#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bw0 s SER -1 N 0.00 6.30 0.09 1.69 0.15 -1.26 -4.74 113.70 115.94 2bw0 s SER -1 Ca 0.00 -0.12 0.01 0.00 0.70 0.00 0.00 55.95 56.54 2bw0 s SER -1 Cb 0.00 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.72 2bw0 s SER -1 CO 0.00 -1.65 0.21 -0.04 1.20 0.00 0.00 173.24 172.95 2bw0 s MET 1 N 5.34 3.33 -0.34 5.44 -1.94 -1.26 -4.92 119.30 124.95 2bw0 s MET 1 Ca 0.40 -0.54 -0.23 0.00 -1.71 0.00 0.00 55.69 53.61 2bw0 s MET 1 Cb -0.08 -2.96 0.00 0.00 2.01 0.00 0.00 34.83 33.81 2bw0 s MET 1 CO 0.21 0.57 0.76 0.15 -0.01 0.00 0.00 175.02 176.70 2bw0 s LYS 2 N -2.72 3.82 -0.07 2.03 1.02 -1.26 -1.09 119.74 121.47 2bw0 s LYS 2 Ca 0.34 0.36 0.05 0.00 0.02 0.00 0.00 55.97 56.74 2bw0 s LYS 2 Cb -0.12 -3.78 -0.01 0.00 -0.52 0.00 0.00 37.83 33.40 2bw0 s LYS 2 CO 0.27 -0.77 -0.22 0.42 -0.92 0.00 0.00 175.35 174.13 2bw0 s ILE 3 N 2.98 2.31 -0.15 2.17 1.01 0.22 0.36 121.20 130.09 2bw0 s ILE 3 Ca 0.30 -0.97 -0.13 0.00 0.00 0.00 0.00 60.65 59.86 2bw0 s ILE 3 Cb -0.14 -1.87 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 2bw0 s ILE 3 CO 0.15 0.57 0.27 0.00 0.00 0.00 0.00 174.94 175.92 2bw0 s ALA 4 N -0.10 3.63 -0.23 9.38 0.00 -0.36 -0.97 121.76 133.11 2bw0 s ALA 4 Ca -0.05 -0.48 -0.07 0.00 0.00 0.00 0.00 51.96 51.36 2bw0 s ALA 4 Cb -0.14 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 20.61 2bw0 s ALA 4 CO 0.04 0.15 0.06 0.08 0.00 0.00 0.00 175.76 176.09 2bw0 s VAL 5 N 0.28 4.30 -0.29 0.00 1.01 -0.43 -0.99 120.40 124.29 2bw0 s VAL 5 Ca 0.16 -0.18 0.03 0.00 0.00 0.00 0.00 61.98 61.99 2bw0 s VAL 5 Cb -0.13 -2.99 0.07 0.00 0.00 0.00 0.00 36.38 33.33 2bw0 s VAL 5 CO 0.04 0.37 -0.05 -0.63 0.00 0.00 0.00 175.10 174.82 2bw0 s ILE 6 N 1.34 2.23 0.00 2.22 1.01 -0.03 -1.09 121.20 126.89 2bw0 s ILE 6 Ca 0.05 -1.86 0.00 0.00 0.00 0.00 0.00 60.65 58.84 2bw0 s ILE 6 Cb -0.15 -2.43 0.00 0.00 0.01 0.00 0.00 42.46 39.90 2bw0 s ILE 6 CO 0.03 -0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.37 2bw0 n GLY 7 N 4.38 0.67 3.81 6.18 0.00 -0.46 -3.56 105.19 116.21 2bw0 n GLY 7 Ca -0.08 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.20 2bw0 n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bw0 s GLN 8 N -0.22 1.49 0.16 1.61 -2.07 -0.77 -4.16 119.66 115.69 2bw0 s GLN 8 Ca 0.00 -0.87 0.00 0.00 -1.82 0.00 0.00 55.36 52.67 2bw0 s GLN 8 Cb 0.00 0.48 0.00 0.00 -1.09 0.00 0.00 33.01 32.40 2bw0 s GLN 8 CO 0.00 -0.69 0.00 0.45 -1.32 0.00 0.00 175.29 173.73 2bw0 n SER 9 N -0.71 -3.75 -0.10 12.60 2.88 -1.26 -1.81 113.62 121.47 2bw0 n SER 9 Ca -0.05 0.28 0.02 0.00 -1.33 0.00 0.00 58.87 57.78 2bw0 n SER 9 Cb 0.60 -1.93 0.32 0.00 -0.75 0.00 0.00 64.21 62.45 2bw0 n SER 9 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2bw0 h LEU 10 N -0.59 0.65 -0.27 2.46 5.85 -1.99 -0.68 115.31 120.74 2bw0 h LEU 10 Ca 0.00 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.74 2bw0 h LEU 10 Cb 0.58 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 2bw0 h LEU 10 CO 0.01 0.51 -0.05 0.15 -0.34 0.00 0.00 178.44 178.71 2bw0 h PHE 11 N 0.75 -0.12 -0.49 1.25 3.57 -1.98 -0.08 116.94 119.85 2bw0 h PHE 11 Ca 0.20 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.72 2bw0 h PHE 11 Cb -0.02 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 2bw0 h PHE 11 CO 0.00 -0.10 0.32 0.78 -2.23 0.00 0.00 178.31 177.08 2bw0 h GLY 12 N 0.02 0.69 0.61 2.40 0.00 -0.65 -1.85 103.07 104.29 2bw0 h GLY 12 Ca 0.13 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.25 2bw0 h GLY 12 CO -0.27 0.26 0.09 -1.61 0.00 0.00 0.00 176.54 175.01 2bw0 h GLN 13 N 0.66 0.21 -0.66 4.80 4.15 -0.65 -0.49 115.11 123.14 2bw0 h GLN 13 Ca 0.18 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.52 2bw0 h GLN 13 Cb -0.07 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.55 2bw0 h GLN 13 CO -0.04 0.14 0.16 0.93 -1.93 0.00 0.00 178.83 178.09 2bw0 h GLU 14 N 0.22 1.06 -0.37 1.69 4.39 -0.66 -0.33 114.58 120.57 2bw0 h GLU 14 Ca 0.17 -0.26 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 2bw0 h GLU 14 Cb 0.18 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2bw0 h GLU 14 CO -0.21 0.95 0.14 0.28 -1.16 0.00 0.00 179.01 179.01 2bw0 h VAL 15 N 0.99 1.20 -0.28 3.13 2.07 -1.13 -1.48 116.25 120.74 2bw0 h VAL 15 Ca 0.21 -0.63 0.07 0.00 0.82 0.00 0.00 66.70 67.16 2bw0 h VAL 15 Cb 0.37 0.92 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 2bw0 h VAL 15 CO 0.00 0.22 -0.22 0.22 0.02 0.00 0.00 177.57 177.81 2bw0 h TYR 16 N 0.45 -0.59 -0.93 1.57 3.20 -0.91 -0.80 116.97 118.97 2bw0 h TYR 16 Ca 0.12 0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.05 2bw0 h TYR 16 Cb 0.22 0.30 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 2bw0 h TYR 16 CO 0.00 -0.30 0.61 0.00 -1.64 0.00 0.00 178.16 176.83 2bw0 h HIS 18 N 1.23 0.84 -0.72 0.00 3.86 -0.67 -1.35 115.15 118.34 2bw0 h HIS 18 Ca 0.35 -0.19 -0.05 0.00 -1.16 0.00 0.00 60.37 59.32 2bw0 h HIS 18 Cb -0.10 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.14 2bw0 h HIS 18 CO -0.01 0.89 0.25 -0.07 0.86 0.00 0.00 177.93 179.85 2bw0 h LEU 19 N 0.65 1.04 -0.54 2.43 3.38 -0.77 -0.28 115.31 121.21 2bw0 h LEU 19 Ca 0.09 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2bw0 h LEU 19 Cb 0.72 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2bw0 h LEU 19 CO 0.06 0.96 0.07 0.03 0.09 0.00 0.00 178.44 179.64 2bw0 h ARG 20 N 1.06 0.91 -0.27 1.13 3.08 -1.27 -2.05 114.38 116.96 2bw0 h ARG 20 Ca 0.24 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 2bw0 h ARG 20 Cb 0.28 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2bw0 h ARG 20 CO -0.01 0.89 0.02 -0.22 -1.07 0.00 0.00 179.97 179.58 2bw0 h LYS 21 N 0.80 0.40 0.00 0.04 3.64 -0.58 -1.52 116.57 119.35 2bw0 h LYS 21 Ca 0.16 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2bw0 h LYS 21 Cb 0.43 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2bw0 h LYS 21 CO 0.01 0.42 0.00 0.39 -2.27 0.00 0.00 179.45 178.00 2bw0 n GLU 22 N -4.34 0.84 -0.18 1.90 -0.58 -0.18 -4.89 120.64 113.21 2bw0 n GLU 22 Ca 0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2bw0 n GLU 22 Cb 0.20 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 2bw0 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2bw0 n GLY 23 N 0.99 0.75 3.87 0.62 0.00 -0.57 -5.04 105.19 105.80 2bw0 n GLY 23 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 2bw0 n GLY 23 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bw0 s HIS 24 N -2.18 3.52 -0.32 1.61 3.76 -0.79 -4.68 115.29 116.21 2bw0 s HIS 24 Ca 0.00 1.21 -0.12 0.00 -0.15 0.00 0.00 55.06 56.00 2bw0 s HIS 24 Cb 0.00 -2.60 -0.03 0.00 1.11 0.00 0.00 32.58 31.06 2bw0 s HIS 24 CO 0.00 -0.36 0.22 -2.00 -0.85 0.00 0.00 174.74 171.75 2bw0 s GLU 25 N -4.36 3.64 -0.57 1.40 2.12 -0.25 -4.34 118.70 116.34 2bw0 s GLU 25 Ca 0.54 -0.54 -0.28 0.00 0.36 0.00 0.00 54.97 55.05 2bw0 s GLU 25 Cb -0.10 -3.74 0.03 0.00 0.26 0.00 0.00 34.13 30.58 2bw0 s GLU 25 CO 0.39 -0.35 1.20 0.08 -0.54 0.00 0.00 175.26 176.03 2bw0 s VAL 26 N 1.73 4.03 -0.28 3.70 1.01 -1.26 -0.61 120.40 128.71 2bw0 s VAL 26 Ca 0.06 0.94 0.27 0.00 0.00 0.00 0.00 61.98 63.25 2bw0 s VAL 26 Cb -0.17 -4.70 0.35 0.00 0.00 0.00 0.00 36.38 31.86 2bw0 s VAL 26 CO 0.10 -1.30 1.74 -0.37 0.00 0.00 0.00 175.10 175.28 2bw0 h VAL 27 N 6.18 0.00 -1.30 2.92 -1.51 -1.40 -3.46 116.25 117.67 2bw0 h VAL 27 Ca -0.25 -0.79 0.24 0.00 -1.23 0.00 0.00 66.70 64.67 2bw0 h VAL 27 Cb 1.06 1.78 -0.22 0.00 -2.13 0.00 0.00 31.29 31.78 2bw0 h VAL 27 CO 1.18 0.00 0.85 -0.83 -1.23 0.00 0.00 177.57 177.54 2bw0 s GLY 28 N -4.15 -0.16 -0.06 5.19 0.00 -1.25 -4.29 107.32 102.60 2bw0 s GLY 28 Ca 0.05 2.07 0.03 0.00 0.00 0.00 0.00 44.72 46.87 2bw0 s GLY 28 CO 0.62 0.78 -0.14 0.14 0.00 0.00 0.00 173.10 174.50 2bw0 s VAL 29 N -1.79 1.22 -0.21 1.40 1.01 0.49 -1.31 120.40 121.21 2bw0 s VAL 29 Ca 0.08 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 2bw0 s VAL 29 Cb -0.01 -1.09 0.02 0.00 0.00 0.00 0.00 36.38 35.30 2bw0 s VAL 29 CO -0.05 0.37 -0.13 -0.36 0.00 0.00 0.00 175.10 174.93 2bw0 s PHE 30 N 0.48 2.91 0.00 5.22 0.40 -0.25 -1.11 117.98 125.63 2bw0 s PHE 30 Ca -0.12 -1.50 0.00 0.00 -0.60 0.00 0.00 56.93 54.71 2bw0 s PHE 30 Cb -0.14 -1.99 0.00 0.00 0.51 0.00 0.00 43.02 41.39 2bw0 s PHE 30 CO 0.03 -0.74 0.00 -2.37 0.70 0.00 0.00 175.22 172.85 2bw0 n THR 31 N 4.66 0.00 -3.78 0.64 5.66 0.06 -1.35 114.28 120.16 2bw0 n THR 31 Ca -0.19 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.59 2bw0 n THR 31 Cb 0.49 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.25 2bw0 n THR 31 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2bw0 s VAL 32 N -1.21 5.13 0.81 1.08 -7.23 -1.26 -0.97 120.40 116.75 2bw0 s VAL 32 Ca 0.00 -0.86 -0.10 0.00 -1.81 0.00 0.00 61.98 59.21 2bw0 s VAL 32 Cb 0.00 -3.83 0.08 0.00 0.56 0.00 0.00 36.38 33.20 2bw0 s VAL 32 CO 0.00 -0.37 1.11 -2.84 -0.31 0.00 0.00 175.10 172.68 2bw0 s PRO 33 N -4.08 1.89 0.42 4.82 0.02 -1.26 -4.66 135.00 132.15 2bw0 s PRO 33 Ca 0.36 1.29 -0.24 0.00 0.02 0.00 0.00 61.00 62.43 2bw0 s PRO 33 Cb -0.09 -1.85 -0.10 0.00 0.02 0.00 0.00 34.50 32.48 2bw0 s PRO 33 CO 0.31 -1.94 1.05 -0.25 -0.33 0.00 0.00 177.00 175.84 2bw0 n ASP 34 N -3.72 1.45 -3.14 2.53 9.92 -1.26 -4.71 116.55 117.62 2bw0 n ASP 34 Ca 0.10 1.04 0.04 0.00 -0.53 0.00 0.00 54.79 55.45 2bw0 n ASP 34 Cb 0.53 -1.37 -0.00 0.00 -0.64 0.00 0.00 41.12 39.63 2bw0 n ASP 34 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2bw0 s LYS 35 N -2.05 0.41 -0.07 -1.24 2.47 -0.07 -4.76 119.74 114.44 2bw0 s LYS 35 Ca 0.63 0.33 -0.01 0.00 -1.56 0.00 0.00 55.97 55.36 2bw0 s LYS 35 Cb -0.55 0.16 0.03 0.00 -1.46 0.00 0.00 37.83 36.01 2bw0 s LYS 35 CO 0.57 -0.75 -0.02 0.34 0.16 0.00 0.00 175.35 175.66 2bw0 s ASP 36 N 2.78 1.41 0.00 1.43 -1.08 -1.26 -4.48 116.67 115.47 2bw0 s ASP 36 Ca 0.17 -0.11 0.00 0.00 -0.52 0.00 0.00 52.55 52.09 2bw0 s ASP 36 Cb -0.06 -0.46 0.00 0.00 -1.46 0.00 0.00 42.92 40.94 2bw0 s ASP 36 CO -0.23 -0.15 0.00 0.61 0.52 0.00 0.00 175.17 175.92 2bw0 n GLY 37 N 4.81 1.79 3.28 2.66 0.00 -1.26 -5.01 105.19 111.46 2bw0 n GLY 37 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.55 2bw0 n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bw0 s LYS 38 N -0.05 3.32 0.39 1.61 2.20 -1.26 -5.12 119.74 120.82 2bw0 s LYS 38 Ca 0.00 -0.66 -0.23 0.00 -0.36 0.00 0.00 55.97 54.72 2bw0 s LYS 38 Cb 0.00 -2.94 -0.11 0.00 -1.51 0.00 0.00 37.83 33.28 2bw0 s LYS 38 CO 0.00 -0.19 0.94 0.00 -0.36 0.00 0.00 175.35 175.74 2bw0 s ALA 39 N 1.42 3.11 0.29 3.13 0.00 -1.26 -0.89 121.76 127.57 2bw0 s ALA 39 Ca 0.05 0.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.16 2bw0 s ALA 39 Cb -0.14 -3.16 -0.12 0.00 0.00 0.00 0.00 23.12 19.71 2bw0 s ALA 39 CO -0.05 0.15 1.61 -3.47 0.00 0.00 0.00 175.76 174.01 2bw0 n ASP 40 N -0.16 3.92 0.21 0.00 -0.08 -1.26 -4.90 116.55 114.27 2bw0 n ASP 40 Ca 0.05 1.14 0.06 0.00 -1.51 0.00 0.00 54.79 54.53 2bw0 n ASP 40 Cb 0.52 -1.60 0.45 0.00 2.34 0.00 0.00 41.12 42.83 2bw0 n ASP 40 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2bw0 h PRO 41 N 4.92 0.00 -0.18 -0.67 0.13 -1.96 -1.19 132.00 133.05 2bw0 h PRO 41 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 2bw0 h PRO 41 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2bw0 h PRO 41 CO 0.80 0.31 -0.09 1.25 -0.23 0.00 0.00 178.00 180.04 2bw0 h LEU 42 N 0.00 0.39 -0.74 1.56 5.85 -1.92 -1.07 115.31 119.38 2bw0 h LEU 42 Ca -0.00 -0.41 0.05 0.00 0.84 0.00 0.00 57.88 58.35 2bw0 h LEU 42 Cb 0.65 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 2bw0 h LEU 42 CO 0.04 0.72 0.45 1.23 -0.34 0.00 0.00 178.44 180.54 2bw0 h GLY 43 N 0.06 1.08 1.08 3.75 0.00 -1.84 -1.48 103.07 105.73 2bw0 h GLY 43 Ca 0.04 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 46.95 2bw0 h GLY 43 CO 0.03 0.24 0.01 1.41 0.00 0.00 0.00 176.54 178.23 2bw0 h LEU 44 N 0.84 1.06 -0.31 3.11 3.38 -1.13 -0.73 115.31 121.53 2bw0 h LEU 44 Ca 0.31 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2bw0 h LEU 44 Cb 0.11 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2bw0 h LEU 44 CO -0.15 1.11 0.04 -0.08 0.09 0.00 0.00 178.44 179.45 2bw0 h GLU 45 N 0.99 0.53 -0.63 1.13 4.57 -0.88 -1.45 114.58 118.84 2bw0 h GLU 45 Ca 0.18 -0.14 -0.07 0.00 -1.18 0.00 0.00 59.36 58.14 2bw0 h GLU 45 Cb 0.55 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.06 2bw0 h GLU 45 CO 0.03 0.62 0.11 0.00 -1.18 0.00 0.00 179.01 178.59 2bw0 h ALA 46 N 0.88 1.00 -0.98 2.92 0.00 -1.17 -2.24 119.26 119.67 2bw0 h ALA 46 Ca 0.09 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.78 2bw0 h ALA 46 Cb 0.36 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 2bw0 h ALA 46 CO 0.01 0.64 0.64 0.93 0.00 0.00 0.00 179.25 181.47 2bw0 h GLU 47 N 0.97 1.21 -0.55 0.00 5.08 -0.86 -1.11 114.58 119.31 2bw0 h GLU 47 Ca 0.20 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.58 2bw0 h GLU 47 Cb 0.41 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2bw0 h GLU 47 CO 0.01 0.80 0.37 0.87 -1.00 0.00 0.00 179.01 180.06 2bw0 h LYS 48 N 1.24 0.35 -0.01 2.33 1.57 -0.66 -2.14 116.57 119.25 2bw0 h LYS 48 Ca 0.39 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 2bw0 h LYS 48 Cb -0.01 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.22 2bw0 h LYS 48 CO -0.12 0.23 -0.45 -0.25 -0.57 0.00 0.00 179.45 178.30 2bw0 n ASP 49 N -4.47 1.06 -0.17 0.86 8.00 -0.53 -4.94 116.55 116.37 2bw0 n ASP 49 Ca 0.09 -0.84 -0.02 0.00 0.71 0.00 0.00 54.79 54.72 2bw0 n ASP 49 Cb 0.36 0.33 -0.01 0.00 -0.02 0.00 0.00 41.12 41.78 2bw0 n ASP 49 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bw0 n GLY 50 N 1.41 0.55 3.74 0.44 0.00 -0.70 -5.02 105.19 105.61 2bw0 n GLY 50 Ca 0.09 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2bw0 n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bw0 s VAL 51 N -1.95 3.79 0.20 1.61 1.01 -0.58 -4.96 120.40 119.53 2bw0 s VAL 51 Ca 0.00 1.60 -0.32 0.00 0.00 0.00 0.00 61.98 63.26 2bw0 s VAL 51 Cb 0.00 -4.02 -0.15 0.00 0.00 0.00 0.00 36.38 32.21 2bw0 s VAL 51 CO 0.00 0.30 1.25 -2.65 0.00 0.00 0.00 175.10 174.00 2bw0 n PRO 52 N 2.12 1.51 -4.13 2.72 -0.02 -1.26 -4.37 135.00 131.56 2bw0 n PRO 52 Ca 0.02 0.54 -0.23 0.00 -2.02 0.00 0.00 63.50 61.80 2bw0 n PRO 52 Cb 0.46 -2.09 -0.17 0.00 -0.02 0.00 0.00 33.50 31.68 2bw0 n PRO 52 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2bw0 s VAL 53 N -0.17 0.76 -0.03 -1.45 1.01 -1.26 -0.38 120.40 118.88 2bw0 s VAL 53 Ca 0.71 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 62.53 2bw0 s VAL 53 Cb -0.77 -0.78 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 2bw0 s VAL 53 CO 0.51 0.30 -0.15 -0.36 0.00 0.00 0.00 175.10 175.40 2bw0 s PHE 54 N 1.23 1.51 -0.15 5.22 0.40 -0.26 -5.00 117.98 120.92 2bw0 s PHE 54 Ca -0.05 -0.40 0.01 0.00 -0.60 0.00 0.00 56.93 55.89 2bw0 s PHE 54 Cb -0.14 -1.02 0.00 0.00 0.51 0.00 0.00 43.02 42.37 2bw0 s PHE 54 CO -0.02 -0.12 -0.17 0.15 0.70 0.00 0.00 175.22 175.76 2bw0 s LYS 55 N -0.02 3.18 0.01 0.44 1.02 -1.26 -0.76 119.74 122.34 2bw0 s LYS 55 Ca -0.02 -0.77 0.00 0.00 0.02 0.00 0.00 55.97 55.20 2bw0 s LYS 55 Cb -0.10 -2.58 -0.01 0.00 -0.52 0.00 0.00 37.83 34.62 2bw0 s LYS 55 CO 0.01 0.01 -0.01 0.71 -0.92 0.00 0.00 175.35 175.15 2bw0 s TYR 56 N 0.81 0.12 -0.26 3.18 2.02 -0.15 -4.75 117.35 118.33 2bw0 s TYR 56 Ca -0.06 -0.21 -0.04 0.00 -0.37 0.00 0.00 57.07 56.39 2bw0 s TYR 56 Cb -0.15 -0.09 -0.14 0.00 -0.40 0.00 0.00 41.96 41.18 2bw0 s TYR 56 CO -0.00 -0.07 -0.27 -1.13 -1.57 0.00 0.00 175.55 172.50 2bw0 n SER 57 N 2.50 1.99 -4.68 2.29 3.41 -1.26 -4.28 113.62 113.58 2bw0 n SER 57 Ca -0.17 0.05 -0.32 0.00 -0.26 0.00 0.00 58.87 58.17 2bw0 n SER 57 Cb 0.58 -0.55 -0.09 0.00 -0.26 0.00 0.00 64.21 63.89 2bw0 n SER 57 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2bw0 s ARG 58 N -2.49 2.78 0.00 4.33 0.52 -1.26 -5.02 118.95 117.80 2bw0 s ARG 58 Ca -0.35 -0.62 0.04 0.00 -0.52 0.00 0.00 55.73 54.28 2bw0 s ARG 58 Cb 0.11 -2.66 0.04 0.00 0.52 0.00 0.00 34.95 32.96 2bw0 s ARG 58 CO 0.53 0.62 0.68 0.91 0.02 0.00 0.00 175.30 178.06 2bw0 n TRP 59 N 1.35 0.02 -4.10 -0.53 7.02 -1.26 -5.00 117.44 114.94 2bw0 n TRP 59 Ca -0.14 -0.05 -0.11 0.00 -1.02 0.00 0.00 57.50 56.17 2bw0 n TRP 59 Cb 0.53 -0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.31 2bw0 n TRP 59 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2bw0 s ARG 60 N -0.41 0.63 -0.02 -0.99 0.52 -1.26 -1.09 118.95 116.34 2bw0 s ARG 60 Ca 0.05 -1.02 -0.29 0.00 -0.52 0.00 0.00 55.73 53.95 2bw0 s ARG 60 Cb 0.03 -0.15 0.07 0.00 0.52 0.00 0.00 34.95 35.42 2bw0 s ARG 60 CO 0.05 -0.01 0.65 0.00 0.02 0.00 0.00 175.30 176.01 2bw0 s ALA 61 N -2.58 -1.68 -1.27 2.13 0.00 0.59 -4.72 121.76 114.23 2bw0 s ALA 61 Ca -0.00 1.13 -0.09 0.00 0.00 0.00 0.00 51.96 53.00 2bw0 s ALA 61 Cb -0.02 0.14 0.07 0.00 0.00 0.00 0.00 23.12 23.32 2bw0 s ALA 61 CO -0.03 -0.42 0.47 1.17 0.00 0.00 0.00 175.76 176.95 2bw0 n LYS 62 N 0.73 -3.27 -0.98 0.00 3.00 -1.26 -0.89 118.16 115.50 2bw0 n LYS 62 Ca -0.19 0.45 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 2bw0 n LYS 62 Cb 0.58 -5.15 0.00 0.00 0.00 0.00 0.00 35.03 30.46 2bw0 n LYS 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2bw0 n GLY 63 N -1.15 0.61 3.31 3.14 0.00 -1.26 -5.00 105.19 104.85 2bw0 n GLY 63 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 2bw0 n GLY 63 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bw0 s GLN 64 N -0.18 1.25 0.28 1.61 -1.52 -0.06 -5.12 119.66 115.92 2bw0 s GLN 64 Ca 0.00 -1.59 -0.30 0.00 -1.95 0.00 0.00 55.36 51.53 2bw0 s GLN 64 Cb 0.00 -0.75 -0.13 0.00 -0.22 0.00 0.00 33.01 31.90 2bw0 s GLN 64 CO 0.00 0.03 1.30 0.00 -0.25 0.00 0.00 175.29 176.37 2bw0 n ALA 65 N -0.34 0.95 -1.69 6.09 0.00 -1.26 -0.30 120.51 123.95 2bw0 n ALA 65 Ca -0.08 0.39 -0.53 0.00 0.00 0.00 0.00 53.44 53.22 2bw0 n ALA 65 Cb 0.62 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.78 2bw0 n ALA 65 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2bw0 n LEU 66 N 1.47 2.87 -0.14 0.00 7.94 -0.25 -4.66 117.00 124.23 2bw0 n LEU 66 Ca 0.09 1.01 0.13 0.00 -1.11 0.00 0.00 56.01 56.13 2bw0 n LEU 66 Cb 0.33 -1.25 0.48 0.00 0.53 0.00 0.00 43.42 43.51 2bw0 n LEU 66 CO 0.62 -0.26 1.20 1.55 -1.11 0.00 0.00 177.39 179.39 2bw0 h PRO 67 N 8.32 0.45 -0.25 1.96 0.13 -1.92 -1.38 132.00 139.31 2bw0 h PRO 67 Ca -0.47 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 64.68 2bw0 h PRO 67 Cb 1.30 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2bw0 h PRO 67 CO 0.96 0.30 -0.05 0.22 -0.23 0.00 0.00 178.00 179.20 2bw0 h ASP 68 N 0.46 -0.20 -0.19 1.44 -0.00 -2.00 -0.97 116.42 114.96 2bw0 h ASP 68 Ca 0.34 0.07 -0.17 0.00 -0.00 0.00 0.00 57.03 57.27 2bw0 h ASP 68 Cb 0.68 0.14 -0.00 0.00 -0.00 0.00 0.00 39.33 40.15 2bw0 h ASP 68 CO -0.11 -0.07 -0.49 1.62 -0.00 0.00 0.00 179.24 180.19 2bw0 h VAL 69 N 0.02 1.29 -0.47 2.25 3.04 -1.67 -2.13 116.25 118.57 2bw0 h VAL 69 Ca 0.12 -1.69 0.01 0.00 -1.01 0.00 0.00 66.70 64.13 2bw0 h VAL 69 Cb 0.18 1.60 -0.02 0.00 -2.01 0.00 0.00 31.29 31.03 2bw0 h VAL 69 CO -0.25 0.55 0.31 0.58 -1.01 0.00 0.00 177.57 177.75 2bw0 h VAL 70 N 0.60 1.11 0.06 1.51 2.07 -1.10 -0.01 116.25 120.50 2bw0 h VAL 70 Ca 0.03 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2bw0 h VAL 70 Cb 1.07 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2bw0 h VAL 70 CO 0.11 0.12 -0.03 0.00 0.02 0.00 0.00 177.57 177.78 2bw0 h ALA 71 N 1.18 -0.09 -0.87 1.67 0.00 -1.00 0.25 119.26 120.40 2bw0 h ALA 71 Ca 0.18 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.10 2bw0 h ALA 71 Cb -0.06 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.68 2bw0 h ALA 71 CO -0.04 -0.47 0.50 0.87 0.00 0.00 0.00 179.25 180.11 2bw0 h LYS 72 N -0.25 0.79 -0.32 0.00 1.57 -1.24 -2.05 116.57 115.08 2bw0 h LYS 72 Ca -0.01 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2bw0 h LYS 72 Cb 0.22 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2bw0 h LYS 72 CO 0.01 0.52 -0.06 -0.92 -0.57 0.00 0.00 179.45 178.44 2bw0 h TYR 73 N 0.82 0.68 0.00 -1.35 3.20 -0.61 -3.20 116.97 116.50 2bw0 h TYR 73 Ca 0.43 -0.14 -0.07 0.00 3.14 0.00 0.00 58.73 62.09 2bw0 h TYR 73 Cb 0.43 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 2bw0 h TYR 73 CO -0.05 0.77 -0.35 1.96 -1.64 0.00 0.00 178.16 178.86 2bw0 h GLN 74 N 0.39 0.00 0.00 1.82 1.08 -0.07 -2.33 115.11 116.00 2bw0 h GLN 74 Ca 0.08 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2bw0 h GLN 74 Cb 0.54 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.97 2bw0 h GLN 74 CO 0.03 0.35 -0.02 0.00 -0.95 0.00 0.00 178.83 178.23 2bw0 h ALA 75 N 1.65 1.75 0.00 3.87 0.00 -1.38 -3.17 119.26 121.99 2bw0 h ALA 75 Ca -0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2bw0 h ALA 75 Cb 0.65 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2bw0 h ALA 75 CO 0.04 0.02 -0.42 -0.07 0.00 0.00 0.00 179.25 178.83 2bw0 h LEU 76 N 0.00 0.00 1.04 0.00 3.38 -1.53 -3.47 115.31 114.73 2bw0 h LEU 76 Ca -0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 2bw0 h LEU 76 Cb 0.04 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.80 2bw0 h LEU 76 CO 0.00 0.42 -0.31 0.61 0.09 0.00 0.00 178.44 179.25 2bw0 n GLY 77 N 0.86 -0.05 3.77 0.83 0.00 -1.20 -4.90 105.19 104.50 2bw0 n GLY 77 Ca 0.01 -0.35 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 2bw0 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bw0 s ALA 78 N -2.71 3.34 -0.10 4.61 0.00 -1.26 -4.86 121.76 120.77 2bw0 s ALA 78 Ca 0.08 1.40 0.22 0.00 0.00 0.00 0.00 51.96 53.66 2bw0 s ALA 78 Cb -0.03 -3.55 -0.29 0.00 0.00 0.00 0.00 23.12 19.25 2bw0 s ALA 78 CO 0.09 -1.00 0.57 0.39 0.00 0.00 0.00 175.76 175.82 2bw0 n GLU 79 N 0.14 0.62 -3.77 0.00 1.02 0.16 -4.45 120.64 114.35 2bw0 n GLU 79 Ca 0.03 -0.15 -0.13 0.00 -0.02 0.00 0.00 57.16 56.89 2bw0 n GLU 79 Cb 0.42 -1.56 -0.11 0.00 -0.02 0.00 0.00 31.44 30.17 2bw0 n GLU 79 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2bw0 s LEU 80 N -4.55 0.86 -0.13 -4.62 2.96 -0.98 -0.28 118.68 111.94 2bw0 s LEU 80 Ca -0.06 0.60 -0.05 0.00 -0.22 0.00 0.00 54.13 54.39 2bw0 s LEU 80 Cb 0.14 1.02 -0.04 0.00 0.50 0.00 0.00 46.19 47.81 2bw0 s LEU 80 CO 0.89 -0.11 0.06 0.20 -1.32 0.00 0.00 176.35 176.08 2bw0 s ASN 81 N 0.15 5.69 -0.14 3.68 0.01 -0.76 -1.22 114.94 122.35 2bw0 s ASN 81 Ca -0.00 0.21 0.02 0.00 -0.71 0.00 0.00 52.86 52.38 2bw0 s ASN 81 Cb -0.02 -1.81 0.01 0.00 0.41 0.00 0.00 41.25 39.83 2bw0 s ASN 81 CO 0.00 0.32 -0.21 -0.69 -1.51 0.00 0.00 177.10 175.01 2bw0 s VAL 82 N -0.48 2.15 -0.72 1.60 1.01 -0.16 -1.12 120.40 122.68 2bw0 s VAL 82 Ca 0.10 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.14 2bw0 s VAL 82 Cb -0.12 -1.86 0.18 0.00 0.00 0.00 0.00 36.38 34.58 2bw0 s VAL 82 CO 0.02 0.55 0.53 -0.76 0.00 0.00 0.00 175.10 175.44 2bw0 s LEU 83 N 0.74 5.03 0.41 3.92 1.02 -0.03 -0.85 118.68 128.92 2bw0 s LEU 83 Ca -0.09 -3.50 0.22 0.00 0.02 0.00 0.00 54.13 50.78 2bw0 s LEU 83 Cb -0.16 -1.76 0.81 0.00 0.02 0.00 0.00 46.19 45.10 2bw0 s LEU 83 CO 0.00 -0.19 1.78 1.55 0.02 0.00 0.00 176.35 179.51 2bw0 h PRO 84 N 6.06 0.00 -0.18 1.29 0.13 -1.85 -1.74 132.00 135.72 2bw0 h PRO 84 Ca 0.08 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.36 2bw0 h PRO 84 Cb 0.83 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.78 2bw0 h PRO 84 CO 0.75 0.28 -0.08 0.12 -0.23 0.00 0.00 178.00 178.85 2bw0 s PHE 85 N -3.62 -0.31 -0.17 1.56 5.36 -1.26 -4.53 117.98 115.00 2bw0 s PHE 85 Ca 0.01 0.07 0.00 0.00 -0.96 0.00 0.00 56.93 56.05 2bw0 s PHE 85 Cb 0.10 0.06 0.03 0.00 -0.34 0.00 0.00 43.02 42.87 2bw0 s PHE 85 CO 0.66 -0.21 -0.11 0.00 -1.46 0.00 0.00 175.22 174.10 2bw0 n SER 87 N 4.75 0.00 -3.47 0.00 3.41 -1.26 -4.85 113.62 112.19 2bw0 n SER 87 Ca -0.15 -0.04 -0.14 0.00 -0.26 0.00 0.00 58.87 58.28 2bw0 n SER 87 Cb 0.48 -0.28 -0.06 0.00 -0.26 0.00 0.00 64.21 64.09 2bw0 n SER 87 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bw0 s GLN 88 N -2.57 1.75 -0.06 4.33 -2.07 -1.26 -4.95 119.66 114.84 2bw0 s GLN 88 Ca 0.21 -1.73 -0.20 0.00 -1.82 0.00 0.00 55.36 51.83 2bw0 s GLN 88 Cb 0.15 0.41 -0.05 0.00 -1.09 0.00 0.00 33.01 32.43 2bw0 s GLN 88 CO 0.35 -0.70 0.56 -0.59 -1.32 0.00 0.00 175.29 173.58 2bw0 s PHE 89 N -3.37 3.60 0.16 9.60 -0.00 -1.26 -5.06 117.98 121.65 2bw0 s PHE 89 Ca 0.32 1.08 -0.20 0.00 -0.00 0.00 0.00 56.93 58.13 2bw0 s PHE 89 Cb 0.01 -2.60 -0.08 0.00 -0.00 0.00 0.00 43.02 40.35 2bw0 s PHE 89 CO 0.19 0.26 0.67 0.42 -0.00 0.00 0.00 175.22 176.76 2bw0 s ILE 90 N 0.23 4.60 0.49 -4.49 -1.09 -1.26 -4.99 121.20 114.68 2bw0 s ILE 90 Ca 0.30 1.30 -0.24 0.00 -2.23 0.00 0.00 60.65 59.78 2bw0 s ILE 90 Cb -0.17 -3.91 -0.07 0.00 -1.58 0.00 0.00 42.46 36.73 2bw0 s ILE 90 CO 0.15 0.37 1.31 -2.65 -1.23 0.00 0.00 174.94 172.88 2bw0 n PRO 91 N 1.17 1.82 -0.04 2.79 -0.02 -1.26 -4.77 135.00 134.69 2bw0 n PRO 91 Ca -0.05 0.66 0.20 0.00 -2.02 0.00 0.00 63.50 62.28 2bw0 n PRO 91 Cb 0.51 -2.48 0.66 0.00 -0.02 0.00 0.00 33.50 32.16 2bw0 n PRO 91 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2bw0 h MET 92 N 1.76 0.08 0.00 -0.52 2.86 -1.98 -1.55 114.93 115.58 2bw0 h MET 92 Ca -0.50 -0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.10 2bw0 h MET 92 Cb 1.30 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.94 2bw0 h MET 92 CO 0.58 0.05 -0.18 1.49 1.06 0.00 0.00 176.91 179.92 2bw0 h GLU 93 N 0.08 0.00 0.07 1.72 4.81 -1.99 -0.79 114.58 118.48 2bw0 h GLU 93 Ca 0.29 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.30 2bw0 h GLU 93 Cb 1.02 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 2bw0 h GLU 93 CO -0.03 0.18 -1.12 0.82 -0.73 0.00 0.00 179.01 178.14 2bw0 h ILE 94 N 0.00 1.14 -0.83 2.32 1.08 -1.65 -3.28 117.51 116.29 2bw0 h ILE 94 Ca -0.00 -2.34 0.12 0.00 -0.39 0.00 0.00 64.86 62.25 2bw0 h ILE 94 Cb 0.32 2.72 -0.08 0.00 -3.07 0.00 0.00 36.82 36.71 2bw0 h ILE 94 CO 0.02 0.59 0.44 0.40 -0.69 0.00 0.00 178.15 178.91 2bw0 h ILE 95 N -0.60 0.80 -0.01 -0.67 1.08 -1.22 -2.35 117.51 114.54 2bw0 h ILE 95 Ca -0.26 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 2bw0 h ILE 95 Cb 1.51 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 2bw0 h ILE 95 CO -0.02 0.12 -0.23 -1.54 -0.69 0.00 0.00 178.15 175.80 2bw0 n SER 96 N -4.83 0.89 -0.09 1.72 3.41 -0.32 -4.04 113.62 110.36 2bw0 n SER 96 Ca 0.15 -0.80 -0.11 0.00 -0.26 0.00 0.00 58.87 57.85 2bw0 n SER 96 Cb 0.36 0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.37 2bw0 n SER 96 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bw0 h ALA 97 N 3.65 0.35 -2.24 7.33 0.00 -1.48 -3.46 119.26 123.41 2bw0 h ALA 97 Ca 0.00 -0.20 -0.48 0.00 0.00 0.00 0.00 54.91 54.24 2bw0 h ALA 97 Cb 0.47 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.19 2bw0 h ALA 97 CO 0.00 0.06 0.37 -1.25 0.00 0.00 0.00 179.25 178.43 2bw0 s PRO 98 N -5.12 3.77 0.20 0.00 0.04 -1.26 -4.96 135.00 127.67 2bw0 s PRO 98 Ca -0.14 1.08 -0.14 0.00 0.04 0.00 0.00 61.00 61.84 2bw0 s PRO 98 Cb 0.08 -2.10 0.21 0.00 0.04 0.00 0.00 34.50 32.72 2bw0 s PRO 98 CO 0.74 -0.43 1.65 -0.09 0.04 0.00 0.00 177.00 178.92 2bw0 h ARG 99 N 0.89 0.04 -0.01 4.56 2.43 -1.76 -1.69 114.38 118.86 2bw0 h ARG 99 Ca -0.47 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2bw0 h ARG 99 Cb 1.20 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2bw0 h ARG 99 CO 0.60 0.03 -0.08 0.72 -1.51 0.00 0.00 179.97 179.73 2bw0 n HIS 100 N -5.33 0.00 -3.00 2.20 8.25 0.61 -5.06 115.22 112.89 2bw0 n HIS 100 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 2bw0 n HIS 100 Cb 0.30 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.34 2bw0 n HIS 100 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bw0 n GLY 101 N 1.21 -1.69 3.13 -1.41 0.00 -0.64 -4.92 105.19 100.87 2bw0 n GLY 101 Ca 0.17 -1.51 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 2bw0 n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bw0 s SER 102 N -4.00 2.12 0.01 1.61 0.01 -1.26 -1.83 113.70 110.36 2bw0 s SER 102 Ca 0.00 -0.35 0.06 0.00 1.31 0.00 0.00 55.95 56.97 2bw0 s SER 102 Cb 0.00 -0.61 -0.03 0.00 0.21 0.00 0.00 66.02 65.59 2bw0 s SER 102 CO 0.00 0.14 -0.16 0.27 0.41 0.00 0.00 173.24 173.90 2bw0 s ILE 103 N 0.07 2.90 -0.03 1.44 -4.36 -0.28 -1.13 121.20 119.81 2bw0 s ILE 103 Ca -0.04 -1.02 0.03 0.00 -0.26 0.00 0.00 60.65 59.36 2bw0 s ILE 103 Cb -0.12 -2.19 0.00 0.00 1.25 0.00 0.00 42.46 41.40 2bw0 s ILE 103 CO 0.02 0.43 -0.11 -0.63 0.24 0.00 0.00 174.94 174.88 2bw0 s ILE 104 N -0.86 0.99 0.01 8.37 1.01 -0.04 -0.85 121.20 129.83 2bw0 s ILE 104 Ca 0.14 -0.47 -0.20 0.00 0.00 0.00 0.00 60.65 60.13 2bw0 s ILE 104 Cb -0.11 -0.88 -0.06 0.00 0.01 0.00 0.00 42.46 41.43 2bw0 s ILE 104 CO 0.04 0.30 0.57 -0.47 0.00 0.00 0.00 174.94 175.38 2bw0 s TYR 105 N 0.21 3.71 -0.04 3.97 5.04 -0.65 -0.88 117.35 128.71 2bw0 s TYR 105 Ca -0.05 1.19 -0.02 0.00 -2.44 0.00 0.00 57.07 55.75 2bw0 s TYR 105 Cb -0.10 -2.55 0.03 0.00 0.35 0.00 0.00 41.96 39.69 2bw0 s TYR 105 CO 0.01 0.43 0.06 -1.58 -1.34 0.00 0.00 175.55 173.13 2bw0 s HIS 106 N -0.47 0.05 -0.19 4.97 5.65 0.12 -4.70 115.29 120.72 2bw0 s HIS 106 Ca 0.30 0.25 -0.04 0.00 0.25 0.00 0.00 55.06 55.81 2bw0 s HIS 106 Cb -0.18 -0.42 -0.10 0.00 -1.18 0.00 0.00 32.58 30.70 2bw0 s HIS 106 CO 0.17 -0.17 3.10 -0.35 -0.65 0.00 0.00 174.74 176.83 2bw0 n PRO 107 N 5.07 2.07 -4.01 2.88 -0.04 -1.26 -0.48 135.00 139.22 2bw0 n PRO 107 Ca -0.08 -1.48 -0.10 0.00 -0.04 0.00 0.00 63.50 61.80 2bw0 n PRO 107 Cb 0.50 -1.96 -0.05 0.00 -0.04 0.00 0.00 33.50 31.94 2bw0 n PRO 107 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2bw0 s SER 108 N 1.26 0.01 -1.27 3.54 1.04 -0.87 -4.13 113.70 113.28 2bw0 s SER 108 Ca 0.57 -1.01 -0.15 0.00 0.48 0.00 0.00 55.95 55.84 2bw0 s SER 108 Cb 0.32 0.59 0.12 0.00 0.10 0.00 0.00 66.02 67.14 2bw0 s SER 108 CO -0.09 -1.16 1.66 0.18 0.98 0.00 0.00 173.24 174.82 2bw0 n LEU 109 N -0.40 5.30 -4.56 2.42 4.77 -1.25 -3.12 117.00 120.16 2bw0 n LEU 109 Ca -0.01 -4.21 -0.45 0.00 -0.03 0.00 0.00 56.01 51.31 2bw0 n LEU 109 Cb 0.62 -1.67 -0.02 0.00 -2.33 0.00 0.00 43.42 40.02 2bw0 n LEU 109 CO 0.24 0.54 0.48 0.18 -1.33 0.00 0.00 177.39 177.49 2bw0 n LEU 110 N 6.80 1.24 -0.17 2.23 4.77 -1.26 -0.82 117.00 129.79 2bw0 n LEU 110 Ca 0.44 1.17 0.08 0.00 -0.03 0.00 0.00 56.01 57.67 2bw0 n LEU 110 Cb 0.43 -1.22 0.42 0.00 -2.33 0.00 0.00 43.42 40.72 2bw0 n LEU 110 CO 0.72 -1.67 0.78 -0.81 -1.33 0.00 0.00 177.39 175.08 2bw0 n PRO 111 N 0.84 1.22 -2.14 3.23 -0.04 -1.26 -4.90 135.00 131.94 2bw0 n PRO 111 Ca 0.11 -0.34 -0.41 0.00 -0.04 0.00 0.00 63.50 62.82 2bw0 n PRO 111 Cb 0.30 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.46 2bw0 n PRO 111 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2bw0 s ARG 112 N -1.92 4.36 -1.37 0.54 0.52 -0.00 -2.21 118.95 118.87 2bw0 s ARG 112 Ca 0.25 2.16 -0.07 0.00 -0.52 0.00 0.00 55.73 57.55 2bw0 s ARG 112 Cb 0.12 -3.12 0.03 0.00 0.52 0.00 0.00 34.95 32.50 2bw0 s ARG 112 CO 0.20 -0.24 1.05 0.72 0.02 0.00 0.00 175.30 177.05 2bw0 n HIS 113 N 1.74 -2.51 -1.49 -0.53 8.25 -1.08 -4.25 115.22 115.35 2bw0 n HIS 113 Ca 0.03 0.96 -0.37 0.00 -0.26 0.00 0.00 57.72 58.08 2bw0 n HIS 113 Cb 0.42 -4.73 0.06 0.00 1.12 0.00 0.00 29.99 26.86 2bw0 n HIS 113 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2bw0 n ARG 114 N -4.69 0.64 0.00 -0.41 1.74 -0.12 -4.68 116.66 109.14 2bw0 n ARG 114 Ca -0.07 0.26 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 2bw0 n ARG 114 Cb 0.59 -2.01 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 2bw0 n ARG 114 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bw0 n GLY 115 N 1.44 -3.77 3.71 -0.13 0.00 -1.26 -1.45 105.19 103.73 2bw0 n GLY 115 Ca 0.13 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 2bw0 n GLY 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bw0 s ALA 116 N -1.01 1.33 -1.46 4.61 0.00 -1.16 -4.05 121.76 120.02 2bw0 s ALA 116 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 51.96 51.61 2bw0 s ALA 116 Cb 0.00 -3.14 0.06 0.00 0.00 0.00 0.00 23.12 20.04 2bw0 s ALA 116 CO 0.00 -2.54 0.78 0.43 0.00 0.00 0.00 175.76 174.44 2bw0 n SER 117 N -3.98 -4.94 0.23 0.00 7.64 -1.26 -4.44 113.62 106.87 2bw0 n SER 117 Ca 0.06 -0.54 0.09 0.00 1.01 0.00 0.00 58.87 59.48 2bw0 n SER 117 Cb 0.57 -3.98 0.57 0.00 -1.01 0.00 0.00 64.21 60.36 2bw0 n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bw0 h ALA 118 N 0.98 1.33 -0.28 -0.43 0.00 -1.84 -1.78 119.26 117.26 2bw0 h ALA 118 Ca -0.53 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.06 2bw0 h ALA 118 Cb 1.35 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2bw0 h ALA 118 CO 0.60 0.26 -0.38 0.82 0.00 0.00 0.00 179.25 180.55 2bw0 h ILE 119 N 0.00 1.30 -0.19 0.00 2.04 -1.89 -1.48 117.51 117.29 2bw0 h ILE 119 Ca -0.00 -1.57 0.04 0.00 1.00 0.00 0.00 64.86 64.33 2bw0 h ILE 119 Cb 0.46 1.65 -0.04 0.00 -0.74 0.00 0.00 36.82 38.15 2bw0 h ILE 119 CO 0.03 0.50 -0.08 0.78 0.00 0.00 0.00 178.15 179.38 2bw0 h ASN 120 N 0.49 -0.28 0.37 1.72 4.21 -1.54 -2.66 115.58 117.89 2bw0 h ASN 120 Ca 0.03 0.07 -0.08 0.00 1.21 0.00 0.00 56.30 57.53 2bw0 h ASN 120 Cb 0.97 0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 38.32 2bw0 h ASN 120 CO 0.09 -0.11 -0.38 -0.50 -1.29 0.00 0.00 177.43 175.24 2bw0 h TRP 121 N -0.06 0.03 -0.43 1.19 4.06 -1.35 0.06 115.95 119.46 2bw0 h TRP 121 Ca 0.10 -0.01 0.08 0.00 2.06 0.00 0.00 58.89 61.13 2bw0 h TRP 121 Cb 0.21 -0.01 -0.07 0.00 -1.00 0.00 0.00 29.16 28.29 2bw0 h TRP 121 CO -0.24 0.40 -0.02 1.15 -3.56 0.00 0.00 178.44 176.17 2bw0 h THR 122 N 0.02 0.65 0.18 1.49 2.02 -0.94 -2.59 112.91 113.74 2bw0 h THR 122 Ca -0.00 -0.03 -0.32 0.00 0.77 0.00 0.00 66.41 66.83 2bw0 h THR 122 Cb 0.69 0.56 0.01 0.00 -1.74 0.00 0.00 68.15 67.67 2bw0 h THR 122 CO 0.05 0.02 -1.47 -0.07 0.37 0.00 0.00 175.52 174.41 2bw0 h LEU 123 N 0.09 0.59 -1.44 2.58 3.38 -1.12 -2.15 115.31 117.23 2bw0 h LEU 123 Ca 0.21 -0.70 0.13 0.00 0.09 0.00 0.00 57.88 57.61 2bw0 h LEU 123 Cb 0.31 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 2bw0 h LEU 123 CO -0.37 1.56 0.52 0.40 0.09 0.00 0.00 178.44 180.64 2bw0 h ILE 124 N 0.10 0.85 -0.03 1.22 2.04 -0.97 -0.46 117.51 120.26 2bw0 h ILE 124 Ca -0.23 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.43 2bw0 h ILE 124 Cb 2.07 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 2bw0 h ILE 124 CO 0.21 0.10 0.00 1.41 0.00 0.00 0.00 178.15 179.88 2bw0 n HIS 125 N -4.51 0.02 -2.73 1.37 8.25 -0.98 -4.47 115.22 112.16 2bw0 n HIS 125 Ca 0.15 -0.01 -0.17 0.00 -0.26 0.00 0.00 57.72 57.42 2bw0 n HIS 125 Cb 0.45 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.58 2bw0 n HIS 125 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bw0 n GLY 126 N 1.14 -0.27 3.76 -1.41 0.00 -0.18 -4.95 105.19 103.27 2bw0 n GLY 126 Ca 0.19 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2bw0 n GLY 126 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bw0 n ASP 127 N -1.50 3.41 0.05 1.61 8.00 -0.82 -4.92 116.55 122.38 2bw0 n ASP 127 Ca -0.11 1.16 0.12 0.00 0.71 0.00 0.00 54.79 56.66 2bw0 n ASP 127 Cb 0.61 -1.60 0.08 0.00 -0.02 0.00 0.00 41.12 40.19 2bw0 n ASP 127 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2bw0 n LYS 128 N 0.04 0.35 -4.27 -1.24 5.02 -1.26 -4.69 118.16 112.10 2bw0 n LYS 128 Ca 0.04 0.05 -0.18 0.00 -2.02 0.00 0.00 58.31 56.20 2bw0 n LYS 128 Cb 0.40 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 2bw0 n LYS 128 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2bw0 s LYS 129 N -3.22 1.09 0.00 1.97 -2.85 -1.26 -0.92 119.74 114.55 2bw0 s LYS 129 Ca 0.04 -1.32 0.00 0.00 -1.00 0.00 0.00 55.97 53.69 2bw0 s LYS 129 Cb 0.13 -0.96 0.00 0.00 -2.06 0.00 0.00 37.83 34.94 2bw0 s LYS 129 CO 0.77 0.18 0.00 0.41 0.10 0.00 0.00 175.35 176.80 2bw0 n GLY 130 N 0.33 3.36 0.00 0.59 0.00 -0.22 -4.79 105.19 104.46 2bw0 n GLY 130 Ca -0.14 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2bw0 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bw0 n GLY 131 N 0.00 -0.46 3.20 -0.02 0.00 -1.26 -0.53 105.19 106.11 2bw0 n GLY 131 Ca 0.00 -1.27 -0.12 0.00 0.00 0.00 0.00 46.02 44.64 2bw0 n GLY 131 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bw0 s PHE 132 N -2.96 1.04 0.05 1.61 -0.12 -0.64 -2.06 117.98 114.90 2bw0 s PHE 132 Ca 0.00 -1.12 0.05 0.00 -0.05 0.00 0.00 56.93 55.81 2bw0 s PHE 132 Cb 0.00 -0.59 -0.02 0.00 -0.63 0.00 0.00 43.02 41.77 2bw0 s PHE 132 CO 0.00 -0.35 -0.14 -1.12 -0.05 0.00 0.00 175.22 173.55 2bw0 s SER 133 N -3.11 1.69 -0.15 1.98 0.01 0.37 -1.48 113.70 113.00 2bw0 s SER 133 Ca 0.24 -0.51 -0.00 0.00 1.31 0.00 0.00 55.95 56.99 2bw0 s SER 133 Cb 0.07 -0.09 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 2bw0 s SER 133 CO 0.03 0.00 -0.13 -0.63 0.41 0.00 0.00 173.24 172.92 2bw0 s ILE 134 N -0.97 2.86 0.07 1.44 -1.09 0.13 -0.70 121.20 122.93 2bw0 s ILE 134 Ca 0.01 -0.71 0.01 0.00 -2.23 0.00 0.00 60.65 57.73 2bw0 s ILE 134 Cb -0.08 -2.21 -0.04 0.00 -1.58 0.00 0.00 42.46 38.54 2bw0 s ILE 134 CO 0.02 0.51 -0.05 0.72 -1.23 0.00 0.00 174.94 174.90 2bw0 s PHE 135 N 0.74 0.71 -0.19 3.97 -0.71 -0.06 0.06 117.98 122.49 2bw0 s PHE 135 Ca -0.06 -0.90 -0.26 0.00 -1.04 0.00 0.00 56.93 54.68 2bw0 s PHE 135 Cb -0.15 -0.44 -0.01 0.00 -1.21 0.00 0.00 43.02 41.20 2bw0 s PHE 135 CO 0.01 -0.22 0.87 -1.58 -1.34 0.00 0.00 175.22 172.96 2bw0 s TRP 136 N -3.35 3.39 0.28 3.49 0.52 0.71 -0.86 118.94 123.13 2bw0 s TRP 136 Ca 0.06 1.28 -0.30 0.00 0.02 0.00 0.00 56.10 57.16 2bw0 s TRP 136 Cb 0.04 -3.06 -0.11 0.00 -1.15 0.00 0.00 33.47 29.18 2bw0 s TRP 136 CO -0.06 -0.31 1.50 0.00 0.02 0.00 0.00 176.95 178.11 2bw0 s ALA 137 N 2.43 3.67 0.00 0.98 0.00 -0.29 -3.67 121.76 124.88 2bw0 s ALA 137 Ca 0.39 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.79 2bw0 s ALA 137 Cb -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2bw0 s ALA 137 CO 0.11 -0.86 0.00 -0.40 0.00 0.00 0.00 175.76 174.61 2bw0 n ASP 138 N 2.09 1.85 -0.26 0.00 3.85 -1.26 -4.77 116.55 118.06 2bw0 n ASP 138 Ca 0.07 -0.45 0.04 0.00 -0.71 0.00 0.00 54.79 53.74 2bw0 n ASP 138 Cb 0.39 0.00 0.18 0.00 -1.35 0.00 0.00 41.12 40.34 2bw0 n ASP 138 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 2bw0 n ASP 139 N -0.52 0.75 -4.62 -1.12 5.68 -1.26 -4.89 116.55 110.58 2bw0 n ASP 139 Ca 0.00 -1.87 -0.22 0.00 -0.50 0.00 0.00 54.79 52.20 2bw0 n ASP 139 Cb 0.00 -0.08 0.02 0.00 -1.14 0.00 0.00 41.12 39.92 2bw0 n ASP 139 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bw0 n GLY 140 N 0.79 2.52 3.37 6.12 0.00 -1.26 -5.05 105.19 111.68 2bw0 n GLY 140 Ca 0.08 -2.27 -0.46 0.00 0.00 0.00 0.00 46.02 43.38 2bw0 n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bw0 s LEU 141 N 0.00 5.93 -1.56 0.99 1.43 -1.26 -4.42 118.68 119.79 2bw0 s LEU 141 Ca 0.37 -2.17 -0.02 0.00 -1.03 0.00 0.00 54.13 51.28 2bw0 s LEU 141 Cb -0.03 -2.28 0.00 0.00 0.03 0.00 0.00 46.19 43.91 2bw0 s LEU 141 CO 0.23 -0.85 0.25 0.47 0.23 0.00 0.00 176.35 176.69 2bw0 n ASP 142 N 5.32 -5.67 -0.35 2.29 8.00 -1.26 -4.77 116.55 120.11 2bw0 n ASP 142 Ca 0.10 -0.13 0.11 0.00 0.71 0.00 0.00 54.79 55.58 2bw0 n ASP 142 Cb 0.46 -4.61 0.01 0.00 -0.02 0.00 0.00 41.12 36.96 2bw0 n ASP 142 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2bw0 n THR 143 N -4.20 0.00 -1.33 -3.53 -2.24 -1.26 -4.92 114.28 96.80 2bw0 n THR 143 Ca -0.17 -0.18 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 2bw0 n THR 143 Cb 0.65 1.09 0.10 0.00 -2.10 0.00 0.00 70.33 70.06 2bw0 n THR 143 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2bw0 s GLY 144 N -2.61 2.08 0.43 3.38 0.00 -1.26 -4.59 107.32 104.75 2bw0 s GLY 144 Ca 0.16 0.67 -0.26 0.00 0.00 0.00 0.00 44.72 45.30 2bw0 s GLY 144 CO 0.64 1.06 1.35 1.22 0.00 0.00 0.00 173.10 177.37 2bw0 n ASP 145 N -3.07 2.95 -4.78 1.64 10.43 -1.24 -4.57 116.55 117.91 2bw0 n ASP 145 Ca 0.12 1.12 -0.35 0.00 2.57 0.00 0.00 54.79 58.24 2bw0 n ASP 145 Cb 0.51 -1.55 -0.02 0.00 1.84 0.00 0.00 41.12 41.90 2bw0 n ASP 145 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2bw0 s LEU 146 N -2.12 3.89 -0.26 0.64 1.43 0.70 -0.21 118.68 122.76 2bw0 s LEU 146 Ca 0.61 2.11 -0.15 0.00 -1.03 0.00 0.00 54.13 55.67 2bw0 s LEU 146 Cb -0.48 -4.44 -0.11 0.00 0.03 0.00 0.00 46.19 41.19 2bw0 s LEU 146 CO 0.58 -0.91 -0.36 -0.11 0.23 0.00 0.00 176.35 175.78 2bw0 n LEU 147 N -0.84 1.96 -3.83 1.79 0.00 0.11 -0.21 117.00 115.97 2bw0 n LEU 147 Ca 0.09 0.34 -0.09 0.00 0.00 0.00 0.00 56.01 56.35 2bw0 n LEU 147 Cb 0.51 -0.81 -0.07 0.00 0.00 0.00 0.00 43.42 43.05 2bw0 n LEU 147 CO 0.43 0.44 -0.02 -1.48 0.00 0.00 0.00 177.39 176.76 2bw0 s LEU 148 N -7.58 1.11 -0.11 -1.96 0.05 -1.02 -4.52 118.68 104.67 2bw0 s LEU 148 Ca -0.37 -0.63 -0.09 0.00 0.05 0.00 0.00 54.13 53.09 2bw0 s LEU 148 Cb 0.13 1.24 0.03 0.00 -2.05 0.00 0.00 46.19 45.54 2bw0 s LEU 148 CO 0.48 -0.79 0.27 -1.58 -0.55 0.00 0.00 176.35 174.18 2bw0 s GLN 149 N -3.87 0.30 -0.03 1.48 0.74 -1.26 -0.70 119.66 116.32 2bw0 s GLN 149 Ca 0.07 0.42 0.02 0.00 0.05 0.00 0.00 55.36 55.92 2bw0 s GLN 149 Cb 0.04 0.11 0.01 0.00 1.10 0.00 0.00 33.01 34.26 2bw0 s GLN 149 CO -0.09 -0.06 -0.09 0.15 -0.55 0.00 0.00 175.29 174.65 2bw0 s LYS 150 N 0.36 1.08 0.10 1.67 1.02 -0.55 -5.01 119.74 118.42 2bw0 s LYS 150 Ca -0.02 -0.31 0.03 0.00 0.02 0.00 0.00 55.97 55.69 2bw0 s LYS 150 Cb -0.03 -0.99 -0.04 0.00 -0.52 0.00 0.00 37.83 36.25 2bw0 s LYS 150 CO -0.01 0.09 0.14 -1.21 -0.92 0.00 0.00 175.35 173.43 2bw0 s GLU 151 N 0.32 3.03 0.06 1.68 2.02 -1.26 -1.62 118.70 122.93 2bw0 s GLU 151 Ca -0.06 -0.68 -0.01 0.00 0.02 0.00 0.00 54.97 54.24 2bw0 s GLU 151 Cb -0.10 -2.78 -0.04 0.00 0.10 0.00 0.00 34.13 31.30 2bw0 s GLU 151 CO 0.01 0.55 -0.03 0.00 0.02 0.00 0.00 175.26 175.81 2bw0 s GLU 153 N -3.92 4.45 -0.17 0.00 2.12 -1.26 -1.06 118.70 118.86 2bw0 s GLU 153 Ca 0.09 1.50 -0.07 0.00 0.36 0.00 0.00 54.97 56.84 2bw0 s GLU 153 Cb 0.08 -2.80 -0.04 0.00 0.26 0.00 0.00 34.13 31.62 2bw0 s GLU 153 CO -0.09 0.12 0.08 0.08 -0.54 0.00 0.00 175.26 174.91 2bw0 s VAL 154 N -1.52 4.94 0.24 3.70 1.01 -0.10 -4.77 120.40 123.89 2bw0 s VAL 154 Ca 0.51 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.51 2bw0 s VAL 154 Cb -0.23 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2bw0 s VAL 154 CO 0.29 0.49 0.42 -0.76 0.00 0.00 0.00 175.10 175.54 2bw0 s LEU 155 N 0.04 4.20 0.53 3.92 1.43 -1.26 -4.76 118.68 122.78 2bw0 s LEU 155 Ca 0.06 0.37 0.25 0.00 -1.03 0.00 0.00 54.13 53.79 2bw0 s LEU 155 Cb -0.12 -3.16 1.49 0.00 0.03 0.00 0.00 46.19 44.43 2bw0 s LEU 155 CO 0.00 -0.10 2.13 1.55 0.23 0.00 0.00 176.35 180.17 2bw0 h PRO 156 N 1.65 0.00 -0.39 1.29 0.13 -1.99 -1.77 132.00 130.93 2bw0 h PRO 156 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2bw0 h PRO 156 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2bw0 h PRO 156 CO 0.66 0.08 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 2bw0 n ASP 157 N -3.90 3.17 -4.64 1.44 8.00 -1.26 -4.94 116.55 114.43 2bw0 n ASP 157 Ca -0.02 -2.11 -0.40 0.00 0.71 0.00 0.00 54.79 52.97 2bw0 n ASP 157 Cb 0.17 -0.30 0.03 0.00 -0.02 0.00 0.00 41.12 41.00 2bw0 n ASP 157 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2bw0 n ASP 158 N 0.55 1.50 -4.73 -2.24 10.43 -0.67 -4.95 116.55 116.43 2bw0 n ASP 158 Ca 0.14 0.98 -0.29 0.00 2.57 0.00 0.00 54.79 58.19 2bw0 n ASP 158 Cb 0.50 -1.41 -0.08 0.00 1.84 0.00 0.00 41.12 41.97 2bw0 n ASP 158 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2bw0 s THR 159 N -1.33 1.71 0.19 -3.53 -4.23 -1.26 -4.71 115.64 102.47 2bw0 s THR 159 Ca 0.67 -1.87 -0.12 0.00 -1.18 0.00 0.00 61.69 59.18 2bw0 s THR 159 Cb -0.49 -2.58 0.11 0.00 1.34 0.00 0.00 72.50 70.88 2bw0 s THR 159 CO 0.54 0.00 1.74 0.58 -0.54 0.00 0.00 174.62 176.93 2bw0 h VAL 160 N 1.42 0.78 -0.53 2.29 2.07 -0.52 -1.35 116.25 120.40 2bw0 h VAL 160 Ca -0.43 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 66.89 2bw0 h VAL 160 Cb 1.28 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 2bw0 h VAL 160 CO 0.73 0.06 -0.03 0.28 0.02 0.00 0.00 177.57 178.63 2bw0 h SER 161 N 0.32 0.94 -0.08 0.57 0.02 -1.75 -0.90 113.55 112.67 2bw0 h SER 161 Ca 0.26 -0.32 -0.22 0.00 -0.84 0.00 0.00 61.79 60.67 2bw0 h SER 161 Cb 0.31 -0.25 0.01 0.00 0.14 0.00 0.00 62.40 62.61 2bw0 h SER 161 CO -0.29 1.03 -0.77 0.71 -1.14 0.00 0.00 176.83 176.37 2bw0 h THR 162 N 0.82 1.29 -0.50 -2.27 1.35 -1.79 0.30 112.91 112.11 2bw0 h THR 162 Ca 0.15 -2.00 -0.11 0.00 -0.55 0.00 0.00 66.41 63.90 2bw0 h THR 162 Cb 0.57 2.00 -0.02 0.00 -1.73 0.00 0.00 68.15 68.97 2bw0 h THR 162 CO 0.03 0.63 -0.10 0.25 -0.25 0.00 0.00 175.52 176.08 2bw0 h LEU 163 N 0.50 0.96 0.33 3.87 5.85 -1.22 -0.38 115.31 125.21 2bw0 h LEU 163 Ca -0.05 -0.35 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 2bw0 h LEU 163 Cb 1.39 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.16 2bw0 h LEU 163 CO 0.16 1.09 -0.16 0.22 -0.34 0.00 0.00 178.44 179.41 2bw0 h TYR 164 N 0.82 -0.41 -0.16 1.25 3.20 -1.08 -2.33 116.97 118.27 2bw0 h TYR 164 Ca 0.13 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.92 2bw0 h TYR 164 Cb 0.66 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 2bw0 h TYR 164 CO 0.05 -0.18 -0.23 -0.91 -1.64 0.00 0.00 178.16 175.25 2bw0 h ASN 165 N -0.54 0.28 0.18 -2.11 2.35 -0.85 0.19 115.58 115.08 2bw0 h ASN 165 Ca -0.04 -0.08 -0.21 0.00 -0.55 0.00 0.00 56.30 55.42 2bw0 h ASN 165 Cb 0.40 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.70 2bw0 h ASN 165 CO 0.07 0.52 -0.82 -0.09 -1.65 0.00 0.00 177.43 175.46 2bw0 h ARG 166 N 0.26 0.50 0.00 0.81 2.43 -1.08 -3.41 114.38 113.89 2bw0 h ARG 166 Ca 0.04 -0.46 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 2bw0 h ARG 166 Cb 0.55 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 2bw0 h ARG 166 CO 0.04 1.09 0.00 0.34 -1.51 0.00 0.00 179.97 179.93 2bw0 n PHE 167 N -3.83 -1.06 -0.03 2.20 -0.00 -0.91 -4.78 117.46 109.05 2bw0 n PHE 167 Ca -0.06 0.19 -0.05 0.00 -0.00 0.00 0.00 57.45 57.53 2bw0 n PHE 167 Cb 0.77 0.59 0.15 0.00 -0.00 0.00 0.00 39.48 40.99 2bw0 n PHE 167 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2bw0 h LEU 168 N 0.00 0.61 0.39 -2.13 3.38 -1.10 -0.01 115.31 116.45 2bw0 h LEU 168 Ca 0.00 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.74 2bw0 h LEU 168 Cb 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2bw0 h LEU 168 CO 0.00 0.84 -0.19 0.15 0.09 0.00 0.00 178.44 179.33 2bw0 h PHE 169 N 0.53 -0.48 -0.32 1.13 3.04 -0.89 -1.88 116.94 118.07 2bw0 h PHE 169 Ca 0.08 -0.01 -0.05 0.00 3.98 0.00 0.00 57.97 61.97 2bw0 h PHE 169 Cb 0.70 0.16 -0.01 0.00 2.56 0.00 0.00 35.95 39.35 2bw0 h PHE 169 CO 0.03 -0.30 0.02 -1.00 -2.02 0.00 0.00 178.31 175.04 2bw0 h PRO 170 N -0.88 0.55 -0.05 6.41 0.13 -1.75 -0.88 132.00 135.54 2bw0 h PRO 170 Ca -0.05 -0.16 -0.15 0.00 -0.87 0.00 0.00 66.00 64.76 2bw0 h PRO 170 Cb 0.40 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.46 2bw0 h PRO 170 CO 0.09 0.67 -0.65 0.93 -0.23 0.00 0.00 178.00 178.80 2bw0 h GLU 171 N 0.36 0.20 -0.44 0.86 4.39 -1.19 -2.80 114.58 115.96 2bw0 h GLU 171 Ca 0.09 -0.15 -0.07 0.00 0.34 0.00 0.00 59.36 59.58 2bw0 h GLU 171 Cb 0.40 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.07 2bw0 h GLU 171 CO 0.01 0.78 0.01 0.78 -1.16 0.00 0.00 179.01 179.43 2bw0 h GLY 172 N 1.60 0.83 0.80 -3.84 0.00 -1.07 0.13 103.07 101.52 2bw0 h GLY 172 Ca -0.01 -0.60 0.01 0.00 0.00 0.00 0.00 47.33 46.73 2bw0 h GLY 172 CO 0.10 0.56 -0.07 -2.22 0.00 0.00 0.00 176.54 174.90 2bw0 h ILE 173 N 0.61 0.82 -0.76 2.60 2.04 -1.16 0.31 117.51 121.96 2bw0 h ILE 173 Ca 0.13 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.09 2bw0 h ILE 173 Cb 0.48 0.82 -0.08 0.00 -0.74 0.00 0.00 36.82 37.30 2bw0 h ILE 173 CO 0.02 0.00 0.38 0.50 0.00 0.00 0.00 178.15 179.05 2bw0 h LYS 174 N -0.12 0.60 -0.43 2.37 3.64 -1.32 -1.20 116.57 120.13 2bw0 h LYS 174 Ca 0.03 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.31 2bw0 h LYS 174 Cb 0.16 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2bw0 h LYS 174 CO -0.08 0.40 0.01 0.78 -2.27 0.00 0.00 179.45 178.29 2bw0 h GLY 175 N 0.62 0.80 1.01 5.01 0.00 -0.28 0.28 103.07 110.52 2bw0 h GLY 175 Ca 0.39 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 2bw0 h GLY 175 CO -0.30 0.54 0.23 1.98 0.00 0.00 0.00 176.54 178.99 2bw0 h MET 176 N 0.59 0.98 -0.57 4.80 1.85 -0.40 -0.21 114.93 121.96 2bw0 h MET 176 Ca 0.12 -0.19 -0.08 0.00 -0.61 0.00 0.00 59.70 58.94 2bw0 h MET 176 Cb 0.47 -0.15 -0.02 0.00 0.43 0.00 0.00 31.60 32.32 2bw0 h MET 176 CO 0.02 0.84 0.06 0.28 -0.40 0.00 0.00 176.91 177.71 2bw0 h VAL 177 N 0.91 1.26 -0.84 -5.77 2.07 -0.97 -1.34 116.25 111.56 2bw0 h VAL 177 Ca 0.21 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 2bw0 h VAL 177 Cb 0.25 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 2bw0 h VAL 177 CO -0.01 0.38 0.40 1.56 0.02 0.00 0.00 177.57 179.91 2bw0 h GLN 178 N 0.86 1.22 -0.47 1.57 4.20 -0.79 -1.33 115.11 120.37 2bw0 h GLN 178 Ca 0.17 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2bw0 h GLN 178 Cb 0.46 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 2bw0 h GLN 178 CO 0.02 0.94 0.26 0.00 -0.67 0.00 0.00 178.83 179.38 2bw0 h ALA 179 N 1.23 0.60 -0.48 3.87 0.00 -0.56 -1.21 119.26 122.70 2bw0 h ALA 179 Ca 0.29 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 2bw0 h ALA 179 Cb 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2bw0 h ALA 179 CO -0.04 0.11 0.11 0.28 0.00 0.00 0.00 179.25 179.71 2bw0 h VAL 180 N 0.62 1.21 -0.39 0.00 2.07 -0.91 -0.82 116.25 118.03 2bw0 h VAL 180 Ca 0.17 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 2bw0 h VAL 180 Cb 0.03 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2bw0 h VAL 180 CO -0.03 0.28 0.19 -0.09 0.02 0.00 0.00 177.57 177.94 2bw0 h ARG 181 N 0.71 0.56 -0.86 1.57 2.43 -0.83 0.11 114.38 118.07 2bw0 h ARG 181 Ca 0.16 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 2bw0 h ARG 181 Cb 0.28 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 2bw0 h ARG 181 CO -0.00 0.49 0.42 -0.07 -1.51 0.00 0.00 179.97 179.30 2bw0 h LEU 182 N 0.49 1.11 -0.73 3.80 3.38 -0.79 -1.54 115.31 121.03 2bw0 h LEU 182 Ca 0.13 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2bw0 h LEU 182 Cb 0.12 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2bw0 h LEU 182 CO -0.02 0.93 0.33 0.40 0.09 0.00 0.00 178.44 180.17 2bw0 h ILE 183 N 1.22 1.24 -0.11 1.22 2.04 -0.65 0.13 117.51 122.61 2bw0 h ILE 183 Ca 0.30 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 2bw0 h ILE 183 Cb 0.10 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2bw0 h ILE 183 CO -0.04 0.29 -0.04 0.00 0.00 0.00 0.00 178.15 178.37 2bw0 h ALA 184 N 1.16 1.74 -0.01 1.87 0.00 -0.23 -1.78 119.26 122.01 2bw0 h ALA 184 Ca 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2bw0 h ALA 184 Cb 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2bw0 h ALA 184 CO -0.03 0.20 -0.23 0.39 0.00 0.00 0.00 179.25 179.58 2bw0 n GLU 185 N -4.40 0.73 -2.42 0.00 1.02 -0.63 -3.66 120.64 111.27 2bw0 n GLU 185 Ca -0.01 -0.39 -0.13 0.00 -0.02 0.00 0.00 57.16 56.61 2bw0 n GLU 185 Cb 0.17 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.11 2bw0 n GLU 185 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bw0 n GLY 186 N 1.34 -0.10 0.14 0.62 0.00 -0.64 -4.95 105.19 101.60 2bw0 n GLY 186 Ca 0.12 -0.32 0.05 0.00 0.00 0.00 0.00 46.02 45.87 2bw0 n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bw0 n LYS 187 N -2.39 1.25 -2.38 1.61 4.76 0.38 -5.02 118.16 116.38 2bw0 n LYS 187 Ca -0.12 -1.84 -0.42 0.00 -2.87 0.00 0.00 58.31 53.07 2bw0 n LYS 187 Cb 0.60 -1.10 -0.03 0.00 -1.84 0.00 0.00 35.03 32.66 2bw0 n LYS 187 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2bw0 s ALA 188 N -1.63 3.43 0.71 7.82 0.00 -1.16 -4.89 121.76 126.06 2bw0 s ALA 188 Ca 0.16 0.87 -0.13 0.00 0.00 0.00 0.00 51.96 52.86 2bw0 s ALA 188 Cb 0.14 -3.47 0.03 0.00 0.00 0.00 0.00 23.12 19.81 2bw0 s ALA 188 CO 0.01 -0.51 1.10 -2.14 0.00 0.00 0.00 175.76 174.23 2bw0 s PRO 189 N 1.21 2.55 -0.15 0.00 0.02 -1.26 -5.01 135.00 132.36 2bw0 s PRO 189 Ca 0.60 1.28 -0.00 0.00 0.02 0.00 0.00 61.00 62.89 2bw0 s PRO 189 Cb -0.30 -1.93 0.03 0.00 0.02 0.00 0.00 34.50 32.33 2bw0 s PRO 189 CO 0.29 -1.43 -0.06 1.03 -0.33 0.00 0.00 177.00 176.49 2bw0 s ARG 190 N -4.49 1.51 -0.40 5.54 0.52 -1.26 -4.35 118.95 116.02 2bw0 s ARG 190 Ca 0.64 -0.43 0.03 0.00 -0.52 0.00 0.00 55.73 55.45 2bw0 s ARG 190 Cb -0.19 -1.87 0.11 0.00 0.52 0.00 0.00 34.95 33.52 2bw0 s ARG 190 CO 0.49 -0.37 0.15 -0.51 0.02 0.00 0.00 175.30 175.08 2bw0 s LEU 191 N 1.65 3.85 0.33 2.53 1.43 0.70 -4.93 118.68 124.25 2bw0 s LEU 191 Ca 0.02 -2.38 -0.28 0.00 -1.03 0.00 0.00 54.13 50.46 2bw0 s LEU 191 Cb -0.14 -1.40 -0.13 0.00 0.03 0.00 0.00 46.19 44.56 2bw0 s LEU 191 CO -0.08 -0.33 1.21 -2.65 0.23 0.00 0.00 176.35 174.73 2bw0 n PRO 192 N 3.92 1.90 -2.46 1.29 -0.02 -1.26 -0.21 135.00 138.16 2bw0 n PRO 192 Ca 0.04 0.67 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 2bw0 n PRO 192 Cb 0.38 -2.20 -0.04 0.00 -0.02 0.00 0.00 33.50 31.62 2bw0 n PRO 192 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2bw0 s GLN 193 N -1.82 4.58 0.81 -0.52 -0.21 -1.26 -4.83 119.66 116.41 2bw0 s GLN 193 Ca 0.57 1.79 -0.10 0.00 0.02 0.00 0.00 55.36 57.63 2bw0 s GLN 193 Cb -0.60 -3.24 0.08 0.00 1.00 0.00 0.00 33.01 30.25 2bw0 s GLN 193 CO 0.61 0.07 1.11 -1.25 -2.12 0.00 0.00 175.29 173.71 2bw0 s PRO 194 N -0.65 1.96 0.05 2.91 0.04 -1.26 -4.97 135.00 133.08 2bw0 s PRO 194 Ca 0.49 1.27 -0.00 0.00 0.04 0.00 0.00 61.00 62.80 2bw0 s PRO 194 Cb -0.31 -1.86 -0.26 0.00 0.04 0.00 0.00 34.50 32.11 2bw0 s PRO 194 CO 0.37 -1.88 1.05 0.93 0.04 0.00 0.00 177.00 177.51 2bw0 h GLU 195 N -1.29 0.19 -6.62 4.56 4.39 -2.02 -3.43 114.58 110.37 2bw0 h GLU 195 Ca -0.43 -0.32 -0.52 0.00 0.34 0.00 0.00 59.36 58.42 2bw0 h GLU 195 Cb 1.24 0.12 0.05 0.00 -0.10 0.00 0.00 28.75 30.06 2bw0 h GLU 195 CO 0.49 1.09 0.94 -2.00 -1.16 0.00 0.00 179.01 178.37 2bw0 s GLU 196 N -2.65 4.18 0.00 2.33 2.12 -1.26 -2.38 118.70 121.04 2bw0 s GLU 196 Ca -0.05 2.46 0.00 0.00 0.36 0.00 0.00 54.97 57.75 2bw0 s GLU 196 Cb 0.08 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.31 2bw0 s GLU 196 CO 0.86 -0.67 0.00 0.41 -0.54 0.00 0.00 175.26 175.31 2bw0 n GLY 197 N 3.86 0.76 3.74 -1.50 0.00 -1.26 -4.84 105.19 105.95 2bw0 n GLY 197 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2bw0 n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bw0 s ALA 198 N -2.80 3.69 0.06 4.61 0.00 -1.00 -4.03 121.76 122.30 2bw0 s ALA 198 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.33 2bw0 s ALA 198 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 2bw0 s ALA 198 CO 0.00 -0.78 -0.05 0.95 0.00 0.00 0.00 175.76 175.89 2bw0 s THR 199 N 0.41 0.39 -0.02 0.00 -4.23 -0.94 -4.94 115.64 106.31 2bw0 s THR 199 Ca 0.63 -1.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.53 2bw0 s THR 199 Cb -0.43 -1.28 0.00 0.00 1.34 0.00 0.00 72.50 72.13 2bw0 s THR 199 CO 0.39 -0.82 -0.07 -0.47 -0.54 0.00 0.00 174.62 173.12 2bw0 s TYR 200 N -3.18 0.71 0.03 3.99 6.14 -1.26 -0.94 117.35 122.83 2bw0 s TYR 200 Ca 0.03 -0.15 0.00 0.00 0.64 0.00 0.00 57.07 57.59 2bw0 s TYR 200 Cb 0.02 -0.51 -0.02 0.00 0.42 0.00 0.00 41.96 41.87 2bw0 s TYR 200 CO -0.06 -0.07 -0.04 -1.21 0.64 0.00 0.00 175.55 174.82 2bw0 s GLU 201 N 0.14 0.37 0.00 4.97 8.01 -0.52 -4.95 118.70 126.72 2bw0 s GLU 201 Ca -0.02 -0.68 0.00 0.00 0.01 0.00 0.00 54.97 54.28 2bw0 s GLU 201 Cb -0.06 0.06 0.00 0.00 -4.31 0.00 0.00 34.13 29.81 2bw0 s GLU 201 CO -0.00 -0.04 0.00 0.41 0.01 0.00 0.00 175.26 175.64 2bw0 n GLY 202 N 1.46 1.09 3.77 -1.39 0.00 -1.26 -3.01 105.19 105.84 2bw0 n GLY 202 Ca -0.23 -2.00 -0.40 0.00 0.00 0.00 0.00 46.02 43.39 2bw0 n GLY 202 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2bw0 s ILE 203 N 0.49 2.46 -0.59 -0.61 1.10 -1.26 -4.55 121.20 118.23 2bw0 s ILE 203 Ca 0.00 0.42 -0.09 0.00 -0.51 0.00 0.00 60.65 60.47 2bw0 s ILE 203 Cb 0.00 -3.25 0.15 0.00 0.15 0.00 0.00 42.46 39.51 2bw0 s ILE 203 CO 0.00 0.07 0.47 -1.58 -2.11 0.00 0.00 174.94 171.78 2bw0 s GLN 204 N -2.24 2.75 0.62 3.50 2.00 -1.26 -5.01 119.66 120.01 2bw0 s GLN 204 Ca 0.57 -2.13 -0.04 0.00 -2.00 0.00 0.00 55.36 51.76 2bw0 s GLN 204 Cb -0.40 -3.99 0.04 0.00 0.80 0.00 0.00 33.01 29.46 2bw0 s GLN 204 CO 0.52 -1.21 0.89 0.15 -0.50 0.00 0.00 175.29 175.14 2bw0 s LYS 205 N 0.71 2.51 0.31 1.67 1.02 -1.26 -4.52 119.74 120.17 2bw0 s LYS 205 Ca 0.11 -0.38 0.04 0.00 0.02 0.00 0.00 55.97 55.76 2bw0 s LYS 205 Cb -0.21 -2.32 0.67 0.00 -0.52 0.00 0.00 37.83 35.45 2bw0 s LYS 205 CO -0.03 -0.90 1.83 -0.22 -0.92 0.00 0.00 175.35 175.11 2bw0 h LYS 206 N -0.24 0.84 -0.41 1.68 1.63 -1.93 -1.46 116.57 116.68 2bw0 h LYS 206 Ca -0.44 -0.05 0.02 0.00 -0.85 0.00 0.00 60.65 59.33 2bw0 h LYS 206 Cb 1.29 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 32.70 2bw0 h LYS 206 CO 0.58 0.55 0.23 1.49 -3.45 0.00 0.00 179.45 178.85 2bw0 h GLU 207 N 0.86 0.45 -0.14 1.90 4.57 -1.95 -1.08 114.58 119.19 2bw0 h GLU 207 Ca 0.51 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.66 2bw0 h GLU 207 Cb 0.66 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 2bw0 h GLU 207 CO -0.28 0.29 0.00 0.25 -1.18 0.00 0.00 179.01 178.09 2bw0 n THR 208 N -4.88 0.18 0.86 0.32 -2.24 -0.56 -2.82 114.28 105.15 2bw0 n THR 208 Ca 0.02 -0.19 0.10 0.00 -2.27 0.00 0.00 64.05 61.71 2bw0 n THR 208 Cb 0.08 0.09 0.29 0.00 -2.10 0.00 0.00 70.33 68.69 2bw0 n THR 208 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bw0 n ALA 209 N -0.10 2.47 -1.74 6.98 0.00 -0.41 -4.95 120.51 122.76 2bw0 n ALA 209 Ca 0.05 -0.69 -0.42 0.00 0.00 0.00 0.00 53.44 52.38 2bw0 n ALA 209 Cb 0.12 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.55 2bw0 n ALA 209 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2bw0 n LYS 210 N 0.71 2.61 -2.51 0.00 4.81 -1.13 -2.67 118.16 119.99 2bw0 n LYS 210 Ca 0.17 0.92 -0.42 0.00 -0.87 0.00 0.00 58.31 58.11 2bw0 n LYS 210 Cb 0.41 -2.67 -0.03 0.00 0.02 0.00 0.00 35.03 32.75 2bw0 n LYS 210 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2bw0 s ILE 211 N -0.37 4.27 -0.43 3.15 1.01 0.11 -4.85 121.20 124.09 2bw0 s ILE 211 Ca 0.61 1.64 -0.21 0.00 0.00 0.00 0.00 60.65 62.69 2bw0 s ILE 211 Cb -0.51 -4.05 0.02 0.00 0.01 0.00 0.00 42.46 37.93 2bw0 s ILE 211 CO 0.53 0.13 0.63 0.21 0.00 0.00 0.00 174.94 176.45 2bw0 s ASN 212 N 0.99 6.32 0.04 3.58 2.47 -1.26 -4.96 114.94 122.12 2bw0 s ASN 212 Ca 0.56 -0.32 0.27 0.00 0.42 0.00 0.00 52.86 53.79 2bw0 s ASN 212 Cb -0.27 -2.32 1.10 0.00 -1.45 0.00 0.00 41.25 38.32 2bw0 s ASN 212 CO 0.29 -0.76 1.85 0.79 -3.72 0.00 0.00 177.10 175.55 2bw0 n TRP 213 N 6.23 0.15 -1.77 0.43 7.02 -1.26 -4.28 117.44 123.95 2bw0 n TRP 213 Ca -0.02 0.05 -0.40 0.00 -1.02 0.00 0.00 57.50 56.11 2bw0 n TRP 213 Cb 0.48 -0.57 -0.01 0.00 -2.42 0.00 0.00 31.31 28.78 2bw0 n TRP 213 CO 0.00 0.00 0.00 -3.47 -2.02 0.00 0.00 177.69 172.20 2bw0 n ASP 214 N -1.62 8.29 -3.65 -0.99 4.64 -1.26 -4.14 116.55 117.81 2bw0 n ASP 214 Ca 0.06 -2.96 -0.11 0.00 -1.38 0.00 0.00 54.79 50.41 2bw0 n ASP 214 Cb 0.33 -1.43 -0.05 0.00 -1.04 0.00 0.00 41.12 38.93 2bw0 n ASP 214 CO 0.00 0.00 0.00 -1.10 -0.82 0.00 0.00 177.20 175.28 2bw0 s GLN 215 N -0.07 1.01 0.77 -0.67 -0.21 -1.26 -4.95 119.66 114.28 2bw0 s GLN 215 Ca 0.59 -0.62 -0.14 0.00 0.02 0.00 0.00 55.36 55.22 2bw0 s GLN 215 Cb 0.18 0.45 0.06 0.00 1.00 0.00 0.00 33.01 34.70 2bw0 s GLN 215 CO -0.08 -0.38 1.18 -2.14 -2.12 0.00 0.00 175.29 171.75 2bw0 s PRO 216 N -3.41 1.95 0.30 2.91 0.02 -1.26 -0.77 135.00 134.73 2bw0 s PRO 216 Ca 0.01 1.66 0.05 0.00 0.02 0.00 0.00 61.00 62.74 2bw0 s PRO 216 Cb 0.01 -1.82 0.73 0.00 0.02 0.00 0.00 34.50 33.44 2bw0 s PRO 216 CO -0.09 -1.96 1.76 0.00 -0.33 0.00 0.00 177.00 176.38 2bw0 h ALA 217 N -0.65 1.61 -0.65 -1.55 0.00 -1.86 -1.49 119.26 114.66 2bw0 h ALA 217 Ca -0.46 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 2bw0 h ALA 217 Cb 1.28 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2bw0 h ALA 217 CO 0.48 -0.11 0.26 1.49 0.00 0.00 0.00 179.25 181.38 2bw0 h GLU 218 N 0.69 0.95 -0.26 0.00 4.81 -1.91 0.17 114.58 119.03 2bw0 h GLU 218 Ca 0.57 -0.15 -0.18 0.00 -0.13 0.00 0.00 59.36 59.47 2bw0 h GLU 218 Cb 0.92 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 2bw0 h GLU 218 CO -0.41 0.77 -0.54 0.00 -0.73 0.00 0.00 179.01 178.11 2bw0 h ALA 219 N 1.35 0.55 -0.36 2.92 0.00 -1.65 -0.69 119.26 121.39 2bw0 h ALA 219 Ca 0.22 -0.51 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 2bw0 h ALA 219 Cb 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2bw0 h ALA 219 CO -0.02 0.68 -0.06 0.82 0.00 0.00 0.00 179.25 180.67 2bw0 h ILE 220 N 0.60 1.27 -0.42 0.00 2.04 -0.95 -0.20 117.51 119.85 2bw0 h ILE 220 Ca 0.02 -1.10 0.06 0.00 1.00 0.00 0.00 64.86 64.84 2bw0 h ILE 220 Cb 1.12 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 38.41 2bw0 h ILE 220 CO 0.11 0.36 0.11 -0.74 0.00 0.00 0.00 178.15 178.00 2bw0 h HIS 221 N 0.47 0.18 -0.96 1.37 2.76 -0.87 0.49 115.15 118.59 2bw0 h HIS 221 Ca 0.09 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.29 2bw0 h HIS 221 Cb 0.55 -0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.44 2bw0 h HIS 221 CO 0.05 0.04 0.59 -0.91 -1.30 0.00 0.00 177.93 176.40 2bw0 h ASN 222 N 0.25 1.14 0.03 3.26 2.35 -0.90 -0.83 115.58 120.87 2bw0 h ASN 222 Ca 0.20 -0.06 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2bw0 h ASN 222 Cb 0.23 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2bw0 h ASN 222 CO -0.24 0.86 -0.05 -0.25 -1.65 0.00 0.00 177.43 176.09 2bw0 h TRP 223 N 1.31 -0.12 -0.12 1.19 2.91 -0.47 -0.21 115.95 120.45 2bw0 h TRP 223 Ca 0.35 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.36 2bw0 h TRP 223 Cb -0.09 0.05 -0.01 0.00 -0.51 0.00 0.00 29.16 28.61 2bw0 h TRP 223 CO 0.00 -0.08 0.05 0.82 -1.03 0.00 0.00 178.44 178.21 2bw0 h ILE 224 N -0.10 1.13 -0.02 2.65 2.04 -0.53 -2.73 117.51 119.96 2bw0 h ILE 224 Ca 0.01 -0.40 -0.09 0.00 1.00 0.00 0.00 64.86 65.38 2bw0 h ILE 224 Cb 0.11 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 2bw0 h ILE 224 CO -0.03 0.12 -0.41 0.08 0.00 0.00 0.00 178.15 177.91 2bw0 h ARG 225 N 0.05 0.03 0.00 2.37 0.11 -1.19 -2.11 114.38 113.63 2bw0 h ARG 225 Ca 0.04 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.11 2bw0 h ARG 225 Cb 0.15 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.22 2bw0 h ARG 225 CO -0.00 0.44 0.00 0.41 0.10 0.00 0.00 179.97 180.92 2bw0 n GLY 226 N -0.32 -0.91 0.22 0.08 0.00 -0.09 -2.20 105.19 101.97 2bw0 n GLY 226 Ca -0.02 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 45.89 2bw0 n GLY 226 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bw0 n ASN 227 N -0.94 1.22 -4.30 1.61 3.02 -0.83 -4.35 115.26 110.69 2bw0 n ASN 227 Ca 0.19 -2.39 -0.37 0.00 -0.03 0.00 0.00 54.58 51.99 2bw0 n ASN 227 Cb 0.09 -0.26 -0.13 0.00 -0.61 0.00 0.00 39.78 38.87 2bw0 n ASN 227 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2bw0 s ASP 228 N -1.73 5.02 0.01 6.41 3.68 -1.01 0.08 116.67 129.13 2bw0 s ASP 228 Ca 0.14 -0.84 0.22 0.00 2.13 0.00 0.00 52.55 54.20 2bw0 s ASP 228 Cb 0.12 -1.84 -0.24 0.00 -1.45 0.00 0.00 42.92 39.52 2bw0 s ASP 228 CO 0.01 -0.21 0.67 0.29 0.13 0.00 0.00 175.17 176.06 2bw0 n LYS 229 N 4.81 0.52 -4.93 4.34 5.02 -1.26 -0.89 118.16 125.77 2bw0 n LYS 229 Ca -0.14 -0.11 -0.33 0.00 -2.02 0.00 0.00 58.31 55.71 2bw0 n LYS 229 Cb 0.47 -1.56 -0.15 0.00 -0.02 0.00 0.00 35.03 33.77 2bw0 n LYS 229 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2bw0 s VAL 230 N -3.39 2.71 -1.44 -0.18 1.01 -1.11 -3.10 120.40 114.89 2bw0 s VAL 230 Ca -0.04 -0.79 0.27 0.00 0.00 0.00 0.00 61.98 61.43 2bw0 s VAL 230 Cb 0.14 -2.11 0.23 0.00 0.00 0.00 0.00 36.38 34.65 2bw0 s VAL 230 CO 0.88 0.54 1.62 -0.81 0.00 0.00 0.00 175.10 177.33 2bw0 n PRO 231 N 3.51 0.48 -0.14 2.72 -0.04 -1.19 -4.62 135.00 135.72 2bw0 n PRO 231 Ca -0.18 -0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 2bw0 n PRO 231 Cb 0.53 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2bw0 n PRO 231 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bw0 n GLY 232 N 1.39 0.20 3.77 0.55 0.00 0.11 -4.80 105.19 106.42 2bw0 n GLY 232 Ca 0.10 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2bw0 n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bw0 s ALA 233 N 0.00 3.51 0.12 4.61 0.00 -1.25 -4.84 121.76 123.91 2bw0 s ALA 233 Ca 0.00 1.38 -0.05 0.00 0.00 0.00 0.00 51.96 53.29 2bw0 s ALA 233 Cb 0.00 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 2bw0 s ALA 233 CO 0.00 -0.82 0.15 1.67 0.00 0.00 0.00 175.76 176.76 2bw0 s TRP 234 N -1.14 0.52 0.24 0.00 1.48 -1.09 -1.34 118.94 117.61 2bw0 s TRP 234 Ca 0.51 -0.92 -0.11 0.00 -1.06 0.00 0.00 56.10 54.51 2bw0 s TRP 234 Cb -0.42 -0.24 -0.01 0.00 -1.16 0.00 0.00 33.47 31.64 2bw0 s TRP 234 CO 0.57 -0.57 0.44 -0.08 -4.06 0.00 0.00 176.95 173.24 2bw0 s THR 235 N -3.97 0.00 -0.21 0.66 -1.32 -0.37 -0.71 115.64 109.72 2bw0 s THR 235 Ca 0.16 -1.48 -0.09 0.00 -1.21 0.00 0.00 61.69 59.07 2bw0 s THR 235 Cb 0.06 -2.25 -0.05 0.00 -1.51 0.00 0.00 72.50 68.75 2bw0 s THR 235 CO -0.03 0.00 0.11 -1.61 -2.21 0.00 0.00 174.62 170.89 2bw0 s GLU 236 N -4.00 4.03 -0.18 7.08 2.02 -1.26 -0.84 118.70 125.55 2bw0 s GLU 236 Ca 0.24 -0.30 -0.19 0.00 0.02 0.00 0.00 54.97 54.74 2bw0 s GLU 236 Cb 0.00 -3.39 0.05 0.00 0.10 0.00 0.00 34.13 30.89 2bw0 s GLU 236 CO 0.10 0.16 0.53 0.00 0.02 0.00 0.00 175.26 176.07 2bw0 s ALA 237 N 0.72 -1.32 -1.41 5.21 0.00 -0.45 -4.07 121.76 120.43 2bw0 s ALA 237 Ca 0.06 1.41 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 2bw0 s ALA 237 Cb -0.13 -0.74 0.04 0.00 0.00 0.00 0.00 23.12 22.29 2bw0 s ALA 237 CO 0.02 -0.26 0.75 0.00 0.00 0.00 0.00 175.76 176.27 2bw0 n GLU 239 N -4.43 -1.49 -3.99 0.00 4.71 -1.26 -4.97 120.64 109.21 2bw0 n GLU 239 Ca -0.17 1.05 -0.09 0.00 -0.01 0.00 0.00 57.16 57.93 2bw0 n GLU 239 Cb 0.62 -5.45 -0.08 0.00 -1.01 0.00 0.00 31.44 25.52 2bw0 n GLU 239 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 2bw0 s GLN 240 N -3.85 1.03 -0.38 3.49 -2.07 -0.91 -5.11 119.66 111.85 2bw0 s GLN 240 Ca 0.00 -1.20 -0.26 0.00 -1.82 0.00 0.00 55.36 52.08 2bw0 s GLN 240 Cb 0.00 0.33 0.02 0.00 -1.09 0.00 0.00 33.01 32.27 2bw0 s GLN 240 CO 0.00 -0.34 0.96 0.15 -1.32 0.00 0.00 175.29 174.74 2bw0 s LYS 241 N -3.96 3.82 -0.11 9.60 1.02 -1.26 -1.35 119.74 127.50 2bw0 s LYS 241 Ca 0.16 0.58 -0.03 0.00 0.02 0.00 0.00 55.97 56.70 2bw0 s LYS 241 Cb 0.05 -3.82 -0.03 0.00 -0.52 0.00 0.00 37.83 33.50 2bw0 s LYS 241 CO -0.02 -1.02 -0.00 -0.51 -0.92 0.00 0.00 175.35 172.88 2bw0 s LEU 242 N 3.62 3.54 -0.11 3.17 1.43 -0.02 -2.83 118.68 127.48 2bw0 s LEU 242 Ca 0.40 0.09 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 2bw0 s LEU 242 Cb -0.11 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 2bw0 s LEU 242 CO 0.21 0.32 -0.05 -0.89 0.23 0.00 0.00 176.35 176.16 2bw0 s THR 243 N -0.52 3.78 -0.11 5.49 2.01 -0.69 -1.24 115.64 124.37 2bw0 s THR 243 Ca 0.09 -0.42 -0.01 0.00 0.31 0.00 0.00 61.69 61.66 2bw0 s THR 243 Cb -0.12 -2.60 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 2bw0 s THR 243 CO 0.02 0.55 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.08 2bw0 s PHE 244 N -0.21 2.97 0.15 4.92 2.99 -0.45 -0.65 117.98 127.70 2bw0 s PHE 244 Ca 0.03 -0.16 0.03 0.00 0.00 0.00 0.00 56.93 56.83 2bw0 s PHE 244 Cb -0.13 -1.82 -0.05 0.00 0.00 0.00 0.00 43.02 41.02 2bw0 s PHE 244 CO 0.03 0.14 -0.05 -0.06 -0.00 0.00 0.00 175.22 175.28 2bw0 s PHE 245 N -0.25 1.18 -1.08 0.36 0.40 -0.59 -4.34 117.98 113.66 2bw0 s PHE 245 Ca 0.04 -0.90 -0.08 0.00 -0.60 0.00 0.00 56.93 55.38 2bw0 s PHE 245 Cb -0.13 -0.65 -0.05 0.00 0.51 0.00 0.00 43.02 42.70 2bw0 s PHE 245 CO 0.02 -0.09 0.90 0.09 0.70 0.00 0.00 175.22 176.85 2bw0 n ASN 246 N -0.20 -5.96 -4.85 1.36 3.02 -1.26 -2.05 115.26 105.32 2bw0 n ASN 246 Ca -0.09 -0.76 -0.32 0.00 -0.03 0.00 0.00 54.58 53.39 2bw0 n ASN 246 Cb 0.62 -4.87 -0.04 0.00 -0.61 0.00 0.00 39.78 34.88 2bw0 n ASN 246 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2bw0 s SER 247 N -3.50 6.64 0.03 6.41 0.15 -1.26 -1.72 113.70 120.46 2bw0 s SER 247 Ca 0.42 1.39 -0.12 0.00 0.70 0.00 0.00 55.95 58.34 2bw0 s SER 247 Cb -0.07 -2.43 0.01 0.00 -1.71 0.00 0.00 66.02 61.82 2bw0 s SER 247 CO 0.76 -0.45 0.25 0.28 1.20 0.00 0.00 173.24 175.28 2bw0 s THR 248 N -2.41 0.09 -2.36 6.45 -1.32 -0.05 -4.90 115.64 111.13 2bw0 s THR 248 Ca 0.56 -0.75 0.23 0.00 -1.21 0.00 0.00 61.69 60.52 2bw0 s THR 248 Cb -0.10 -0.87 0.42 0.00 -1.51 0.00 0.00 72.50 70.45 2bw0 s THR 248 CO 0.28 -0.41 1.39 0.18 -2.21 0.00 0.00 174.62 173.84 2bw0 n LEU 249 N 0.74 3.45 -4.55 9.08 4.77 -1.26 -1.09 117.00 128.14 2bw0 n LEU 249 Ca -0.19 -1.54 -0.41 0.00 -0.03 0.00 0.00 56.01 53.84 2bw0 n LEU 249 Cb 0.59 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 2bw0 n LEU 249 CO 0.22 0.75 1.25 0.21 -1.33 0.00 0.00 177.39 178.49 2bw0 s ASN 250 N -1.43 6.24 -0.12 -1.43 3.84 -1.26 -4.76 114.94 116.02 2bw0 s ASN 250 Ca 0.38 -0.70 0.18 0.00 0.21 0.00 0.00 52.86 52.93 2bw0 s ASN 250 Cb 0.22 -2.56 0.28 0.00 -0.55 0.00 0.00 41.25 38.64 2bw0 s ASN 250 CO 0.31 -1.76 1.15 0.35 -2.79 0.00 0.00 177.10 174.35 2bw0 n THR 251 N 6.52 1.85 -1.60 -5.21 -2.24 -1.26 -4.90 114.28 107.45 2bw0 n THR 251 Ca 0.11 -2.20 -0.52 0.00 -2.27 0.00 0.00 64.05 59.17 2bw0 n THR 251 Cb 0.50 -0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.46 2bw0 n THR 251 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2bw0 n SER 252 N -1.38 1.71 0.00 3.42 3.41 -1.26 -0.99 113.62 118.53 2bw0 n SER 252 Ca 0.15 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.88 2bw0 n SER 252 Cb 0.62 -1.19 0.00 0.00 -0.26 0.00 0.00 64.21 63.38 2bw0 n SER 252 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bw0 n GLY 253 N 2.62 1.82 3.82 5.00 0.00 -1.26 -5.00 105.19 112.19 2bw0 n GLY 253 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2bw0 n GLY 253 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bw0 s LEU 254 N 0.00 4.03 0.05 0.99 1.43 -0.16 -5.07 118.68 119.95 2bw0 s LEU 254 Ca 0.00 1.67 0.05 0.00 -1.03 0.00 0.00 54.13 54.82 2bw0 s LEU 254 Cb 0.00 -4.38 -0.02 0.00 0.03 0.00 0.00 46.19 41.82 2bw0 s LEU 254 CO 0.00 -0.28 -0.13 0.68 0.23 0.00 0.00 176.35 176.84 2bw0 s VAL 255 N -2.04 1.04 -1.51 -1.59 -7.23 -1.26 -5.06 120.40 102.75 2bw0 s VAL 255 Ca 0.59 -1.08 -0.09 0.00 -1.81 0.00 0.00 61.98 59.58 2bw0 s VAL 255 Cb -0.11 -0.98 -0.01 0.00 0.56 0.00 0.00 36.38 35.85 2bw0 s VAL 255 CO 0.16 -0.10 2.67 -0.81 -0.31 0.00 0.00 175.10 176.71 2bw0 n PRO 256 N 1.70 3.82 -5.24 4.82 -0.04 -1.26 -4.85 135.00 133.95 2bw0 n PRO 256 Ca -0.19 -2.64 -0.32 0.00 -0.04 0.00 0.00 63.50 60.31 2bw0 n PRO 256 Cb 0.55 -2.83 -0.16 0.00 -0.04 0.00 0.00 33.50 31.02 2bw0 n PRO 256 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2bw0 s GLU 257 N 1.36 2.64 0.00 0.54 2.02 -1.26 -5.02 118.70 118.98 2bw0 s GLU 257 Ca 0.61 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.71 2bw0 s GLU 257 Cb 0.17 -2.20 0.00 0.00 0.10 0.00 0.00 34.13 32.20 2bw0 s GLU 257 CO -0.07 0.36 0.00 0.41 0.02 0.00 0.00 175.26 175.98 2bw0 n GLY 258 N 3.02 -0.55 3.64 -1.39 0.00 -1.26 -4.65 105.19 104.01 2bw0 n GLY 258 Ca -0.18 -0.30 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 2bw0 n GLY 258 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bw0 s ASP 259 N -4.00 5.57 0.37 1.61 1.01 -0.84 -4.90 116.67 115.49 2bw0 s ASP 259 Ca 0.00 0.09 -0.27 0.00 0.71 0.00 0.00 52.55 53.09 2bw0 s ASP 259 Cb 0.00 -1.91 -0.09 0.00 1.01 0.00 0.00 42.92 41.93 2bw0 s ASP 259 CO 0.00 0.21 1.22 0.00 0.21 0.00 0.00 175.17 176.80 2bw0 s ALA 260 N 0.16 3.27 -0.38 5.23 0.00 -1.26 -0.15 121.76 128.64 2bw0 s ALA 260 Ca 0.04 1.07 0.03 0.00 0.00 0.00 0.00 51.96 53.11 2bw0 s ALA 260 Cb -0.12 -3.42 0.11 0.00 0.00 0.00 0.00 23.12 19.69 2bw0 s ALA 260 CO 0.01 -0.57 0.10 -1.17 0.00 0.00 0.00 175.76 174.13 2bw0 s LEU 261 N -2.22 4.75 0.25 0.00 2.96 0.44 -4.83 118.68 120.03 2bw0 s LEU 261 Ca 0.54 -2.29 -0.30 0.00 -0.22 0.00 0.00 54.13 51.86 2bw0 s LEU 261 Cb -0.34 -1.65 -0.09 0.00 0.50 0.00 0.00 46.19 44.60 2bw0 s LEU 261 CO 0.44 -0.37 1.31 -2.84 -1.32 0.00 0.00 176.35 173.57 2bw0 s PRO 262 N 0.72 4.38 -0.29 0.98 0.02 -1.26 -1.08 135.00 138.48 2bw0 s PRO 262 Ca 0.12 2.11 -0.01 0.00 0.02 0.00 0.00 61.00 63.24 2bw0 s PRO 262 Cb -0.20 -3.15 0.09 0.00 0.02 0.00 0.00 34.50 31.26 2bw0 s PRO 262 CO -0.06 -0.22 0.07 0.42 -0.33 0.00 0.00 177.00 176.87 2bw0 s ILE 263 N -0.33 0.96 0.21 2.83 1.01 -1.26 -4.17 121.20 120.45 2bw0 s ILE 263 Ca 0.54 -1.29 -0.32 0.00 0.00 0.00 0.00 60.65 59.58 2bw0 s ILE 263 Cb -0.38 -1.63 -0.14 0.00 0.01 0.00 0.00 42.46 40.32 2bw0 s ILE 263 CO 0.43 -0.54 1.40 -2.65 0.00 0.00 0.00 174.94 173.58 2bw0 n PRO 264 N 4.83 1.91 0.00 2.79 -0.02 -1.26 -1.41 135.00 141.85 2bw0 n PRO 264 Ca -0.04 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2bw0 n PRO 264 Cb 0.43 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2bw0 n PRO 264 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bw0 n GLY 265 N 2.37 3.19 3.82 -1.23 0.00 -1.26 -4.92 105.19 107.16 2bw0 n GLY 265 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2bw0 n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bw0 s ALA 266 N -2.36 2.84 0.28 4.61 0.00 -0.50 -4.74 121.76 121.89 2bw0 s ALA 266 Ca 0.00 0.26 0.11 0.00 0.00 0.00 0.00 51.96 52.33 2bw0 s ALA 266 Cb 0.00 -3.18 0.39 0.00 0.00 0.00 0.00 23.12 20.32 2bw0 s ALA 266 CO 0.00 -0.70 1.63 1.25 0.00 0.00 0.00 175.76 177.93 2bw0 h HIS 267 N 0.36 0.00 -3.53 0.00 -0.00 -1.82 -3.45 115.15 106.71 2bw0 h HIS 267 Ca -0.46 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 59.81 2bw0 h HIS 267 Cb 1.21 0.00 -0.16 0.00 -0.00 0.00 0.00 27.41 28.46 2bw0 h HIS 267 CO 0.61 0.60 -0.33 1.03 -0.00 0.00 0.00 177.93 179.84 2bw0 s ARG 268 N -3.65 0.78 0.70 5.26 0.52 -1.26 -5.09 118.95 116.21 2bw0 s ARG 268 Ca -0.01 -0.67 -0.16 0.00 -0.52 0.00 0.00 55.73 54.37 2bw0 s ARG 268 Cb 0.13 0.33 0.02 0.00 0.52 0.00 0.00 34.95 35.95 2bw0 s ARG 268 CO 0.76 -0.24 1.22 -2.14 0.02 0.00 0.00 175.30 174.91 2bw0 s PRO 269 N -2.90 2.28 0.74 3.54 0.02 -1.26 -4.64 135.00 132.78 2bw0 s PRO 269 Ca -0.02 1.81 -0.11 0.00 0.02 0.00 0.00 61.00 62.69 2bw0 s PRO 269 Cb 0.00 -1.85 0.04 0.00 0.02 0.00 0.00 34.50 32.72 2bw0 s PRO 269 CO -0.06 -1.74 1.08 0.20 -0.33 0.00 0.00 177.00 176.15 2bw0 s GLY 270 N -1.91 1.66 -0.08 0.52 0.00 -0.24 -4.66 107.32 102.61 2bw0 s GLY 270 Ca 0.76 0.09 0.01 0.00 0.00 0.00 0.00 44.72 45.57 2bw0 s GLY 270 CO 0.43 0.43 -0.08 0.14 0.00 0.00 0.00 173.10 174.02 2bw0 s VAL 271 N -3.02 0.94 -0.36 1.40 1.01 0.28 -0.42 120.40 120.23 2bw0 s VAL 271 Ca 0.60 -0.29 -0.26 0.00 0.00 0.00 0.00 61.98 62.02 2bw0 s VAL 271 Cb -0.15 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.31 2bw0 s VAL 271 CO 0.55 0.33 0.95 -0.69 0.00 0.00 0.00 175.10 176.25 2bw0 s VAL 272 N 1.29 4.57 0.43 2.92 1.01 0.79 -0.59 120.40 130.82 2bw0 s VAL 272 Ca -0.03 1.28 0.06 0.00 0.00 0.00 0.00 61.98 63.29 2bw0 s VAL 272 Cb -0.14 -4.35 -0.07 0.00 0.00 0.00 0.00 36.38 31.83 2bw0 s VAL 272 CO -0.03 -0.53 0.01 0.42 0.00 0.00 0.00 175.10 174.97 2bw0 s THR 273 N 3.52 1.86 0.54 3.92 -4.23 0.38 -1.98 115.64 119.65 2bw0 s THR 273 Ca 0.39 -1.99 0.21 0.00 -1.18 0.00 0.00 61.69 59.13 2bw0 s THR 273 Cb -0.12 -2.85 0.32 0.00 1.34 0.00 0.00 72.50 71.19 2bw0 s THR 273 CO 0.18 0.00 2.12 0.11 -0.54 0.00 0.00 174.62 176.49 2bw0 h LYS 274 N 1.68 0.00 0.00 3.99 1.57 -1.88 -2.21 116.57 119.72 2bw0 h LYS 274 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2bw0 h LYS 274 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 2bw0 h LYS 274 CO 0.79 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.67 2bw0 h ALA 275 N 1.90 1.00 0.00 3.86 0.00 -1.96 -3.45 119.26 120.62 2bw0 h ALA 275 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2bw0 h ALA 275 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2bw0 h ALA 275 CO -0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2bw0 n GLY 276 N 1.16 0.74 3.51 0.00 0.00 -0.83 -4.80 105.19 104.97 2bw0 n GLY 276 Ca 0.05 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 2bw0 n GLY 276 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bw0 s LEU 277 N 0.00 4.63 -0.01 0.99 2.96 0.62 -0.47 118.68 127.40 2bw0 s LEU 277 Ca 0.00 -0.45 -0.30 0.00 -0.22 0.00 0.00 54.13 53.16 2bw0 s LEU 277 Cb 0.00 -2.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.08 2bw0 s LEU 277 CO 0.00 -0.68 1.00 -0.63 -1.32 0.00 0.00 176.35 174.72 2bw0 s ILE 278 N 2.52 4.80 0.12 6.68 1.01 0.25 -0.52 121.20 136.06 2bw0 s ILE 278 Ca 0.18 2.02 0.08 0.00 0.00 0.00 0.00 60.65 62.93 2bw0 s ILE 278 Cb -0.15 -4.29 -0.04 0.00 0.01 0.00 0.00 42.46 37.99 2bw0 s ILE 278 CO 0.16 0.13 -0.20 -0.76 0.00 0.00 0.00 174.94 174.28 2bw0 s LEU 279 N 1.18 2.35 -0.06 2.97 1.43 -0.34 -0.56 118.68 125.65 2bw0 s LEU 279 Ca 0.52 -0.75 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 2bw0 s LEU 279 Cb -0.21 -0.87 -0.03 0.00 0.03 0.00 0.00 46.19 45.12 2bw0 s LEU 279 CO 0.26 0.03 -0.13 -0.36 0.23 0.00 0.00 176.35 176.39 2bw0 s PHE 280 N -1.46 2.76 0.76 0.29 0.40 -1.26 -1.01 117.98 118.46 2bw0 s PHE 280 Ca 0.10 -0.19 -0.09 0.00 -0.60 0.00 0.00 56.93 56.15 2bw0 s PHE 280 Cb -0.09 -1.68 0.17 0.00 0.51 0.00 0.00 43.02 41.94 2bw0 s PHE 280 CO 0.05 0.16 1.04 0.41 0.70 0.00 0.00 175.22 177.58 2bw0 n GLY 281 N 2.46 -0.70 0.00 4.36 0.00 -0.45 -4.64 105.19 106.22 2bw0 n GLY 281 Ca -0.17 -1.82 0.09 0.00 0.00 0.00 0.00 46.02 44.12 2bw0 n GLY 281 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bw0 n ASN 282 N -3.45 0.00 -1.24 1.61 6.94 0.05 -1.97 115.26 117.21 2bw0 n ASN 282 Ca 0.14 -1.42 0.10 0.00 -0.02 0.00 0.00 54.58 53.38 2bw0 n ASN 282 Cb 0.50 0.00 0.29 0.00 -2.36 0.00 0.00 39.78 38.22 2bw0 n ASN 282 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2bw0 n ASP 283 N -0.78 3.88 -1.03 0.53 5.75 -1.26 -4.94 116.55 118.70 2bw0 n ASP 283 Ca 0.13 -2.09 -0.11 0.00 -0.01 0.00 0.00 54.79 52.71 2bw0 n ASP 283 Cb 0.06 -0.45 -0.05 0.00 -1.03 0.00 0.00 41.12 39.65 2bw0 n ASP 283 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2bw0 n ASP 284 N 1.30 -4.31 -4.88 -1.12 8.00 -0.83 -4.98 116.55 109.72 2bw0 n ASP 284 Ca 0.22 0.28 -0.30 0.00 0.71 0.00 0.00 54.79 55.70 2bw0 n ASP 284 Cb 0.63 -3.52 -0.03 0.00 -0.02 0.00 0.00 41.12 38.18 2bw0 n ASP 284 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2bw0 s LYS 285 N -2.81 3.72 0.08 -1.24 1.02 -1.26 -4.87 119.74 114.38 2bw0 s LYS 285 Ca 0.00 0.33 0.02 0.00 0.02 0.00 0.00 55.97 56.35 2bw0 s LYS 285 Cb 0.00 -2.45 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 2bw0 s LYS 285 CO 0.00 0.01 0.10 -1.64 -0.92 0.00 0.00 175.35 172.90 2bw0 s MET 286 N -3.85 2.98 0.24 1.68 -1.94 -1.26 -1.34 119.30 115.81 2bw0 s MET 286 Ca 0.49 -0.65 0.03 0.00 -1.71 0.00 0.00 55.69 53.86 2bw0 s MET 286 Cb -0.10 -2.78 -0.05 0.00 2.01 0.00 0.00 34.83 33.90 2bw0 s MET 286 CO 0.32 0.57 0.01 -0.48 -0.01 0.00 0.00 175.02 175.43 2bw0 s LEU 287 N -2.41 2.14 -0.10 -0.03 2.34 -0.18 -4.86 118.68 115.59 2bw0 s LEU 287 Ca 0.30 -1.24 0.01 0.00 0.06 0.00 0.00 54.13 53.26 2bw0 s LEU 287 Cb -0.12 -0.25 0.02 0.00 -0.56 0.00 0.00 46.19 45.28 2bw0 s LEU 287 CO 0.23 -0.54 -0.11 -0.22 -1.06 0.00 0.00 176.35 174.66 2bw0 s LEU 288 N -3.31 1.46 -0.22 1.48 2.96 -0.25 -1.20 118.68 119.59 2bw0 s LEU 288 Ca 0.30 -0.33 -0.09 0.00 -0.22 0.00 0.00 54.13 53.79 2bw0 s LEU 288 Cb 0.06 -0.88 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 2bw0 s LEU 288 CO 0.09 -0.04 0.11 -0.69 -1.32 0.00 0.00 176.35 174.50 2bw0 s VAL 289 N 1.21 4.98 -0.14 1.68 1.01 0.33 -0.88 120.40 128.59 2bw0 s VAL 289 Ca -0.04 0.04 0.20 0.00 0.00 0.00 0.00 61.98 62.19 2bw0 s VAL 289 Cb -0.14 -3.29 -0.17 0.00 0.00 0.00 0.00 36.38 32.78 2bw0 s VAL 289 CO -0.03 0.39 0.71 0.29 0.00 0.00 0.00 175.10 176.45 2bw0 n LYS 290 N 4.11 0.64 -4.16 2.72 5.02 -0.70 -0.27 118.16 125.51 2bw0 n LYS 290 Ca -0.16 0.04 -0.16 0.00 -2.02 0.00 0.00 58.31 56.01 2bw0 n LYS 290 Cb 0.52 -1.70 -0.12 0.00 -0.02 0.00 0.00 35.03 33.71 2bw0 n LYS 290 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2bw0 s ASN 291 N -5.24 1.26 -0.02 4.39 -0.87 -0.87 -0.39 114.94 113.21 2bw0 s ASN 291 Ca -0.04 -0.52 0.02 0.00 -1.57 0.00 0.00 52.86 50.75 2bw0 s ASN 291 Cb 0.10 -0.03 -0.00 0.00 -0.02 0.00 0.00 41.25 41.31 2bw0 s ASN 291 CO 0.84 -0.10 -0.08 -0.63 -2.57 0.00 0.00 177.10 174.55 2bw0 s ILE 292 N -1.16 0.70 -0.19 0.60 1.01 -0.44 -1.54 121.20 120.19 2bw0 s ILE 292 Ca -0.04 -0.35 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 2bw0 s ILE 292 Cb -0.09 -0.61 -0.02 0.00 0.01 0.00 0.00 42.46 41.75 2bw0 s ILE 292 CO 0.01 0.21 -0.04 -1.58 0.00 0.00 0.00 174.94 173.55 2bw0 s GLN 293 N 0.02 3.51 0.74 2.79 0.74 0.17 -0.69 119.66 126.94 2bw0 s GLN 293 Ca -0.00 -0.58 -0.11 0.00 0.05 0.00 0.00 55.36 54.72 2bw0 s GLN 293 Cb -0.06 -2.96 0.03 0.00 1.10 0.00 0.00 33.01 31.12 2bw0 s GLN 293 CO -0.00 0.01 1.10 -0.51 -0.55 0.00 0.00 175.29 175.34 2bw0 s LEU 294 N 0.96 2.79 0.39 3.68 1.43 0.33 -1.70 118.68 126.56 2bw0 s LEU 294 Ca 0.00 1.19 0.09 0.00 -1.03 0.00 0.00 54.13 54.39 2bw0 s LEU 294 Cb -0.15 -3.92 0.86 0.00 0.03 0.00 0.00 46.19 43.01 2bw0 s LEU 294 CO 0.01 -1.57 1.94 -0.08 0.23 0.00 0.00 176.35 176.89 2bw0 h GLU 295 N -0.81 0.60 0.00 1.70 4.81 -1.85 0.59 114.58 119.62 2bw0 h GLU 295 Ca -0.46 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2bw0 h GLU 295 Cb 1.26 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2bw0 h GLU 295 CO 0.62 0.40 0.00 -0.40 -0.73 0.00 0.00 179.01 178.90 2bw0 n ASP 296 N -4.49 0.00 0.00 1.04 5.68 -1.26 -4.87 116.55 112.65 2bw0 n ASP 296 Ca 0.12 -0.25 0.00 0.00 -0.50 0.00 0.00 54.79 54.15 2bw0 n ASP 296 Cb 0.34 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 2bw0 n ASP 296 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bw0 n GLY 297 N 0.58 0.24 3.72 6.12 0.00 0.20 -5.05 105.19 111.00 2bw0 n GLY 297 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2bw0 n GLY 297 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bw0 s LYS 298 N -0.90 4.31 -0.15 1.61 2.20 -1.26 -4.68 119.74 120.87 2bw0 s LYS 298 Ca 0.00 2.14 -0.14 0.00 -0.36 0.00 0.00 55.97 57.61 2bw0 s LYS 298 Cb 0.00 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 33.06 2bw0 s LYS 298 CO 0.00 -0.44 0.30 1.41 -0.36 0.00 0.00 175.35 176.26 2bw0 s MET 299 N 0.81 4.21 0.16 4.03 -2.45 -1.26 -0.51 119.30 124.28 2bw0 s MET 299 Ca 0.64 0.12 0.02 0.00 -1.25 0.00 0.00 55.69 55.22 2bw0 s MET 299 Cb -0.38 -3.41 -0.05 0.00 1.25 0.00 0.00 34.83 32.25 2bw0 s MET 299 CO 0.33 0.28 -0.02 0.96 1.05 0.00 0.00 175.02 177.61 2bw0 s ILE 300 N 0.33 0.75 0.19 10.11 -4.36 0.13 -5.01 121.20 123.34 2bw0 s ILE 300 Ca 0.17 -1.98 -0.30 0.00 -0.26 0.00 0.00 60.65 58.28 2bw0 s ILE 300 Cb -0.13 -2.00 -0.08 0.00 1.25 0.00 0.00 42.46 41.50 2bw0 s ILE 300 CO 0.05 -0.59 1.18 -0.76 0.24 0.00 0.00 174.94 175.06 2bw0 s LEU 301 N -3.15 4.46 0.39 0.37 1.43 -1.26 -1.32 118.68 119.60 2bw0 s LEU 301 Ca 0.21 2.22 0.06 0.00 -1.03 0.00 0.00 54.13 55.58 2bw0 s LEU 301 Cb 0.05 -3.61 0.78 0.00 0.03 0.00 0.00 46.19 43.45 2bw0 s LEU 301 CO 0.02 -0.34 2.02 0.00 0.23 0.00 0.00 176.35 178.27 2bw0 h ALA 302 N 5.16 1.62 0.00 4.21 0.00 -0.99 0.07 119.26 129.34 2bw0 h ALA 302 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2bw0 h ALA 302 Cb 1.21 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2bw0 h ALA 302 CO 0.74 0.32 0.00 0.66 0.00 0.00 0.00 179.25 180.97 2bw0 h SER 303 N 0.59 0.00 -0.65 0.00 4.64 -1.79 -0.79 113.55 115.56 2bw0 h SER 303 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2bw0 h SER 303 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2bw0 h SER 303 CO -0.03 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.52 2bw0 n ASN 304 N -2.97 4.73 -0.26 4.97 3.02 0.01 -4.66 115.26 120.10 2bw0 n ASN 304 Ca -0.02 -2.44 -0.01 0.00 -0.03 0.00 0.00 54.58 52.08 2bw0 n ASN 304 Cb 0.09 -0.58 0.12 0.00 -0.61 0.00 0.00 39.78 38.80 2bw0 n ASN 304 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2bw0 h PHE 305 N 4.07 0.80 -0.55 3.10 3.04 -1.22 -0.87 116.94 125.31 2bw0 h PHE 305 Ca 0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2bw0 h PHE 305 Cb 1.45 -0.25 0.00 0.00 2.56 0.00 0.00 35.95 39.70 2bw0 h PHE 305 CO 0.77 0.39 0.00 1.19 -2.02 0.00 0.00 178.31 178.65 2bw0 n PHE 306 N -4.72 1.16 -0.88 0.41 3.01 -1.26 -5.17 117.46 110.01 2bw0 n PHE 306 Ca 0.10 -0.48 0.00 0.00 1.01 0.00 0.00 57.45 58.08 2bw0 n PHE 306 Cb 0.18 -0.17 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 2bw0 n PHE 306 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94