#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b09 s THR 2 N 0.00 2.21 -0.98 5.09 2.01 -0.26 -4.85 115.64 118.86 1b09 s THR 2 Ca 0.00 -0.95 -0.22 0.00 0.31 0.00 0.00 61.69 60.83 1b09 s THR 2 Cb 0.00 -1.87 0.07 0.00 0.01 0.00 0.00 72.50 70.71 1b09 s THR 2 CO 0.00 0.55 1.37 -0.62 -0.69 0.00 0.00 174.62 175.23 1b09 s ASP 3 N 0.50 6.51 0.00 3.53 2.15 -1.24 0.11 116.67 128.22 1b09 s ASP 3 Ca -0.14 -1.53 0.00 0.00 0.43 0.00 0.00 52.55 51.31 1b09 s ASP 3 Cb -0.17 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 1b09 s ASP 3 CO 0.05 -1.43 0.60 0.23 -0.17 0.00 0.00 175.17 174.45 1b09 n MET 4 N 8.39 0.86 -1.66 4.34 2.81 -0.46 -4.89 117.12 126.51 1b09 n MET 4 Ca 0.29 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.75 1b09 n MET 4 Cb 0.50 -1.29 -0.03 0.00 -0.71 0.00 0.00 33.22 31.69 1b09 n MET 4 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1b09 n SER 5 N 0.27 4.02 0.00 7.83 2.88 -1.26 -1.84 113.62 125.52 1b09 n SER 5 Ca 0.00 0.87 0.00 0.00 -1.33 0.00 0.00 58.87 58.41 1b09 n SER 5 Cb 0.30 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 1b09 n SER 5 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1b09 n ARG 6 N 7.49 0.00 -4.37 -1.46 5.12 -1.26 -5.05 116.66 117.13 1b09 n ARG 6 Ca 0.21 0.37 -0.19 0.00 -1.93 0.00 0.00 57.85 56.31 1b09 n ARG 6 Cb 0.39 -3.85 -0.10 0.00 -1.16 0.00 0.00 32.46 27.74 1b09 n ARG 6 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1b09 s LYS 7 N -2.51 1.39 0.01 5.56 1.02 -0.77 -3.13 119.74 121.32 1b09 s LYS 7 Ca 0.00 -1.67 -0.06 0.00 0.02 0.00 0.00 55.97 54.26 1b09 s LYS 7 Cb 0.00 -0.98 -0.00 0.00 -0.52 0.00 0.00 37.83 36.32 1b09 s LYS 7 CO 0.00 0.06 0.10 0.00 -0.92 0.00 0.00 175.35 174.59 1b09 s ALA 8 N -3.11 -0.20 -0.10 5.17 0.00 0.97 -4.55 121.76 119.94 1b09 s ALA 8 Ca 0.26 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.63 1b09 s ALA 8 Cb 0.03 0.14 -0.03 0.00 0.00 0.00 0.00 23.12 23.26 1b09 s ALA 8 CO 0.09 -0.21 1.28 -0.06 0.00 0.00 0.00 175.76 176.85 1b09 s PHE 9 N -1.57 2.92 -0.27 0.00 0.08 -0.37 -1.88 117.98 116.89 1b09 s PHE 9 Ca -0.14 1.01 -0.06 0.00 0.12 0.00 0.00 56.93 57.86 1b09 s PHE 9 Cb -0.07 -3.52 -0.00 0.00 -0.57 0.00 0.00 43.02 38.86 1b09 s PHE 9 CO 0.00 -1.77 0.05 0.54 -0.10 0.00 0.00 175.22 173.94 1b09 s VAL 10 N 2.93 3.90 -0.60 -0.44 0.11 0.15 -1.03 120.40 125.42 1b09 s VAL 10 Ca 0.57 -0.53 -0.17 0.00 -2.93 0.00 0.00 61.98 58.92 1b09 s VAL 10 Cb -0.25 -2.92 0.13 0.00 -1.53 0.00 0.00 36.38 31.81 1b09 s VAL 10 CO 0.19 0.22 0.62 -0.36 -3.33 0.00 0.00 175.10 172.45 1b09 s PHE 11 N 1.52 3.19 -0.40 1.54 0.40 0.21 -0.67 117.98 123.77 1b09 s PHE 11 Ca 0.04 -1.23 0.22 0.00 -0.60 0.00 0.00 56.93 55.36 1b09 s PHE 11 Cb -0.16 -3.90 0.30 0.00 0.51 0.00 0.00 43.02 39.77 1b09 s PHE 11 CO 0.01 -1.14 1.58 -1.35 0.70 0.00 0.00 175.22 175.02 1b09 h PRO 12 N 8.90 0.00 -3.90 0.24 0.11 -1.82 -1.13 132.00 134.41 1b09 h PRO 12 Ca -0.25 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.72 1b09 h PRO 12 Cb 1.09 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.01 1b09 h PRO 12 CO 1.04 0.05 -0.60 -1.59 -0.21 0.00 0.00 178.00 176.69 1b09 s LYS 13 N -3.19 0.49 0.16 1.05 -2.85 -1.26 -4.86 119.74 109.28 1b09 s LYS 13 Ca 0.06 -0.74 -0.31 0.00 -1.00 0.00 0.00 55.97 53.98 1b09 s LYS 13 Cb 0.05 0.18 -0.11 0.00 -2.06 0.00 0.00 37.83 35.90 1b09 s LYS 13 CO 0.68 -0.11 1.73 -2.00 0.10 0.00 0.00 175.35 175.76 1b09 s GLU 14 N -2.31 4.15 0.12 1.78 2.12 -1.26 -4.93 118.70 118.36 1b09 s GLU 14 Ca -0.08 2.54 -0.03 0.00 0.36 0.00 0.00 54.97 57.76 1b09 s GLU 14 Cb -0.03 -3.31 0.01 0.00 0.26 0.00 0.00 34.13 31.06 1b09 s GLU 14 CO -0.04 -0.76 0.21 -1.13 -0.54 0.00 0.00 175.26 173.00 1b09 n SER 15 N 4.72 -0.61 0.00 -1.70 3.41 -1.26 -5.05 113.62 113.13 1b09 n SER 15 Ca 0.16 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.26 1b09 n SER 15 Cb 0.37 1.04 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1b09 n SER 15 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1b09 n ASP 16 N -1.43 0.75 0.00 4.04 2.03 -1.26 -4.36 116.55 116.32 1b09 n ASP 16 Ca -0.02 -0.89 0.00 0.00 0.52 0.00 0.00 54.79 54.40 1b09 n ASP 16 Cb 0.18 0.20 0.00 0.00 -0.72 0.00 0.00 41.12 40.78 1b09 n ASP 16 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1b09 n THR 17 N -0.20 0.00 -3.41 5.18 -2.24 -1.26 -4.83 114.28 107.53 1b09 n THR 17 Ca 0.00 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 1b09 n THR 17 Cb 0.01 1.15 -0.06 0.00 -2.10 0.00 0.00 70.33 69.33 1b09 n THR 17 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1b09 s SER 18 N 0.00 6.62 0.32 3.42 0.01 -1.25 -4.14 113.70 118.68 1b09 s SER 18 Ca 0.00 0.73 -0.18 0.00 1.31 0.00 0.00 55.95 57.81 1b09 s SER 18 Cb 0.00 -2.25 0.05 0.00 0.21 0.00 0.00 66.02 64.03 1b09 s SER 18 CO 0.00 0.07 0.83 -0.72 0.41 0.00 0.00 173.24 173.83 1b09 s TYR 19 N 0.38 0.04 -0.04 2.43 -0.85 0.38 -4.54 117.35 115.15 1b09 s TYR 19 Ca 0.23 -0.61 0.04 0.00 -0.52 0.00 0.00 57.07 56.21 1b09 s TYR 19 Cb -0.15 0.78 -0.00 0.00 0.38 0.00 0.00 41.96 42.97 1b09 s TYR 19 CO 0.08 -1.36 -0.16 0.08 -1.52 0.00 0.00 175.55 172.67 1b09 s VAL 20 N -2.66 1.37 -0.25 -3.49 1.01 -0.94 -0.80 120.40 114.65 1b09 s VAL 20 Ca 0.15 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.36 1b09 s VAL 20 Cb -0.05 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 1b09 s VAL 20 CO 0.09 0.40 0.11 -0.55 0.00 0.00 0.00 175.10 175.15 1b09 s SER 21 N 0.05 5.53 0.06 3.32 0.15 0.40 -1.75 113.70 121.45 1b09 s SER 21 Ca -0.04 -0.09 -0.25 0.00 0.70 0.00 0.00 55.95 56.27 1b09 s SER 21 Cb -0.11 -2.00 -0.06 0.00 -1.71 0.00 0.00 66.02 62.14 1b09 s SER 21 CO 0.02 -0.01 0.78 -0.76 1.20 0.00 0.00 173.24 174.47 1b09 s LEU 22 N 1.50 4.46 -0.29 3.45 1.02 -0.54 0.12 118.68 128.39 1b09 s LEU 22 Ca 0.06 1.48 -0.11 0.00 0.02 0.00 0.00 54.13 55.59 1b09 s LEU 22 Cb -0.15 -3.26 -0.04 0.00 0.02 0.00 0.00 46.19 42.77 1b09 s LEU 22 CO 0.06 0.02 0.18 -0.54 0.02 0.00 0.00 176.35 176.09 1b09 s LYS 23 N -0.11 3.76 -0.23 1.70 -0.14 -0.19 -4.20 119.74 120.32 1b09 s LYS 23 Ca 0.39 -0.45 -0.06 0.00 -1.36 0.00 0.00 55.97 54.49 1b09 s LYS 23 Cb -0.21 -3.65 -0.02 0.00 -1.68 0.00 0.00 37.83 32.27 1b09 s LYS 23 CO 0.24 -0.26 0.03 0.00 -0.76 0.00 0.00 175.35 174.59 1b09 s ALA 24 N 1.72 3.07 -0.10 5.17 0.00 -1.26 -4.72 121.76 125.63 1b09 s ALA 24 Ca 0.06 -1.09 -0.04 0.00 0.00 0.00 0.00 51.96 50.90 1b09 s ALA 24 Cb -0.16 -1.92 -0.14 0.00 0.00 0.00 0.00 23.12 20.90 1b09 s ALA 24 CO 0.10 -0.36 2.25 -0.35 0.00 0.00 0.00 175.76 177.40 1b09 n PRO 25 N 4.67 1.24 -2.33 0.00 -0.04 -1.26 -4.90 135.00 132.38 1b09 n PRO 25 Ca -0.17 -0.67 -0.35 0.00 -0.04 0.00 0.00 63.50 62.27 1b09 n PRO 25 Cb 0.51 -1.86 -0.01 0.00 -0.04 0.00 0.00 33.50 32.11 1b09 n PRO 25 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1b09 s LEU 26 N 0.01 3.83 0.00 1.53 1.02 -1.26 -4.92 118.68 118.90 1b09 s LEU 26 Ca 0.38 2.15 0.00 0.00 0.02 0.00 0.00 54.13 56.68 1b09 s LEU 26 Cb 0.17 -4.50 0.00 0.00 0.02 0.00 0.00 46.19 41.88 1b09 s LEU 26 CO -0.00 -1.05 0.00 0.35 0.02 0.00 0.00 176.35 175.67 1b09 n THR 27 N -1.03 0.00 -3.87 5.49 -2.24 -1.26 -4.98 114.28 106.38 1b09 n THR 27 Ca 0.10 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.53 1b09 n THR 27 Cb 0.51 -0.04 -0.05 0.00 -2.10 0.00 0.00 70.33 68.64 1b09 n THR 27 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1b09 s LYS 28 N -1.14 3.46 0.89 -0.78 -0.14 -1.26 -5.04 119.74 115.72 1b09 s LYS 28 Ca 0.00 -0.19 -0.11 0.00 -1.36 0.00 0.00 55.97 54.31 1b09 s LYS 28 Cb 0.00 -3.15 0.13 0.00 -1.68 0.00 0.00 37.83 33.14 1b09 s LYS 28 CO 0.00 0.73 1.16 -1.25 -0.76 0.00 0.00 175.35 175.22 1b09 s PRO 29 N -1.45 1.17 -0.03 -1.68 0.04 -1.26 -4.77 135.00 127.03 1b09 s PRO 29 Ca 0.21 1.58 -0.25 0.00 0.04 0.00 0.00 61.00 62.58 1b09 s PRO 29 Cb -0.12 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1b09 s PRO 29 CO 0.11 -2.53 0.77 -0.51 0.04 0.00 0.00 177.00 174.88 1b09 s LEU 30 N -6.42 4.36 0.00 -3.56 2.01 0.25 -4.91 118.68 110.41 1b09 s LEU 30 Ca 0.68 1.34 0.07 0.00 0.01 0.00 0.00 54.13 56.23 1b09 s LEU 30 Cb -0.24 -3.21 0.02 0.00 0.01 0.00 0.00 46.19 42.77 1b09 s LEU 30 CO 0.56 -0.11 0.59 0.29 1.01 0.00 0.00 176.35 178.69 1b09 n LYS 31 N 3.58 1.53 -3.60 1.70 4.76 -1.26 -0.35 118.16 124.52 1b09 n LYS 31 Ca -0.00 -0.65 -0.08 0.00 -2.87 0.00 0.00 58.31 54.72 1b09 n LYS 31 Cb 0.51 -1.04 -0.05 0.00 -1.84 0.00 0.00 35.03 32.62 1b09 n LYS 31 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1b09 s ALA 32 N -0.92 -1.99 0.30 7.82 0.00 -1.26 -0.56 121.76 125.15 1b09 s ALA 32 Ca 0.07 1.68 -0.14 0.00 0.00 0.00 0.00 51.96 53.57 1b09 s ALA 32 Cb 0.06 -0.95 0.01 0.00 0.00 0.00 0.00 23.12 22.24 1b09 s ALA 32 CO 0.15 -0.29 0.59 -0.59 0.00 0.00 0.00 175.76 175.62 1b09 s PHE 33 N -1.10 0.31 -0.15 0.00 -0.12 -0.55 -3.93 117.98 112.43 1b09 s PHE 33 Ca 0.02 -0.73 -0.06 0.00 -0.05 0.00 0.00 56.93 56.10 1b09 s PHE 33 Cb -0.01 0.39 0.07 0.00 -0.63 0.00 0.00 43.02 42.84 1b09 s PHE 33 CO -0.01 -1.19 0.34 0.99 -0.05 0.00 0.00 175.22 175.30 1b09 s THR 34 N -3.50 -0.33 -0.01 -4.49 2.01 -0.96 -2.02 115.64 106.34 1b09 s THR 34 Ca 0.20 0.18 0.06 0.00 0.31 0.00 0.00 61.69 62.44 1b09 s THR 34 Cb -0.03 -0.53 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 1b09 s THR 34 CO 0.11 0.08 -0.20 0.54 -0.69 0.00 0.00 174.62 174.46 1b09 s VAL 35 N 2.04 1.55 0.16 3.82 0.11 -0.63 -0.42 120.40 127.03 1b09 s VAL 35 Ca -0.04 -0.88 0.07 0.00 -2.93 0.00 0.00 61.98 58.21 1b09 s VAL 35 Cb -0.11 -1.30 -0.04 0.00 -1.53 0.00 0.00 36.38 33.40 1b09 s VAL 35 CO -0.11 0.41 -0.16 0.00 -3.33 0.00 0.00 175.10 171.91 1b09 s LEU 37 N -2.71 -0.18 0.06 0.00 -0.00 -0.70 -0.63 118.68 114.52 1b09 s LEU 37 Ca 0.15 -0.04 -0.02 0.00 -0.00 0.00 0.00 54.13 54.22 1b09 s LEU 37 Cb -0.04 1.57 -0.04 0.00 -0.00 0.00 0.00 46.19 47.68 1b09 s LEU 37 CO 0.05 -0.37 0.23 -1.00 -0.00 0.00 0.00 176.35 175.27 1b09 s HIS 38 N -2.63 3.52 0.28 3.48 3.76 0.10 -2.47 115.29 121.33 1b09 s HIS 38 Ca 0.09 0.33 -0.19 0.00 -0.15 0.00 0.00 55.06 55.14 1b09 s HIS 38 Cb -0.00 -1.82 0.02 0.00 1.11 0.00 0.00 32.58 31.88 1b09 s HIS 38 CO -0.05 0.58 0.67 -0.59 -0.85 0.00 0.00 174.74 174.50 1b09 s PHE 39 N -1.49 -0.07 -0.30 1.40 -0.71 -0.86 -1.38 117.98 114.58 1b09 s PHE 39 Ca 0.34 -0.38 -0.07 0.00 -1.04 0.00 0.00 56.93 55.79 1b09 s PHE 39 Cb -0.13 0.61 0.15 0.00 -1.21 0.00 0.00 43.02 42.45 1b09 s PHE 39 CO 0.25 -1.20 0.65 -0.47 -1.34 0.00 0.00 175.22 173.11 1b09 s TYR 40 N -3.89 -1.41 0.23 3.49 5.04 -0.82 -1.33 117.35 118.66 1b09 s TYR 40 Ca 0.13 2.04 -0.19 0.00 -2.44 0.00 0.00 57.07 56.61 1b09 s TYR 40 Cb -0.05 0.70 0.03 0.00 0.35 0.00 0.00 41.96 42.98 1b09 s TYR 40 CO 0.08 -0.73 0.59 -0.08 -1.34 0.00 0.00 175.55 174.07 1b09 s THR 41 N 2.87 0.01 -0.57 4.34 -1.32 -1.26 -2.11 115.64 117.60 1b09 s THR 41 Ca 0.04 -0.83 0.12 0.00 -1.21 0.00 0.00 61.69 59.81 1b09 s THR 41 Cb -0.13 -1.72 0.34 0.00 -1.51 0.00 0.00 72.50 69.48 1b09 s THR 41 CO -0.20 -0.05 1.27 -0.62 -2.21 0.00 0.00 174.62 172.82 1b09 n GLU 42 N -0.39 2.83 0.23 7.08 1.02 -1.26 -4.67 120.64 125.48 1b09 n GLU 42 Ca -0.08 -2.25 0.14 0.00 -0.02 0.00 0.00 57.16 54.95 1b09 n GLU 42 Cb 0.62 -1.42 0.36 0.00 -0.02 0.00 0.00 31.44 30.97 1b09 n GLU 42 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1b09 h LEU 43 N 1.66 0.00 -2.15 -4.62 4.07 -1.89 -3.38 115.31 108.99 1b09 h LEU 43 Ca 0.00 0.00 0.07 0.00 0.08 0.00 0.00 57.88 58.03 1b09 h LEU 43 Cb 0.93 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.66 1b09 h LEU 43 CO 0.07 0.00 0.23 0.28 -1.08 0.00 0.00 178.44 177.94 1b09 h SER 44 N 0.00 0.00 0.29 -0.43 0.02 -1.83 -0.36 113.55 111.23 1b09 h SER 44 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1b09 h SER 44 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.35 1b09 h SER 44 CO 0.00 0.00 -1.38 -1.54 -1.14 0.00 0.00 176.83 172.77 1b09 n SER 45 N -3.94 0.47 -0.08 3.07 3.41 -1.26 -4.55 113.62 110.75 1b09 n SER 45 Ca 0.03 -0.17 -0.07 0.00 -0.26 0.00 0.00 58.87 58.39 1b09 n SER 45 Cb 0.37 1.22 -0.03 0.00 -0.26 0.00 0.00 64.21 65.52 1b09 n SER 45 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1b09 n THR 46 N -2.10 1.44 -4.33 6.66 -2.24 -0.32 -4.99 114.28 108.40 1b09 n THR 46 Ca -0.00 0.18 -0.21 0.00 -2.27 0.00 0.00 64.05 61.75 1b09 n THR 46 Cb 0.49 -2.35 -0.08 0.00 -2.10 0.00 0.00 70.33 66.29 1b09 n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b09 s ARG 47 N -2.35 1.78 0.50 -0.78 1.70 -0.30 -5.00 118.95 114.49 1b09 s ARG 47 Ca -0.18 -2.04 0.02 0.00 -0.47 0.00 0.00 55.73 53.05 1b09 s ARG 47 Cb 0.03 0.12 0.02 0.00 -0.57 0.00 0.00 34.95 34.55 1b09 s ARG 47 CO 0.28 -0.61 0.71 0.20 -1.08 0.00 0.00 175.30 174.80 1b09 s GLY 48 N -3.42 1.76 0.20 3.88 0.00 -1.26 -4.15 107.32 104.34 1b09 s GLY 48 Ca 0.37 -1.31 -0.23 0.00 0.00 0.00 0.00 44.72 43.55 1b09 s GLY 48 CO 0.24 -1.08 0.67 -2.52 0.00 0.00 0.00 173.10 170.41 1b09 s TYR 49 N -2.62 -0.39 -0.11 1.90 -0.85 -0.42 -4.53 117.35 110.32 1b09 s TYR 49 Ca 0.54 0.09 -0.09 0.00 -0.52 0.00 0.00 57.07 57.08 1b09 s TYR 49 Cb -0.10 0.62 -0.04 0.00 0.38 0.00 0.00 41.96 42.81 1b09 s TYR 49 CO 0.37 -0.98 0.20 0.45 -1.52 0.00 0.00 175.55 174.07 1b09 s SER 50 N -2.81 6.45 -0.16 -0.18 0.15 -0.20 -1.54 113.70 115.41 1b09 s SER 50 Ca 0.05 0.53 0.15 0.00 0.70 0.00 0.00 55.95 57.38 1b09 s SER 50 Cb -0.03 -2.11 -0.20 0.00 -1.71 0.00 0.00 66.02 61.96 1b09 s SER 50 CO -0.05 0.34 0.07 -0.38 1.20 0.00 0.00 173.24 174.42 1b09 n ILE 51 N 2.28 1.08 -3.20 6.45 5.41 -0.63 -4.54 119.36 126.22 1b09 n ILE 51 Ca -0.18 -0.68 0.01 0.00 1.00 0.00 0.00 62.75 62.90 1b09 n ILE 51 Cb 0.54 -0.55 -0.03 0.00 -0.71 0.00 0.00 39.64 38.90 1b09 n ILE 51 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 1b09 s PHE 52 N -2.42 -1.44 -0.17 1.39 5.36 -1.15 -4.70 117.98 114.86 1b09 s PHE 52 Ca -0.08 1.42 -0.04 0.00 -0.96 0.00 0.00 56.93 57.27 1b09 s PHE 52 Cb 0.05 0.40 -0.03 0.00 -0.34 0.00 0.00 43.02 43.10 1b09 s PHE 52 CO 0.67 -0.87 -0.03 0.45 -1.46 0.00 0.00 175.22 173.98 1b09 s SER 53 N 2.78 4.80 -0.32 6.13 0.15 -1.08 -1.70 113.70 124.45 1b09 s SER 53 Ca 0.18 -0.15 0.04 0.00 0.70 0.00 0.00 55.95 56.72 1b09 s SER 53 Cb -0.15 -1.79 0.09 0.00 -1.71 0.00 0.00 66.02 62.46 1b09 s SER 53 CO -0.21 0.15 0.02 -0.47 1.20 0.00 0.00 173.24 173.92 1b09 s TYR 54 N 0.51 3.55 -0.10 3.44 6.14 0.30 -1.50 117.35 129.69 1b09 s TYR 54 Ca -0.03 -2.78 -0.01 0.00 0.64 0.00 0.00 57.07 54.88 1b09 s TYR 54 Cb -0.14 -2.64 -0.03 0.00 0.42 0.00 0.00 41.96 39.57 1b09 s TYR 54 CO 0.03 -0.93 -0.04 0.00 0.64 0.00 0.00 175.55 175.25 1b09 s ALA 55 N 0.98 3.06 0.07 3.97 0.00 0.23 -1.59 121.76 128.48 1b09 s ALA 55 Ca 0.06 -0.84 0.09 0.00 0.00 0.00 0.00 51.96 51.27 1b09 s ALA 55 Cb -0.19 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.49 1b09 s ALA 55 CO -0.08 0.45 -0.25 0.99 0.00 0.00 0.00 175.76 176.87 1b09 s THR 56 N -0.41 2.04 0.57 0.00 2.01 0.72 0.73 115.64 121.30 1b09 s THR 56 Ca 0.07 -1.46 0.33 0.00 0.31 0.00 0.00 61.69 60.94 1b09 s THR 56 Cb -0.12 -1.77 0.48 0.00 0.01 0.00 0.00 72.50 71.09 1b09 s THR 56 CO 0.02 0.23 1.75 0.07 -0.69 0.00 0.00 174.62 176.01 1b09 h LYS 57 N 4.52 0.00 0.06 4.92 -0.00 -1.98 0.45 116.57 124.55 1b09 h LYS 57 Ca -0.47 0.00 -0.29 0.00 -0.00 0.00 0.00 60.65 59.89 1b09 h LYS 57 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.36 1b09 h LYS 57 CO 0.42 0.00 -1.51 -0.09 -0.00 0.00 0.00 179.45 178.27 1b09 h ARG 58 N 0.00 0.14 -4.20 0.07 2.43 -1.95 -3.46 114.38 107.40 1b09 h ARG 58 Ca 0.44 -0.23 -0.48 0.00 -0.81 0.00 0.00 59.98 58.90 1b09 h ARG 58 Cb 2.03 0.09 -0.35 0.00 -0.42 0.00 0.00 29.97 31.32 1b09 h ARG 58 CO -0.00 0.93 -0.79 -1.14 -1.51 0.00 0.00 179.97 177.45 1b09 s GLN 59 N -2.63 1.30 0.13 0.20 -0.44 0.16 -5.03 119.66 113.35 1b09 s GLN 59 Ca -0.07 -0.22 0.02 0.00 -2.50 0.00 0.00 55.36 52.59 1b09 s GLN 59 Cb 0.08 -1.28 -0.11 0.00 -1.64 0.00 0.00 33.01 30.06 1b09 s GLN 59 CO 0.83 -0.14 1.30 0.38 0.50 0.00 0.00 175.29 178.16 1b09 h ASP 60 N 7.61 0.26 -2.76 6.67 2.03 -1.88 0.20 116.42 128.55 1b09 h ASP 60 Ca -0.31 -0.23 -0.76 0.00 -0.73 0.00 0.00 57.03 55.00 1b09 h ASP 60 Cb 1.15 -0.08 -0.31 0.00 -0.83 0.00 0.00 39.33 39.26 1b09 h ASP 60 CO 0.42 1.09 0.46 0.59 -1.03 0.00 0.00 179.24 180.78 1b09 n ASN 61 N -3.58 5.81 0.12 4.15 3.02 -1.26 -4.11 115.26 119.41 1b09 n ASN 61 Ca -0.04 -3.42 -0.10 0.00 -0.03 0.00 0.00 54.58 50.99 1b09 n ASN 61 Cb 0.88 -1.13 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 1b09 n ASN 61 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1b09 h GLU 62 N 5.16 -0.36 -4.11 3.52 4.57 -1.39 -1.98 114.58 119.99 1b09 h GLU 62 Ca 0.20 0.02 -0.52 0.00 -1.18 0.00 0.00 59.36 57.89 1b09 h GLU 62 Cb 0.63 0.08 -0.37 0.00 -0.16 0.00 0.00 28.75 28.93 1b09 h GLU 62 CO 1.22 -0.05 -0.79 0.96 -1.18 0.00 0.00 179.01 179.16 1b09 s ILE 63 N -3.47 0.93 -0.14 2.32 -5.25 -1.03 -0.21 121.20 114.35 1b09 s ILE 63 Ca -0.11 -0.30 -0.02 0.00 -0.99 0.00 0.00 60.65 59.24 1b09 s ILE 63 Cb 0.01 -1.01 0.04 0.00 2.95 0.00 0.00 42.46 44.45 1b09 s ILE 63 CO 0.38 0.29 -0.00 -0.22 -1.79 0.00 0.00 174.94 173.60 1b09 s LEU 64 N 1.74 1.04 -0.25 0.37 2.96 -0.20 -0.53 118.68 123.80 1b09 s LEU 64 Ca 0.04 -0.48 -0.15 0.00 -0.22 0.00 0.00 54.13 53.31 1b09 s LEU 64 Cb -0.13 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 45.91 1b09 s LEU 64 CO -0.08 -0.23 0.39 -0.63 -1.32 0.00 0.00 176.35 174.49 1b09 s ILE 65 N 1.85 5.17 -0.01 6.68 1.01 -0.69 -2.20 121.20 133.01 1b09 s ILE 65 Ca 0.02 0.64 0.02 0.00 0.00 0.00 0.00 60.65 61.33 1b09 s ILE 65 Cb -0.15 -3.72 -0.00 0.00 0.01 0.00 0.00 42.46 38.60 1b09 s ILE 65 CO -0.07 0.17 -0.08 0.12 0.00 0.00 0.00 174.94 175.08 1b09 s PHE 66 N 1.90 0.75 -0.27 3.97 5.36 -0.42 -1.60 117.98 127.67 1b09 s PHE 66 Ca 0.17 -0.15 -0.11 0.00 -0.96 0.00 0.00 56.93 55.88 1b09 s PHE 66 Cb -0.15 -0.50 -0.05 0.00 -0.34 0.00 0.00 43.02 41.97 1b09 s PHE 66 CO 0.09 -0.03 0.18 -0.46 -1.46 0.00 0.00 175.22 173.54 1b09 s TRP 67 N -0.10 3.24 -0.17 10.12 -0.11 -0.59 0.19 118.94 131.52 1b09 s TRP 67 Ca 0.02 0.13 -0.05 0.00 1.22 0.00 0.00 56.10 57.42 1b09 s TRP 67 Cb -0.04 -2.34 -0.03 0.00 -1.50 0.00 0.00 33.47 29.56 1b09 s TRP 67 CO -0.00 -0.10 -0.01 -1.54 -4.62 0.00 0.00 176.95 170.68 1b09 s SER 68 N 1.53 4.95 0.24 5.86 1.04 -0.09 -1.30 113.70 125.94 1b09 s SER 68 Ca 0.07 -0.11 -0.31 0.00 0.48 0.00 0.00 55.95 56.08 1b09 s SER 68 Cb -0.15 -1.83 -0.13 0.00 0.10 0.00 0.00 66.02 64.01 1b09 s SER 68 CO 0.09 0.14 1.42 1.17 0.98 0.00 0.00 173.24 177.03 1b09 n LYS 69 N 3.75 2.08 -0.12 4.02 4.81 -1.26 -2.06 118.16 129.37 1b09 n LYS 69 Ca -0.17 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 1b09 n LYS 69 Cb 0.52 -2.40 0.00 0.00 0.02 0.00 0.00 35.03 33.17 1b09 n LYS 69 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1b09 n ASP 70 N 2.13 0.00 0.00 3.14 8.00 -1.26 -4.75 116.55 123.82 1b09 n ASP 70 Ca 0.11 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.59 1b09 n ASP 70 Cb 0.32 -0.15 -0.01 0.00 -0.02 0.00 0.00 41.12 41.26 1b09 n ASP 70 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1b09 n ILE 71 N -2.00 1.20 0.00 0.53 5.41 -0.95 -4.98 119.36 118.58 1b09 n ILE 71 Ca 0.00 0.31 0.00 0.00 1.00 0.00 0.00 62.75 64.06 1b09 n ILE 71 Cb 0.00 -1.78 0.00 0.00 -0.71 0.00 0.00 39.64 37.15 1b09 n ILE 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b09 n GLY 72 N 2.83 0.17 3.78 7.39 0.00 -0.88 -0.33 105.19 118.16 1b09 n GLY 72 Ca -0.04 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.41 1b09 n GLY 72 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b09 s TYR 73 N -4.00 3.70 -0.24 1.61 2.02 -0.19 -0.91 117.35 119.35 1b09 s TYR 73 Ca 0.00 1.77 0.02 0.00 -0.37 0.00 0.00 57.07 58.48 1b09 s TYR 73 Cb 0.00 -2.91 0.06 0.00 -0.40 0.00 0.00 41.96 38.71 1b09 s TYR 73 CO 0.00 0.23 -0.10 0.45 -1.57 0.00 0.00 175.55 174.57 1b09 s SER 74 N -1.60 4.03 -0.34 2.29 0.15 0.50 -0.11 113.70 118.62 1b09 s SER 74 Ca 0.49 -1.21 -0.10 0.00 0.70 0.00 0.00 55.95 55.83 1b09 s SER 74 Cb -0.19 -1.38 0.01 0.00 -1.71 0.00 0.00 66.02 62.75 1b09 s SER 74 CO 0.24 -0.19 0.18 0.12 1.20 0.00 0.00 173.24 174.79 1b09 s PHE 75 N 1.25 3.21 -0.04 3.44 5.36 0.10 -1.31 117.98 129.99 1b09 s PHE 75 Ca -0.06 -0.75 0.07 0.00 -0.96 0.00 0.00 56.93 55.23 1b09 s PHE 75 Cb -0.19 -2.40 -0.02 0.00 -0.34 0.00 0.00 43.02 40.08 1b09 s PHE 75 CO -0.06 -0.55 -0.25 -0.08 -1.46 0.00 0.00 175.22 172.82 1b09 s THR 76 N 1.59 2.07 -0.02 0.12 -1.32 -0.94 -0.00 115.64 117.13 1b09 s THR 76 Ca 0.03 -1.08 0.02 0.00 -1.21 0.00 0.00 61.69 59.45 1b09 s THR 76 Cb -0.18 -1.73 0.01 0.00 -1.51 0.00 0.00 72.50 69.09 1b09 s THR 76 CO 0.07 0.58 -0.07 0.54 -2.21 0.00 0.00 174.62 173.52 1b09 s VAL 77 N -0.38 0.65 -1.00 5.08 0.11 -0.61 -1.04 120.40 123.21 1b09 s VAL 77 Ca 0.03 -0.28 0.00 0.00 -2.93 0.00 0.00 61.98 58.80 1b09 s VAL 77 Cb -0.12 -0.59 0.00 0.00 -1.53 0.00 0.00 36.38 34.14 1b09 s VAL 77 CO 0.01 0.21 0.00 0.61 -3.33 0.00 0.00 175.10 172.61 1b09 n GLY 78 N 3.38 0.88 2.66 6.54 0.00 0.70 -2.54 105.19 116.81 1b09 n GLY 78 Ca -0.19 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1b09 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b09 n GLY 79 N -1.60 0.94 3.78 -0.02 0.00 -0.75 -5.01 105.19 102.53 1b09 n GLY 79 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1b09 n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b09 s SER 80 N -2.99 6.30 -0.13 1.61 0.01 -1.05 -5.09 113.70 112.36 1b09 s SER 80 Ca 0.00 0.35 -0.04 0.00 1.31 0.00 0.00 55.95 57.57 1b09 s SER 80 Cb 0.00 -2.10 -0.03 0.00 0.21 0.00 0.00 66.02 64.10 1b09 s SER 80 CO 0.00 0.24 0.01 -0.70 0.41 0.00 0.00 173.24 173.21 1b09 s GLU 81 N -0.08 3.44 0.05 12.44 2.12 -1.26 -1.58 118.70 133.83 1b09 s GLU 81 Ca 0.11 -0.41 0.07 0.00 0.36 0.00 0.00 54.97 55.11 1b09 s GLU 81 Cb -0.12 -2.95 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 1b09 s GLU 81 CO 0.01 0.48 -0.20 -1.50 -0.54 0.00 0.00 175.26 173.50 1b09 s ILE 82 N -0.25 1.65 -0.19 -3.70 1.10 0.99 -4.97 121.20 115.83 1b09 s ILE 82 Ca 0.06 -1.21 -0.01 0.00 -0.51 0.00 0.00 60.65 58.98 1b09 s ILE 82 Cb -0.12 -1.44 -0.00 0.00 0.15 0.00 0.00 42.46 41.05 1b09 s ILE 82 CO 0.02 0.18 -0.11 -0.22 -2.11 0.00 0.00 174.94 172.70 1b09 s LEU 83 N -1.21 2.61 -0.54 8.50 2.96 -1.26 0.00 118.68 129.73 1b09 s LEU 83 Ca 0.07 -0.46 -0.09 0.00 -0.22 0.00 0.00 54.13 53.43 1b09 s LEU 83 Cb -0.09 -1.63 0.14 0.00 0.50 0.00 0.00 46.19 45.11 1b09 s LEU 83 CO 0.02 0.03 0.41 -0.36 -1.32 0.00 0.00 176.35 175.12 1b09 s PHE 84 N 1.18 3.47 0.22 5.38 0.08 0.84 -5.00 117.98 124.15 1b09 s PHE 84 Ca 0.02 -2.05 -0.30 0.00 0.12 0.00 0.00 56.93 54.72 1b09 s PHE 84 Cb -0.14 -3.48 -0.09 0.00 -0.57 0.00 0.00 43.02 38.73 1b09 s PHE 84 CO -0.04 -0.97 1.26 -1.21 -0.10 0.00 0.00 175.22 174.16 1b09 s GLU 85 N 0.97 4.43 -0.13 0.44 2.02 -1.26 -1.02 118.70 124.15 1b09 s GLU 85 Ca 0.09 2.01 -0.00 0.00 0.02 0.00 0.00 54.97 57.09 1b09 s GLU 85 Cb -0.23 -3.19 0.02 0.00 0.10 0.00 0.00 34.13 30.83 1b09 s GLU 85 CO -0.02 -0.16 -0.11 0.08 0.02 0.00 0.00 175.26 175.07 1b09 s VAL 86 N -0.21 1.28 -0.09 2.63 1.01 0.55 -4.91 120.40 120.66 1b09 s VAL 86 Ca 0.54 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 1b09 s VAL 86 Cb -0.36 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 1b09 s VAL 86 CO 0.40 0.41 0.07 1.55 0.00 0.00 0.00 175.10 177.53 1b09 h PRO 87 N 8.11 -0.05 -6.47 2.72 0.13 -1.96 -3.41 132.00 131.06 1b09 h PRO 87 Ca -0.34 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.27 1b09 h PRO 87 Cb 1.13 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 1b09 h PRO 87 CO 0.46 -0.04 0.30 -2.00 -0.23 0.00 0.00 178.00 176.49 1b09 s GLU 88 N -1.73 4.63 -0.04 0.86 2.12 -1.26 -5.06 118.70 118.21 1b09 s GLU 88 Ca -0.01 1.33 0.06 0.00 0.36 0.00 0.00 54.97 56.71 1b09 s GLU 88 Cb 0.00 -3.38 -0.01 0.00 0.26 0.00 0.00 34.13 31.00 1b09 s GLU 88 CO 0.02 0.22 -0.23 0.54 -0.54 0.00 0.00 175.26 175.28 1b09 s VAL 89 N 0.03 1.86 0.03 3.70 0.11 -1.26 -5.13 120.40 119.74 1b09 s VAL 89 Ca 0.44 -0.98 0.03 0.00 -2.93 0.00 0.00 61.98 58.55 1b09 s VAL 89 Cb -0.22 -1.57 -0.02 0.00 -1.53 0.00 0.00 36.38 33.04 1b09 s VAL 89 CO 0.28 0.52 -0.09 0.28 -3.33 0.00 0.00 175.10 172.75 1b09 s THR 90 N -0.25 0.71 -0.46 5.04 -1.32 -1.26 -5.09 115.64 113.01 1b09 s THR 90 Ca 0.01 -0.90 -0.28 0.00 -1.21 0.00 0.00 61.69 59.30 1b09 s THR 90 Cb -0.12 -0.70 0.03 0.00 -1.51 0.00 0.00 72.50 70.20 1b09 s THR 90 CO 0.02 -0.16 1.09 0.54 -2.21 0.00 0.00 174.62 173.89 1b09 s VAL 91 N -0.97 4.29 0.13 5.08 0.11 -1.26 -4.93 120.40 122.85 1b09 s VAL 91 Ca -0.04 1.17 -0.25 0.00 -2.93 0.00 0.00 61.98 59.93 1b09 s VAL 91 Cb -0.08 -4.55 0.07 0.00 -1.53 0.00 0.00 36.38 30.29 1b09 s VAL 91 CO 0.01 -0.92 0.89 0.00 -3.33 0.00 0.00 175.10 171.74 1b09 s ALA 92 N 4.23 -1.64 0.32 1.54 0.00 -1.26 -5.12 121.76 119.82 1b09 s ALA 92 Ca 0.45 0.32 -0.28 0.00 0.00 0.00 0.00 51.96 52.45 1b09 s ALA 92 Cb -0.08 0.63 -0.09 0.00 0.00 0.00 0.00 23.12 23.57 1b09 s ALA 92 CO 0.29 -0.94 1.10 -2.14 0.00 0.00 0.00 175.76 174.07 1b09 s PRO 93 N -3.35 4.47 -0.02 0.00 0.02 -1.26 -4.66 135.00 130.20 1b09 s PRO 93 Ca 0.10 1.75 0.04 0.00 0.02 0.00 0.00 61.00 62.90 1b09 s PRO 93 Cb -0.02 -2.99 -0.01 0.00 0.02 0.00 0.00 34.50 31.50 1b09 s PRO 93 CO -0.01 0.07 -0.12 0.14 -0.33 0.00 0.00 177.00 176.75 1b09 s VAL 94 N -1.30 1.01 -0.14 3.83 -7.23 -0.44 -5.00 120.40 111.14 1b09 s VAL 94 Ca 0.49 -0.53 -0.04 0.00 -1.81 0.00 0.00 61.98 60.09 1b09 s VAL 94 Cb -0.30 -0.85 -0.03 0.00 0.56 0.00 0.00 36.38 35.75 1b09 s VAL 94 CO 0.38 0.29 0.00 -2.28 -0.31 0.00 0.00 175.10 173.18 1b09 s HIS 95 N -0.16 3.13 0.05 2.82 2.46 -1.26 -2.02 115.29 120.30 1b09 s HIS 95 Ca 0.02 -0.03 0.03 0.00 0.47 0.00 0.00 55.06 55.55 1b09 s HIS 95 Cb -0.06 -1.93 -0.02 0.00 -0.13 0.00 0.00 32.58 30.44 1b09 s HIS 95 CO -0.00 0.19 -0.10 0.96 -2.47 0.00 0.00 174.74 173.32 1b09 s ILE 96 N -0.08 0.70 0.15 0.89 -4.36 -1.03 0.29 121.20 117.76 1b09 s ILE 96 Ca 0.04 -1.07 0.11 0.00 -0.26 0.00 0.00 60.65 59.46 1b09 s ILE 96 Cb -0.13 -0.73 -0.04 0.00 1.25 0.00 0.00 42.46 42.82 1b09 s ILE 96 CO 0.02 -0.29 -0.24 0.00 0.24 0.00 0.00 174.94 174.67 1b09 s THR 98 N -1.30 -0.02 0.25 0.00 -1.32 -0.23 -0.66 115.64 112.37 1b09 s THR 98 Ca 0.17 0.06 0.11 0.00 -1.21 0.00 0.00 61.69 60.82 1b09 s THR 98 Cb -0.09 -0.47 -0.05 0.00 -1.51 0.00 0.00 72.50 70.37 1b09 s THR 98 CO 0.08 0.03 -0.19 -0.44 -2.21 0.00 0.00 174.62 171.88 1b09 s SER 99 N 0.77 3.33 -0.05 8.08 0.01 -0.84 -1.60 113.70 123.40 1b09 s SER 99 Ca -0.05 -0.99 -0.11 0.00 1.31 0.00 0.00 55.95 56.11 1b09 s SER 99 Cb -0.06 -0.26 0.02 0.00 0.21 0.00 0.00 66.02 65.93 1b09 s SER 99 CO -0.05 0.01 0.25 0.86 0.41 0.00 0.00 173.24 174.72 1b09 s TRP 100 N -2.44 -0.18 -0.05 2.43 -0.00 -0.86 -2.31 118.94 115.53 1b09 s TRP 100 Ca 0.26 0.37 -0.01 0.00 -0.00 0.00 0.00 56.10 56.73 1b09 s TRP 100 Cb -0.05 0.06 0.03 0.00 -0.00 0.00 0.00 33.47 33.52 1b09 s TRP 100 CO 0.12 -0.26 0.01 -2.00 -0.00 0.00 0.00 176.95 174.83 1b09 s GLU 101 N -0.69 0.36 0.36 5.86 2.12 -1.18 -1.48 118.70 124.04 1b09 s GLU 101 Ca -0.08 0.16 0.06 0.00 0.36 0.00 0.00 54.97 55.48 1b09 s GLU 101 Cb -0.04 -0.71 0.68 0.00 0.26 0.00 0.00 34.13 34.31 1b09 s GLU 101 CO 0.02 -0.25 1.89 1.03 -0.54 0.00 0.00 175.26 177.41 1b09 h SER 102 N 8.01 0.38 -0.35 -1.70 0.87 -1.11 0.38 113.55 120.04 1b09 h SER 102 Ca -0.25 -0.07 -0.14 0.00 -1.23 0.00 0.00 61.79 60.11 1b09 h SER 102 Cb 1.13 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 1b09 h SER 102 CO 0.30 0.49 -0.31 0.00 -0.53 0.00 0.00 176.83 176.77 1b09 h ALA 103 N 1.56 0.50 0.00 6.23 0.00 -1.91 0.50 119.26 126.14 1b09 h ALA 103 Ca 0.08 -0.42 -0.18 0.00 0.00 0.00 0.00 54.91 54.40 1b09 h ALA 103 Cb 0.34 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1b09 h ALA 103 CO 0.01 0.55 -1.96 -1.13 0.00 0.00 0.00 179.25 176.72 1b09 n SER 104 N -4.18 1.14 0.00 0.00 3.41 -1.20 -4.74 113.62 108.05 1b09 n SER 104 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1b09 n SER 104 Cb 0.50 1.22 0.00 0.00 -0.26 0.00 0.00 64.21 65.67 1b09 n SER 104 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b09 n GLY 105 N 1.85 0.72 3.69 5.00 0.00 0.13 -4.83 105.19 111.75 1b09 n GLY 105 Ca -0.17 -0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 1b09 n GLY 105 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b09 s ILE 106 N -2.00 5.09 -0.09 -0.61 1.01 -1.24 0.84 121.20 124.21 1b09 s ILE 106 Ca 0.00 1.15 -0.01 0.00 0.00 0.00 0.00 60.65 61.78 1b09 s ILE 106 Cb 0.00 -3.91 -0.03 0.00 0.01 0.00 0.00 42.46 38.52 1b09 s ILE 106 CO 0.00 0.22 -0.02 0.68 0.00 0.00 0.00 174.94 175.82 1b09 s VAL 107 N 1.20 4.11 0.11 2.92 -7.23 0.37 -3.08 120.40 118.80 1b09 s VAL 107 Ca 0.29 -0.32 0.04 0.00 -1.81 0.00 0.00 61.98 60.18 1b09 s VAL 107 Cb -0.16 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.02 1b09 s VAL 107 CO 0.12 0.59 0.11 -1.61 -0.31 0.00 0.00 175.10 174.00 1b09 s GLU 108 N -0.76 2.91 -0.18 4.82 2.02 -0.98 -2.53 118.70 124.00 1b09 s GLU 108 Ca 0.12 -0.75 -0.04 0.00 0.02 0.00 0.00 54.97 54.31 1b09 s GLU 108 Cb -0.11 -2.71 0.06 0.00 0.10 0.00 0.00 34.13 31.47 1b09 s GLU 108 CO 0.02 0.54 0.08 0.12 0.02 0.00 0.00 175.26 176.03 1b09 s PHE 109 N -1.53 0.43 -0.22 1.61 2.19 -1.26 -1.98 117.98 117.22 1b09 s PHE 109 Ca 0.30 -0.49 -0.08 0.00 0.33 0.00 0.00 56.93 56.98 1b09 s PHE 109 Cb -0.11 -0.80 -0.04 0.00 -1.31 0.00 0.00 43.02 40.76 1b09 s PHE 109 CO 0.23 -0.55 0.10 -1.58 1.83 0.00 0.00 175.22 175.24 1b09 s TRP 110 N 2.06 3.22 -0.15 10.12 0.52 0.17 -1.06 118.94 133.82 1b09 s TRP 110 Ca 0.02 -0.01 -0.02 0.00 0.02 0.00 0.00 56.10 56.11 1b09 s TRP 110 Cb -0.16 -2.19 -0.02 0.00 -1.15 0.00 0.00 33.47 29.95 1b09 s TRP 110 CO -0.10 -0.02 -0.09 0.08 0.02 0.00 0.00 176.95 176.84 1b09 s VAL 111 N 0.95 3.34 -1.71 4.03 1.01 0.30 -1.67 120.40 126.65 1b09 s VAL 111 Ca 0.05 -0.55 -0.12 0.00 0.00 0.00 0.00 61.98 61.37 1b09 s VAL 111 Cb -0.14 -2.44 0.12 0.00 0.00 0.00 0.00 36.38 33.92 1b09 s VAL 111 CO 0.03 0.50 0.31 0.47 0.00 0.00 0.00 175.10 176.41 1b09 n ASP 112 N 3.73 -0.49 0.00 3.32 8.00 0.14 -0.52 116.55 130.74 1b09 n ASP 112 Ca -0.18 -1.25 0.00 0.00 0.71 0.00 0.00 54.79 54.07 1b09 n ASP 112 Cb 0.52 -1.67 0.00 0.00 -0.02 0.00 0.00 41.12 39.96 1b09 n ASP 112 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b09 n GLY 113 N -1.83 2.96 3.84 0.44 0.00 -1.26 -5.02 105.19 104.31 1b09 n GLY 113 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 1b09 n GLY 113 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b09 s LYS 114 N -0.58 3.21 -0.02 1.61 1.02 0.32 -4.95 119.74 120.35 1b09 s LYS 114 Ca 0.00 -0.44 -0.06 0.00 0.02 0.00 0.00 55.97 55.49 1b09 s LYS 114 Cb 0.00 -2.95 -0.04 0.00 -0.52 0.00 0.00 37.83 34.32 1b09 s LYS 114 CO 0.00 0.65 0.23 -1.25 -0.92 0.00 0.00 175.35 174.06 1b09 s PRO 115 N -1.93 3.53 0.32 -1.68 0.04 -1.26 -0.54 135.00 133.48 1b09 s PRO 115 Ca 0.26 -0.12 -0.06 0.00 0.04 0.00 0.00 61.00 61.12 1b09 s PRO 115 Cb -0.12 -3.11 -0.05 0.00 0.04 0.00 0.00 34.50 31.26 1b09 s PRO 115 CO 0.17 0.68 0.60 1.03 0.04 0.00 0.00 177.00 179.52 1b09 s ARG 116 N -1.64 3.65 0.42 4.56 1.81 -0.22 -4.97 118.95 122.56 1b09 s ARG 116 Ca 0.25 0.09 -0.21 0.00 -1.72 0.00 0.00 55.73 54.14 1b09 s ARG 116 Cb -0.13 -2.59 -0.14 0.00 -0.45 0.00 0.00 34.95 31.63 1b09 s ARG 116 CO 0.14 0.15 0.22 0.28 -0.68 0.00 0.00 175.30 175.42 1b09 n VAL 117 N -1.07 1.00 -2.79 3.52 0.31 -1.26 -4.42 118.33 113.62 1b09 n VAL 117 Ca -0.01 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.45 1b09 n VAL 117 Cb 0.54 -0.18 -0.06 0.00 -0.91 0.00 0.00 33.84 33.23 1b09 n VAL 117 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1b09 s ARG 118 N -1.21 4.56 0.24 5.55 0.52 -1.26 -4.69 118.95 122.65 1b09 s ARG 118 Ca 0.61 1.30 0.03 0.00 -0.52 0.00 0.00 55.73 57.15 1b09 s ARG 118 Cb -0.61 -2.77 -0.05 0.00 0.52 0.00 0.00 34.95 32.03 1b09 s ARG 118 CO 0.61 0.27 0.02 0.15 0.02 0.00 0.00 175.30 176.37 1b09 s LYS 119 N -2.11 1.36 -0.13 3.54 1.02 -1.05 -4.96 119.74 117.41 1b09 s LYS 119 Ca 0.51 -1.70 -0.06 0.00 0.02 0.00 0.00 55.97 54.74 1b09 s LYS 119 Cb -0.18 -0.55 -0.04 0.00 -0.52 0.00 0.00 37.83 36.54 1b09 s LYS 119 CO 0.23 -0.14 0.09 0.45 -0.92 0.00 0.00 175.35 175.06 1b09 s SER 120 N -3.31 5.94 -0.29 2.83 0.15 -1.26 -0.48 113.70 117.28 1b09 s SER 120 Ca 0.30 0.29 -0.15 0.00 0.70 0.00 0.00 55.95 57.09 1b09 s SER 120 Cb 0.06 -1.90 0.13 0.00 -1.71 0.00 0.00 66.02 62.60 1b09 s SER 120 CO 0.10 0.33 0.86 -0.22 1.20 0.00 0.00 173.24 175.51 1b09 s LEU 121 N -0.57 -0.72 -1.44 3.45 2.96 0.25 -4.97 118.68 117.65 1b09 s LEU 121 Ca 0.11 1.08 -0.09 0.00 -0.22 0.00 0.00 54.13 55.01 1b09 s LEU 121 Cb -0.12 1.95 0.03 0.00 0.50 0.00 0.00 46.19 48.55 1b09 s LEU 121 CO 0.02 -0.16 1.01 0.29 -1.32 0.00 0.00 176.35 176.19 1b09 n LYS 122 N 4.42 -6.69 -1.70 1.98 4.76 -1.26 -4.62 118.16 115.05 1b09 n LYS 122 Ca -0.16 0.78 -0.44 0.00 -2.87 0.00 0.00 58.31 55.63 1b09 n LYS 122 Cb 0.55 -5.75 -0.02 0.00 -1.84 0.00 0.00 35.03 27.97 1b09 n LYS 122 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1b09 n LYS 123 N -4.71 2.34 0.00 1.97 4.81 -1.26 -2.27 118.16 119.04 1b09 n LYS 123 Ca -0.01 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 1b09 n LYS 123 Cb 0.56 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.05 1b09 n LYS 123 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1b09 n GLY 124 N 2.47 1.95 3.76 3.14 0.00 0.17 -5.02 105.19 111.67 1b09 n GLY 124 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1b09 n GLY 124 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b09 s TYR 125 N -2.35 2.53 -0.04 1.61 5.04 -0.96 -5.05 117.35 118.12 1b09 s TYR 125 Ca 0.00 1.56 0.06 0.00 -2.44 0.00 0.00 57.07 56.25 1b09 s TYR 125 Cb 0.00 -3.25 -0.01 0.00 0.35 0.00 0.00 41.96 39.05 1b09 s TYR 125 CO 0.00 -1.83 -0.22 -0.08 -1.34 0.00 0.00 175.55 172.08 1b09 s THR 126 N -2.16 1.81 0.11 4.34 -1.32 -1.26 -4.71 115.64 112.44 1b09 s THR 126 Ca 0.69 -0.95 -0.14 0.00 -1.21 0.00 0.00 61.69 60.08 1b09 s THR 126 Cb -0.23 -1.52 -0.07 0.00 -1.51 0.00 0.00 72.50 69.17 1b09 s THR 126 CO 0.39 0.51 0.52 -0.69 -2.21 0.00 0.00 174.62 173.14 1b09 s VAL 127 N -0.24 4.89 0.80 5.08 1.01 0.53 -4.92 120.40 127.55 1b09 s VAL 127 Ca 0.01 0.83 -0.11 0.00 0.00 0.00 0.00 61.98 62.71 1b09 s VAL 127 Cb -0.11 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.60 1b09 s VAL 127 CO 0.02 0.33 1.11 -0.83 0.00 0.00 0.00 175.10 175.73 1b09 s GLY 128 N -1.56 1.72 -0.18 4.51 0.00 -1.26 -0.58 107.32 109.97 1b09 s GLY 128 Ca 0.34 0.38 0.02 0.00 0.00 0.00 0.00 44.72 45.47 1b09 s GLY 128 CO 0.18 0.75 -0.15 0.00 0.00 0.00 0.00 173.10 173.88 1b09 n ALA 129 N -3.62 1.61 -2.74 3.20 0.00 -1.26 -4.48 120.51 113.22 1b09 n ALA 129 Ca 0.10 -0.79 -0.43 0.00 0.00 0.00 0.00 53.44 52.32 1b09 n ALA 129 Cb 0.53 0.07 -0.04 0.00 0.00 0.00 0.00 19.45 20.00 1b09 n ALA 129 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1b09 s GLU 130 N -2.36 3.23 0.11 0.00 -1.05 -1.26 -4.70 118.70 112.66 1b09 s GLU 130 Ca -0.23 -0.53 -0.15 0.00 -0.15 0.00 0.00 54.97 53.91 1b09 s GLU 130 Cb 0.06 -4.12 0.03 0.00 -0.44 0.00 0.00 34.13 29.66 1b09 s GLU 130 CO 0.43 -1.58 0.36 0.00 0.95 0.00 0.00 175.26 175.42 1b09 s ALA 131 N 3.86 -0.79 -0.25 -0.84 0.00 -1.26 -4.47 121.76 118.01 1b09 s ALA 131 Ca 0.26 -0.14 -0.11 0.00 0.00 0.00 0.00 51.96 51.97 1b09 s ALA 131 Cb -0.15 0.62 -0.05 0.00 0.00 0.00 0.00 23.12 23.54 1b09 s ALA 131 CO 0.15 -0.60 0.19 0.45 0.00 0.00 0.00 175.76 175.96 1b09 s SER 132 N -2.73 6.12 -0.29 0.00 0.15 0.22 -4.89 113.70 112.28 1b09 s SER 132 Ca 0.02 0.11 -0.07 0.00 0.70 0.00 0.00 55.95 56.72 1b09 s SER 132 Cb 0.02 -2.12 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 1b09 s SER 132 CO -0.11 0.02 0.08 -0.63 1.20 0.00 0.00 173.24 173.79 1b09 s ILE 133 N 1.29 4.00 -0.06 6.45 1.01 -1.26 -0.60 121.20 132.01 1b09 s ILE 133 Ca 0.08 -0.62 0.03 0.00 0.00 0.00 0.00 60.65 60.15 1b09 s ILE 133 Cb -0.14 -3.03 0.00 0.00 0.01 0.00 0.00 42.46 39.30 1b09 s ILE 133 CO 0.07 0.12 -0.17 -0.63 0.00 0.00 0.00 174.94 174.33 1b09 s ILE 134 N 1.51 1.47 -0.33 2.92 1.01 -0.56 -1.47 121.20 125.76 1b09 s ILE 134 Ca 0.03 -0.70 -0.13 0.00 0.00 0.00 0.00 60.65 59.85 1b09 s ILE 134 Cb -0.17 -1.29 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 1b09 s ILE 134 CO 0.02 0.43 0.28 -0.76 0.00 0.00 0.00 174.94 174.91 1b09 s LEU 135 N 0.34 4.38 0.00 2.97 1.02 -0.72 -2.65 118.68 124.02 1b09 s LEU 135 Ca -0.11 -0.24 0.00 0.00 0.02 0.00 0.00 54.13 53.80 1b09 s LEU 135 Cb -0.15 -2.22 0.00 0.00 0.02 0.00 0.00 46.19 43.84 1b09 s LEU 135 CO 0.04 -0.23 0.00 0.61 0.02 0.00 0.00 176.35 176.79 1b09 n GLY 136 N 5.02 0.57 3.55 -3.19 0.00 -1.26 -2.20 105.19 107.68 1b09 n GLY 136 Ca -0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 1b09 n GLY 136 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b09 s GLN 137 N 0.00 1.83 -0.11 1.61 -1.52 -1.26 -1.94 119.66 118.28 1b09 s GLN 137 Ca 0.00 -2.02 -0.04 0.00 -1.95 0.00 0.00 55.36 51.35 1b09 s GLN 137 Cb 0.00 -1.38 -0.04 0.00 -0.22 0.00 0.00 33.01 31.37 1b09 s GLN 137 CO 0.00 -0.07 0.05 -2.00 -0.25 0.00 0.00 175.29 173.02 1b09 s GLU 138 N -3.76 3.22 -0.03 2.91 -6.30 -1.26 -4.67 118.70 108.80 1b09 s GLU 138 Ca 0.35 -0.31 -0.07 0.00 -2.50 0.00 0.00 54.97 52.44 1b09 s GLU 138 Cb 0.09 -2.96 -0.05 0.00 0.00 0.00 0.00 34.13 31.21 1b09 s GLU 138 CO 0.17 0.69 0.24 -0.65 0.02 0.00 0.00 175.26 175.73 1b09 s GLN 139 N -0.82 3.56 0.00 4.30 -0.21 -1.26 -4.10 119.66 121.13 1b09 s GLN 139 Ca 0.13 -0.06 0.00 0.00 0.02 0.00 0.00 55.36 55.45 1b09 s GLN 139 Cb -0.12 -3.13 0.00 0.00 1.00 0.00 0.00 33.01 30.76 1b09 s GLN 139 CO 0.03 0.70 0.08 -0.25 -2.12 0.00 0.00 175.29 173.72 1b09 n ASP 140 N 1.45 0.16 -3.87 5.90 9.92 -1.11 -4.74 116.55 124.26 1b09 n ASP 140 Ca -0.14 -0.49 -0.11 0.00 -0.53 0.00 0.00 54.79 53.51 1b09 n ASP 140 Cb 0.53 0.49 -0.10 0.00 -0.64 0.00 0.00 41.12 41.41 1b09 n ASP 140 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1b09 s SER 141 N -0.49 0.02 -0.94 -2.24 1.04 -0.73 -4.83 113.70 105.54 1b09 s SER 141 Ca 0.00 -0.18 -0.14 0.00 0.48 0.00 0.00 55.95 56.11 1b09 s SER 141 Cb 0.00 0.21 -0.29 0.00 0.10 0.00 0.00 66.02 66.04 1b09 s SER 141 CO 0.00 -0.34 2.15 0.33 0.98 0.00 0.00 173.24 176.36 1b09 n PHE 142 N 1.59 0.14 -0.38 5.02 7.35 -1.26 0.15 117.46 130.08 1b09 n PHE 142 Ca -0.22 0.10 0.00 0.00 -0.76 0.00 0.00 57.45 56.57 1b09 n PHE 142 Cb 0.56 -0.94 0.00 0.00 0.35 0.00 0.00 39.48 39.45 1b09 n PHE 142 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1b09 n GLY 143 N 5.40 1.04 2.02 7.13 0.00 -1.26 -5.00 105.19 114.51 1b09 n GLY 143 Ca 0.63 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.56 1b09 n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b09 n GLY 144 N -2.00 2.73 2.53 -0.02 0.00 0.41 -5.02 105.19 103.82 1b09 n GLY 144 Ca 0.00 -1.59 -0.00 0.00 0.00 0.00 0.00 46.02 44.43 1b09 n GLY 144 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1b09 n ASN 145 N -1.92 -5.81 -4.69 1.61 4.13 -1.26 -1.77 115.26 105.55 1b09 n ASN 145 Ca 0.01 -0.05 -0.38 0.00 1.68 0.00 0.00 54.58 55.85 1b09 n ASN 145 Cb 0.36 -3.83 -0.07 0.00 -1.54 0.00 0.00 39.78 34.69 1b09 n ASN 145 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1b09 s PHE 146 N -3.00 3.42 -0.15 3.10 0.08 -1.26 -3.16 117.98 117.01 1b09 s PHE 146 Ca 0.00 0.67 -0.10 0.00 0.12 0.00 0.00 56.93 57.63 1b09 s PHE 146 Cb -0.00 -2.50 -0.05 0.00 -0.57 0.00 0.00 43.02 39.91 1b09 s PHE 146 CO 0.49 0.08 0.18 -1.21 -0.10 0.00 0.00 175.22 174.66 1b09 s GLU 147 N 0.99 3.95 0.39 0.44 2.02 -1.26 -4.96 118.70 120.26 1b09 s GLU 147 Ca 0.20 -0.09 0.14 0.00 0.02 0.00 0.00 54.97 55.24 1b09 s GLU 147 Cb -0.14 -3.34 0.78 0.00 0.10 0.00 0.00 34.13 31.54 1b09 s GLU 147 CO 0.08 0.47 1.85 0.78 0.02 0.00 0.00 175.26 178.45 1b09 h GLY 148 N 6.01 0.00 1.16 -1.39 0.00 -1.93 -2.46 103.07 104.46 1b09 h GLY 148 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1b09 h GLY 148 CO 0.69 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 176.09 1b09 n SER 149 N -4.06 0.00 -0.19 0.19 3.41 -1.26 -1.17 113.62 110.53 1b09 n SER 149 Ca -0.02 -0.30 0.02 0.00 -0.26 0.00 0.00 58.87 58.31 1b09 n SER 149 Cb 0.39 -0.08 0.04 0.00 -0.26 0.00 0.00 64.21 64.29 1b09 n SER 149 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b09 n GLN 150 N -1.08 1.67 -1.31 4.33 6.02 -0.93 -4.66 117.38 121.41 1b09 n GLN 150 Ca 0.10 -1.32 -0.30 0.00 -0.01 0.00 0.00 57.00 55.46 1b09 n GLN 150 Cb 0.07 -1.08 0.10 0.00 1.02 0.00 0.00 30.24 30.35 1b09 n GLN 150 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1b09 s SER 151 N -0.74 4.23 -0.20 1.08 1.04 -0.32 -1.03 113.70 117.76 1b09 s SER 151 Ca 0.07 1.61 -0.05 0.00 0.48 0.00 0.00 55.95 58.05 1b09 s SER 151 Cb 0.04 -2.32 -0.03 0.00 0.10 0.00 0.00 66.02 63.81 1b09 s SER 151 CO 0.05 -2.18 0.01 -0.22 0.98 0.00 0.00 173.24 171.88 1b09 s LEU 152 N -5.97 3.35 -0.18 2.42 2.96 -0.82 -4.54 118.68 115.91 1b09 s LEU 152 Ca 0.62 -0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 54.34 1b09 s LEU 152 Cb -0.17 -1.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 1b09 s LEU 152 CO 0.56 0.08 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.93 1b09 s VAL 153 N 0.88 3.50 -4.14 1.68 1.01 -1.26 -4.78 120.40 117.30 1b09 s VAL 153 Ca 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1b09 s VAL 153 Cb -0.14 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.69 1b09 s VAL 153 CO 0.02 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.20 1b09 n GLY 154 N 4.07 0.76 3.67 4.51 0.00 -0.43 -4.51 105.19 113.26 1b09 n GLY 154 Ca -0.18 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.76 1b09 n GLY 154 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b09 s ASP 155 N -4.00 4.89 0.01 1.61 1.11 -0.90 -0.61 116.67 118.78 1b09 s ASP 155 Ca 0.00 -0.25 0.00 0.00 0.18 0.00 0.00 52.55 52.48 1b09 s ASP 155 Cb 0.00 -1.11 -0.01 0.00 1.07 0.00 0.00 42.92 42.87 1b09 s ASP 155 CO 0.00 0.15 -0.01 -0.51 1.18 0.00 0.00 175.17 175.98 1b09 s ILE 156 N -1.39 0.06 0.28 0.77 2.07 -0.20 -1.94 121.20 120.84 1b09 s ILE 156 Ca 0.26 -0.35 -0.09 0.00 -1.41 0.00 0.00 60.65 59.06 1b09 s ILE 156 Cb -0.11 -0.12 0.04 0.00 0.13 0.00 0.00 42.46 42.40 1b09 s ILE 156 CO 0.18 -0.18 0.53 0.61 -1.91 0.00 0.00 174.94 174.16 1b09 n GLY 157 N 2.52 1.47 4.27 1.50 0.00 -0.48 -1.24 105.19 113.23 1b09 n GLY 157 Ca -0.17 -1.25 -0.36 0.00 0.00 0.00 0.00 46.02 44.25 1b09 n GLY 157 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1b09 n ASN 158 N -1.45 -0.71 -4.69 1.61 4.13 -1.26 0.02 115.26 112.91 1b09 n ASN 158 Ca -0.05 -1.17 -0.41 0.00 1.68 0.00 0.00 54.58 54.63 1b09 n ASN 158 Cb 0.42 -1.48 -0.04 0.00 -1.54 0.00 0.00 39.78 37.15 1b09 n ASN 158 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1b09 s VAL 159 N -3.55 4.88 0.06 2.41 0.11 -1.25 -3.70 120.40 119.35 1b09 s VAL 159 Ca 0.48 1.77 0.04 0.00 -2.93 0.00 0.00 61.98 61.33 1b09 s VAL 159 Cb -0.28 -4.19 -0.03 0.00 -1.53 0.00 0.00 36.38 30.35 1b09 s VAL 159 CO 0.94 0.08 -0.11 0.20 -3.33 0.00 0.00 175.10 172.88 1b09 s ASN 160 N 1.06 1.25 -0.02 3.54 0.02 0.20 -3.94 114.94 117.04 1b09 s ASN 160 Ca 0.43 -0.58 0.01 0.00 -1.02 0.00 0.00 52.86 51.69 1b09 s ASN 160 Cb -0.18 -0.00 0.02 0.00 0.02 0.00 0.00 41.25 41.10 1b09 s ASN 160 CO 0.17 -0.14 -0.02 -0.32 0.02 0.00 0.00 177.10 176.81 1b09 s MET 161 N -1.66 0.38 0.32 -0.60 1.75 -0.13 -1.75 119.30 117.62 1b09 s MET 161 Ca -0.06 -0.02 0.08 0.00 -1.25 0.00 0.00 55.69 54.43 1b09 s MET 161 Cb -0.10 -0.47 -0.03 0.00 2.84 0.00 0.00 34.83 37.06 1b09 s MET 161 CO 0.01 -0.06 0.21 -1.58 -0.65 0.00 0.00 175.02 172.96 1b09 s TRP 162 N 0.64 2.87 -2.07 4.11 0.51 0.44 -0.62 118.94 124.82 1b09 s TRP 162 Ca -0.07 -0.29 0.18 0.00 -2.12 0.00 0.00 56.10 53.81 1b09 s TRP 162 Cb -0.10 -1.64 0.26 0.00 -0.81 0.00 0.00 33.47 31.18 1b09 s TRP 162 CO -0.01 0.32 1.19 -0.40 -0.51 0.00 0.00 176.95 177.54 1b09 n ASP 163 N -1.24 2.86 -2.18 2.95 5.75 -1.26 -2.27 116.55 121.15 1b09 n ASP 163 Ca -0.04 -1.84 -0.04 0.00 -0.01 0.00 0.00 54.79 52.86 1b09 n ASP 163 Cb 0.60 -0.12 -0.01 0.00 -1.03 0.00 0.00 41.12 40.56 1b09 n ASP 163 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 1b09 n PHE 164 N 1.09 0.11 -3.86 2.11 -1.74 -1.25 -4.24 117.46 109.68 1b09 n PHE 164 Ca 0.14 -0.31 -0.36 0.00 -0.56 0.00 0.00 57.45 56.36 1b09 n PHE 164 Cb 0.49 -0.03 -0.10 0.00 1.52 0.00 0.00 39.48 41.35 1b09 n PHE 164 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 1b09 s VAL 165 N -1.35 4.83 0.34 1.97 1.01 -1.26 -3.19 120.40 122.75 1b09 s VAL 165 Ca 0.01 -0.01 -0.27 0.00 0.00 0.00 0.00 61.98 61.71 1b09 s VAL 165 Cb 0.00 -3.22 -0.09 0.00 0.00 0.00 0.00 36.38 33.07 1b09 s VAL 165 CO 0.00 0.39 1.08 -0.76 0.00 0.00 0.00 175.10 175.82 1b09 s LEU 166 N 0.89 4.33 0.58 3.92 1.43 -1.26 -5.04 118.68 123.53 1b09 s LEU 166 Ca 0.05 2.18 -0.13 0.00 -1.03 0.00 0.00 54.13 55.19 1b09 s LEU 166 Cb -0.13 -3.91 -0.05 0.00 0.03 0.00 0.00 46.19 42.12 1b09 s LEU 166 CO 0.03 -0.35 1.02 -0.94 0.23 0.00 0.00 176.35 176.33 1b09 s SER 167 N -1.21 6.30 0.41 2.29 1.04 -1.26 -4.87 113.70 116.40 1b09 s SER 167 Ca 0.52 1.51 0.09 0.00 0.48 0.00 0.00 55.95 58.55 1b09 s SER 167 Cb -0.27 -2.49 0.90 0.00 0.10 0.00 0.00 66.02 64.25 1b09 s SER 167 CO 0.35 -0.82 2.03 -0.65 0.98 0.00 0.00 173.24 175.13 1b09 h PRO 168 N 0.17 0.51 -0.47 4.02 0.11 -1.99 0.35 132.00 134.70 1b09 h PRO 168 Ca -0.45 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 1b09 h PRO 168 Cb 1.19 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1b09 h PRO 168 CO 0.61 0.34 0.05 -0.44 -0.21 0.00 0.00 178.00 178.35 1b09 h ASP 169 N 0.53 0.76 -0.20 -2.05 5.19 -2.01 -2.50 116.42 116.15 1b09 h ASP 169 Ca 0.20 -0.28 0.01 0.00 -0.62 0.00 0.00 57.03 56.34 1b09 h ASP 169 Cb 0.13 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.42 1b09 h ASP 169 CO -0.05 0.85 0.10 -0.33 -3.12 0.00 0.00 179.24 176.69 1b09 h GLU 170 N 0.65 0.20 0.00 3.56 5.08 -1.51 -2.82 114.58 119.74 1b09 h GLU 170 Ca 0.14 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1b09 h GLU 170 Cb 0.43 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1b09 h GLU 170 CO 0.01 0.13 -0.06 0.82 -1.00 0.00 0.00 179.01 178.92 1b09 h ILE 171 N 0.21 1.04 -0.73 3.13 2.04 -0.99 -1.79 117.51 120.42 1b09 h ILE 171 Ca 0.08 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.68 1b09 h ILE 171 Cb 0.02 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1b09 h ILE 171 CO -0.06 0.06 0.24 -1.13 0.00 0.00 0.00 178.15 177.26 1b09 h ASN 172 N 0.00 1.06 -0.24 1.72 -0.73 -1.19 -1.72 115.58 114.47 1b09 h ASN 172 Ca -0.00 -0.20 -0.13 0.00 1.87 0.00 0.00 56.30 57.84 1b09 h ASN 172 Cb 0.11 -0.28 -0.00 0.00 0.27 0.00 0.00 38.32 38.42 1b09 h ASN 172 CO 0.01 0.98 -0.34 0.71 -0.37 0.00 0.00 177.43 178.42 1b09 h THR 173 N 1.08 1.31 -0.81 -3.57 1.35 -1.21 0.39 112.91 111.46 1b09 h THR 173 Ca 0.24 -1.54 0.22 0.00 -0.55 0.00 0.00 66.41 64.78 1b09 h THR 173 Cb 0.30 1.72 -0.04 0.00 -1.73 0.00 0.00 68.15 68.40 1b09 h THR 173 CO -0.01 0.48 0.57 0.40 -0.25 0.00 0.00 175.52 176.71 1b09 h ILE 174 N 0.37 0.64 0.12 6.82 5.03 -1.36 0.70 117.51 129.82 1b09 h ILE 174 Ca 0.03 -0.04 -0.01 0.00 -0.12 0.00 0.00 64.86 64.72 1b09 h ILE 174 Cb 0.92 0.50 0.00 0.00 -3.03 0.00 0.00 36.82 35.21 1b09 h ILE 174 CO 0.08 0.02 -0.06 0.22 -0.68 0.00 0.00 178.15 177.74 1b09 h TYR 175 N 0.13 -0.15 0.00 1.37 3.20 -0.34 -3.09 116.97 118.09 1b09 h TYR 175 Ca 0.40 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.26 1b09 h TYR 175 Cb 1.37 0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.69 1b09 h TYR 175 CO -0.00 0.32 0.00 1.28 -1.64 0.00 0.00 178.16 178.12 1b09 n LEU 176 N -4.91 0.00 0.00 2.82 7.99 0.03 -4.79 117.00 118.14 1b09 n LEU 176 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.92 1b09 n LEU 176 Cb 0.27 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.58 1b09 n LEU 176 CO 0.29 0.00 0.00 0.61 -1.51 0.00 0.00 177.39 176.78 1b09 n GLY 177 N -0.20 0.54 3.56 -0.72 0.00 -0.57 -5.06 105.19 102.74 1b09 n GLY 177 Ca 0.08 -0.59 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1b09 n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b09 s GLY 178 N -2.54 1.56 0.24 -0.02 0.00 0.23 -4.99 107.32 101.80 1b09 s GLY 178 Ca 0.00 -0.84 -0.08 0.00 0.00 0.00 0.00 44.72 43.79 1b09 s GLY 178 CO 0.00 0.02 0.54 2.56 0.00 0.00 0.00 173.10 176.22 1b09 s PRO 179 N -5.28 3.75 0.22 2.90 0.04 -1.26 -4.47 135.00 130.89 1b09 s PRO 179 Ca 0.70 0.19 -0.10 0.00 0.04 0.00 0.00 61.00 61.83 1b09 s PRO 179 Cb -0.12 -2.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.75 1b09 s PRO 179 CO 0.57 0.30 0.37 -0.59 0.04 0.00 0.00 177.00 177.69 1b09 s PHE 180 N -1.87 0.51 -0.32 0.56 -0.71 -1.26 -4.81 117.98 110.08 1b09 s PHE 180 Ca 0.46 -0.85 0.01 0.00 -1.04 0.00 0.00 56.93 55.52 1b09 s PHE 180 Cb -0.11 -0.01 0.10 0.00 -1.21 0.00 0.00 43.02 41.79 1b09 s PHE 180 CO 0.23 -0.86 0.07 -1.12 -1.34 0.00 0.00 175.22 172.21 1b09 s SER 181 N -3.03 4.35 0.68 1.98 0.01 -1.26 -5.12 113.70 111.31 1b09 s SER 181 Ca 0.24 -1.86 -0.13 0.00 1.31 0.00 0.00 55.95 55.51 1b09 s SER 181 Cb 0.02 -1.21 0.01 0.00 0.21 0.00 0.00 66.02 65.05 1b09 s SER 181 CO 0.07 -0.40 1.09 -2.84 0.41 0.00 0.00 173.24 171.57 1b09 s PRO 182 N 1.30 2.81 0.00 12.44 0.02 -1.26 -4.99 135.00 145.32 1b09 s PRO 182 Ca 0.10 1.23 0.00 0.00 0.02 0.00 0.00 61.00 62.35 1b09 s PRO 182 Cb -0.18 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.38 1b09 s PRO 182 CO -0.17 -1.22 0.23 0.27 -0.33 0.00 0.00 177.00 175.77 1b09 n ASN 183 N -2.70 0.45 0.00 2.53 2.04 -1.12 -4.81 115.26 111.65 1b09 n ASN 183 Ca 0.09 -0.77 0.00 0.00 -0.44 0.00 0.00 54.58 53.46 1b09 n ASN 183 Cb 0.53 0.24 0.00 0.00 -2.53 0.00 0.00 39.78 38.02 1b09 n ASN 183 CO 0.00 0.00 0.00 0.52 -0.44 0.00 0.00 177.26 177.34 1b09 n VAL 184 N -0.24 0.00 -3.63 3.53 0.31 0.21 -4.91 118.33 113.60 1b09 n VAL 184 Ca 0.00 0.31 -0.37 0.00 -0.01 0.00 0.00 64.34 64.27 1b09 n VAL 184 Cb 0.05 -1.29 -0.10 0.00 -0.91 0.00 0.00 33.84 31.59 1b09 n VAL 184 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1b09 s LEU 185 N -4.48 4.09 -0.20 7.52 1.02 -1.01 -4.53 118.68 121.09 1b09 s LEU 185 Ca 0.00 0.09 0.01 0.00 0.02 0.00 0.00 54.13 54.25 1b09 s LEU 185 Cb 0.00 -2.12 0.04 0.00 0.02 0.00 0.00 46.19 44.13 1b09 s LEU 185 CO 0.00 0.03 -0.14 0.21 0.02 0.00 0.00 176.35 176.47 1b09 s ASN 186 N 1.25 3.41 0.47 2.29 3.84 -1.26 -0.95 114.94 123.98 1b09 s ASN 186 Ca 0.08 -0.85 0.13 0.00 0.21 0.00 0.00 52.86 52.43 1b09 s ASN 186 Cb -0.14 -1.36 1.10 0.00 -0.55 0.00 0.00 41.25 40.30 1b09 s ASN 186 CO 0.06 -0.10 2.09 -0.25 -2.79 0.00 0.00 177.10 176.11 1b09 h TRP 187 N 7.94 0.24 -0.03 0.43 2.91 -1.93 -1.17 115.95 124.34 1b09 h TRP 187 Ca -0.33 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.69 1b09 h TRP 187 Cb 1.11 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.67 1b09 h TRP 187 CO 0.51 0.14 0.00 0.54 -1.03 0.00 0.00 178.44 178.61 1b09 n ARG 188 N -4.50 1.15 -2.88 2.65 1.74 -1.26 -1.35 116.66 112.21 1b09 n ARG 188 Ca 0.02 -0.22 -0.12 0.00 -0.77 0.00 0.00 57.85 56.75 1b09 n ARG 188 Cb 0.15 -1.35 0.04 0.00 -1.02 0.00 0.00 32.46 30.28 1b09 n ARG 188 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1b09 n ALA 189 N -0.60 0.04 -2.61 7.54 0.00 -0.48 -3.73 120.51 120.66 1b09 n ALA 189 Ca 0.16 -2.07 -0.39 0.00 0.00 0.00 0.00 53.44 51.15 1b09 n ALA 189 Cb 0.13 -1.10 -0.06 0.00 0.00 0.00 0.00 19.45 18.42 1b09 n ALA 189 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1b09 s LEU 190 N -2.02 4.35 -0.31 0.00 2.96 0.30 -4.57 118.68 119.40 1b09 s LEU 190 Ca 0.29 1.03 -0.03 0.00 -0.22 0.00 0.00 54.13 55.20 1b09 s LEU 190 Cb 0.29 -2.85 0.05 0.00 0.50 0.00 0.00 46.19 44.18 1b09 s LEU 190 CO -0.09 0.04 0.03 -0.75 -1.32 0.00 0.00 176.35 174.26 1b09 s LYS 191 N 0.22 2.46 0.19 1.98 2.36 -1.26 -1.10 119.74 124.59 1b09 s LYS 191 Ca 0.30 -1.26 -0.03 0.00 -2.55 0.00 0.00 55.97 52.43 1b09 s LYS 191 Cb -0.17 -3.25 -0.03 0.00 -1.05 0.00 0.00 37.83 33.33 1b09 s LYS 191 CO 0.15 -0.64 0.17 1.52 1.55 0.00 0.00 175.35 178.10 1b09 s TYR 192 N 1.28 0.91 -0.11 4.03 1.13 -1.26 -1.02 117.35 122.31 1b09 s TYR 192 Ca -0.04 -1.20 -0.00 0.00 -1.41 0.00 0.00 57.07 54.42 1b09 s TYR 192 Cb -0.20 -0.39 0.02 0.00 -1.10 0.00 0.00 41.96 40.29 1b09 s TYR 192 CO -0.00 -0.67 -0.09 -2.00 -2.51 0.00 0.00 175.55 170.29 1b09 s GLU 193 N -4.10 1.59 -0.01 -3.49 2.12 0.32 -4.95 118.70 110.19 1b09 s GLU 193 Ca 0.31 -0.29 -0.03 0.00 0.36 0.00 0.00 54.97 55.32 1b09 s GLU 193 Cb 0.06 -1.59 -0.04 0.00 0.26 0.00 0.00 34.13 32.82 1b09 s GLU 193 CO 0.08 -0.22 0.18 0.08 -0.54 0.00 0.00 175.26 174.84 1b09 s VAL 194 N 1.55 5.42 -0.29 3.70 1.01 -1.26 0.15 120.40 130.68 1b09 s VAL 194 Ca 0.02 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1b09 s VAL 194 Cb -0.13 -3.53 0.18 0.00 0.00 0.00 0.00 36.38 32.90 1b09 s VAL 194 CO -0.07 0.33 0.51 -1.58 0.00 0.00 0.00 175.10 174.29 1b09 s GLN 195 N -1.92 0.49 0.00 2.72 2.00 0.02 -4.99 119.66 117.98 1b09 s GLN 195 Ca 0.27 0.51 0.00 0.00 -2.00 0.00 0.00 55.36 54.14 1b09 s GLN 195 Cb -0.13 0.04 0.00 0.00 0.80 0.00 0.00 33.01 33.72 1b09 s GLN 195 CO 0.18 -0.90 0.00 0.41 -0.50 0.00 0.00 175.29 174.48 1b09 n GLY 196 N 5.39 0.20 3.08 2.59 0.00 -1.26 0.14 105.19 115.34 1b09 n GLY 196 Ca 0.01 -2.19 -0.43 0.00 0.00 0.00 0.00 46.02 43.41 1b09 n GLY 196 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1b09 n GLU 197 N 0.00 3.34 -5.11 1.61 4.07 -1.26 -4.91 120.64 118.38 1b09 n GLU 197 Ca 0.00 -3.38 -0.29 0.00 -0.06 0.00 0.00 57.16 53.43 1b09 n GLU 197 Cb 0.00 -3.11 -0.16 0.00 -0.06 0.00 0.00 31.44 28.11 1b09 n GLU 197 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 1b09 s VAL 198 N 1.77 1.79 0.34 6.31 -7.23 -1.26 -4.21 120.40 117.90 1b09 s VAL 198 Ca 0.44 -0.95 0.08 0.00 -1.81 0.00 0.00 61.98 59.74 1b09 s VAL 198 Cb 0.07 -1.50 -0.04 0.00 0.56 0.00 0.00 36.38 35.47 1b09 s VAL 198 CO -0.01 0.50 0.16 -0.36 -0.31 0.00 0.00 175.10 175.09 1b09 s PHE 199 N -0.36 2.74 -0.47 2.82 0.40 0.16 -4.94 117.98 118.33 1b09 s PHE 199 Ca 0.04 -0.36 0.03 0.00 -0.60 0.00 0.00 56.93 56.04 1b09 s PHE 199 Cb -0.10 -1.64 0.12 0.00 0.51 0.00 0.00 43.02 41.91 1b09 s PHE 199 CO 0.01 0.33 0.21 0.99 0.70 0.00 0.00 175.22 177.46 1b09 s THR 200 N -2.40 2.70 0.35 0.64 2.01 -1.26 0.31 115.64 117.99 1b09 s THR 200 Ca 0.38 -2.86 0.08 0.00 0.31 0.00 0.00 61.69 59.60 1b09 s THR 200 Cb -0.03 -2.89 -0.05 0.00 0.01 0.00 0.00 72.50 69.55 1b09 s THR 200 CO 0.23 -0.74 0.12 -0.54 -0.69 0.00 0.00 174.62 173.01 1b09 s LYS 201 N 0.24 2.29 0.69 4.92 -0.14 -0.79 -4.89 119.74 122.07 1b09 s LYS 201 Ca 0.14 -1.63 -0.17 0.00 -1.36 0.00 0.00 55.97 52.96 1b09 s LYS 201 Cb -0.23 -2.10 -0.00 0.00 -1.68 0.00 0.00 37.83 33.82 1b09 s LYS 201 CO -0.03 0.08 1.06 -2.30 -0.76 0.00 0.00 175.35 173.40 1b09 n PRO 202 N -1.12 0.69 -3.09 -1.68 -0.02 -1.26 -0.02 135.00 128.49 1b09 n PRO 202 Ca -0.03 0.29 -0.35 0.00 -2.02 0.00 0.00 63.50 61.39 1b09 n PRO 202 Cb 0.62 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.73 1b09 n PRO 202 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1b09 s GLN 203 N -3.30 4.21 0.33 -0.52 -2.07 -1.18 -4.58 119.66 112.55 1b09 s GLN 203 Ca 0.76 0.85 0.18 0.00 -1.82 0.00 0.00 55.36 55.34 1b09 s GLN 203 Cb -0.36 -2.78 0.16 0.00 -1.09 0.00 0.00 33.01 28.94 1b09 s GLN 203 CO 0.47 0.34 1.47 -0.07 -1.32 0.00 0.00 175.29 176.18 1b09 h LEU 204 N 3.17 0.00-10.37 2.60 3.38 -1.95 -3.46 115.31 108.67 1b09 h LEU 204 Ca -0.48 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.05 1b09 h LEU 204 Cb 1.19 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.96 1b09 h LEU 204 CO 0.65 0.29 -0.18 -1.66 0.09 0.00 0.00 178.44 177.63 1b09 s TRP 205 N -3.07 3.10 -2.51 1.13 -2.14 -1.26 -5.12 118.94 109.06 1b09 s TRP 205 Ca 0.05 -0.00 0.28 0.00 2.66 0.00 0.00 56.10 59.08 1b09 s TRP 205 Cb 0.07 -2.28 1.03 0.00 -3.10 0.00 0.00 33.47 29.19 1b09 s TRP 205 CO 0.72 -0.32 1.73 -0.35 -2.66 0.00 0.00 176.95 176.07