1.02 0.03 1.15 -0.73 0.00 0.00 179.01 180.56 2wm1 h THR 315 N 0.45 1.21 -1.00 0.32 2.02 -1.82 -1.90 112.91 112.20 2wm1 h THR 315 Ca 0.00 -0.66 0.16 0.00 0.77 0.00 0.00 66.41 66.68 2wm1 h THR 315 Cb 1.15 1.40 -0.10 0.00 -1.74 0.00 0.00 68.15 68.86 2wm1 h THR 315 CO 0.11 0.19 0.62 0.11 0.37 0.00 0.00 175.52 176.93 2wm1 h LYS 316 N 0.00 0.81 -0.35 6.66 1.57 -1.25 -0.99 116.57 123.03 2wm1 h LYS 316 Ca 0.04 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 2wm1 h LYS 316 Cb 0.28 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2wm1 h LYS 316 CO 0.00 0.54 -0.31 -0.91 -0.57 0.00 0.00 179.45 178.20 2wm1 h ASN 317 N 0.84 0.79 -0.08 0.86 -0.26 -1.27 0.53 115.58 116.98 2wm1 h ASN 317 Ca 0.54 -0.32 -0.00 0.00 -0.56 0.00 0.00 56.30 55.96 2wm1 h ASN 317 Cb 0.75 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 37.79 2wm1 h ASN 317 CO -0.32 1.04 0.04 0.11 -1.06 0.00 0.00 177.43 177.24 2wm1 h LYS 318 N 0.64 0.11 -0.78 0.81 1.57 -0.60 -1.44 116.57 116.88 2wm1 h LYS 318 Ca 0.07 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2wm1 h LYS 318 Cb 0.84 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.09 2wm1 h LYS 318 CO 0.07 0.15 0.36 -0.07 -0.57 0.00 0.00 179.45 179.39 2wm1 h LEU 319 N 0.04 1.03 -0.50 2.94 3.38 -0.99 -0.33 115.31 120.89 2wm1 h LEU 319 Ca 0.03 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 2wm1 h LEU 319 Cb 0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2wm1 h LEU 319 CO -0.00 0.89 -0.53 0.11 0.09 0.00 0.00 178.44 178.99 2wm1 h LYS 320 N 1.11 0.00 0.00 1.13 1.57 -0.86 -0.42 116.57 119.10 2wm1 h LYS 320 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 2wm1 h LYS 320 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2wm1 h LYS 320 CO -0.03 0.53 0.00 0.00 -0.57 0.00 0.00 179.45 179.38 2wm1 n ALA 321 N -2.29 0.82 -0.18 3.86 0.00 -0.62 -0.52 120.51 121.58 2wm1 n ALA 321 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 2wm1 n ALA 321 Cb 0.65 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.23 2wm1 n ALA 321 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2wm1 h GLY 322 N 0.00 1.03 1.37 0.00 0.00 -0.87 -1.87 103.07 102.74 2wm1 h GLY 322 Ca 0.00 -0.63 -0.09 0.00 0.00 0.00 0.00 47.33 46.61 2wm1 h GLY 322 CO 0.00 0.59 -0.09 3.43 0.00 0.00 0.00 176.54 180.47 2wm1 h ASN 323 N 0.92 0.74 -0.51 0.19 2.35 -1.33 -1.73 115.58 116.20 2wm1 h ASN 323 Ca 0.19 -0.21 -0.05 0.00 -0.55 0.00 0.00 56.30 55.69 2wm1 h ASN 323 Cb 0.35 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 2wm1 h ASN 323 CO 0.00 0.86 0.14 0.00 -1.65 0.00 0.00 177.43 176.78 2wm1 h ALA 324 N 1.21 0.67 -0.42 -0.83 0.00 -1.66 -1.08 119.26 117.14 2wm1 h ALA 324 Ca 0.12 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 2wm1 h ALA 324 Cb 0.55 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2wm1 h ALA 324 CO 0.03 0.35 -0.15 -0.07 0.00 0.00 0.00 179.25 179.41 2wm1 h LEU 325 N 0.70 0.79 0.04 0.00 3.38 -1.16 -0.97 115.31 118.09 2wm1 h LEU 325 Ca 0.16 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 2wm1 h LEU 325 Cb 0.31 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2wm1 h LEU 325 CO -0.00 0.95 -0.02 0.00 0.09 0.00 0.00 178.44 179.45 2wm1 h ALA 326 N 1.12 -0.06 -0.82 1.53 0.00 -1.18 -0.03 119.26 119.82 2wm1 h ALA 326 Ca 0.11 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2wm1 h ALA 326 Cb 0.65 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 2wm1 h ALA 326 CO 0.05 -0.44 0.50 0.35 0.00 0.00 0.00 179.25 179.71 2wm1 h PHE 327 N -0.23 0.93 0.00 0.00 3.57 -1.04 -2.68 116.94 117.49 2wm1 h PHE 327 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2wm1 h PHE 327 Cb 0.21 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.65 2wm1 h PHE 327 CO -0.02 0.49 -0.26 1.28 -2.23 0.00 0.00 178.31 177.57 2wm1 n LEU 328 N -4.64 0.64 -0.92 0.59 4.77 -0.38 -4.74 117.00 112.32 2wm1 n LEU 328 Ca 0.11 0.40 -0.07 0.00 -0.03 0.00 0.00 56.01 56.42 2wm1 n LEU 328 Cb 0.15 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2wm1 n LEU 328 CO 0.31 -0.09 -0.06 0.61 -1.33 0.00 0.00 177.39 176.83 2wm1 n GLY 329 N 1.36 0.13 3.68 -0.72 0.00 -0.16 -4.86 105.19 104.62 2wm1 n GLY 329 Ca 0.05 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.23 2wm1 n GLY 329 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wm1 s LEU 330 N -2.21 3.39 -0.04 0.99 1.43 -0.41 -5.04 118.68 116.79 2wm1 s LEU 330 Ca 0.03 -0.29 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 2wm1 s LEU 330 Cb -0.01 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 2wm1 s LEU 330 CO 0.04 0.13 1.37 -1.61 0.23 0.00 0.00 176.35 176.50 2wm1 s GLU 331 N -2.65 4.28 0.00 1.70 0.41 -1.26 -4.65 118.70 116.53 2wm1 s GLU 331 Ca 0.27 1.88 0.00 0.00 -0.41 0.00 0.00 54.97 56.71 2wm1 s GLU 331 Cb -0.10 -3.64 0.00 0.00 -1.78 0.00 0.00 34.13 28.60 2wm1 s GLU 331 CO 0.18 -0.60 0.01 0.54 -0.49 0.00 0.00 175.26 174.91