#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xf2 s VAL 2 N 0.00 3.87 0.02 1.69 1.01 -1.26 -3.89 120.40 121.84 1xf2 s VAL 2 Ca 0.00 1.18 0.05 0.00 0.00 0.00 0.00 61.98 63.21 1xf2 s VAL 2 Cb 0.00 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 1xf2 s VAL 2 CO 0.00 -0.04 -0.16 -0.54 0.00 0.00 0.00 175.10 174.36 1xf2 s LYS 3 N 2.88 1.12 -0.24 2.72 1.02 -0.85 -5.00 119.74 121.39 1xf2 s LYS 3 Ca 0.63 -0.73 0.00 0.00 0.02 0.00 0.00 55.97 55.89 1xf2 s LYS 3 Cb -0.29 -1.13 0.06 0.00 -0.52 0.00 0.00 37.83 35.95 1xf2 s LYS 3 CO 0.24 0.29 -0.02 -0.51 -0.92 0.00 0.00 175.35 174.43 1xf2 s LEU 4 N -0.90 2.37 -0.34 3.17 1.43 -1.26 -2.18 118.68 120.97 1xf2 s LEU 4 Ca 0.04 -1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 51.80 1xf2 s LEU 4 Cb -0.07 -1.07 -0.01 0.00 0.03 0.00 0.00 46.19 45.07 1xf2 s LEU 4 CO 0.01 -0.27 0.40 -0.76 0.23 0.00 0.00 176.35 175.96 1xf2 s LEU 5 N 1.48 4.38 0.05 1.79 1.02 -0.09 -4.31 118.68 122.98 1xf2 s LEU 5 Ca -0.03 -0.13 0.01 0.00 0.02 0.00 0.00 54.13 53.99 1xf2 s LEU 5 Cb -0.18 -2.41 -0.04 0.00 0.02 0.00 0.00 46.19 43.58 1xf2 s LEU 5 CO -0.08 -0.36 0.14 -1.61 0.02 0.00 0.00 176.35 174.47 1xf2 s GLU 6 N 2.11 3.19 0.82 1.70 2.02 -1.26 -1.20 118.70 126.08 1xf2 s GLU 6 Ca 0.14 -0.51 -0.11 0.00 0.02 0.00 0.00 54.97 54.51 1xf2 s GLU 6 Cb -0.16 -2.92 0.08 0.00 0.10 0.00 0.00 34.13 31.24 1xf2 s GLU 6 CO 0.12 0.61 1.10 -1.54 0.02 0.00 0.00 175.26 175.57 1xf2 s SER 7 N -2.26 4.06 0.99 -0.19 1.04 -0.92 -4.97 113.70 111.46 1xf2 s SER 7 Ca 0.30 1.86 -0.16 0.00 0.48 0.00 0.00 55.95 58.43 1xf2 s SER 7 Cb -0.13 -2.50 0.21 0.00 0.10 0.00 0.00 66.02 63.71 1xf2 s SER 7 CO 0.22 -2.32 1.29 -0.83 0.98 0.00 0.00 173.24 172.58 1xf2 s GLY 8 N -3.25 1.75 0.41 7.32 0.00 -1.26 -4.53 107.32 107.76 1xf2 s GLY 8 Ca 0.62 -1.15 -0.25 0.00 0.00 0.00 0.00 44.72 43.95 1xf2 s GLY 8 CO 0.57 -0.37 0.99 -1.55 0.00 0.00 0.00 173.10 172.74 1xf2 n PRO 9 N -3.90 1.32 -4.73 2.90 -0.04 -1.26 -4.69 135.00 124.61 1xf2 n PRO 9 Ca 0.15 0.47 -0.26 0.00 -0.04 0.00 0.00 63.50 63.82 1xf2 n PRO 9 Cb 0.59 -2.01 -0.16 0.00 -0.04 0.00 0.00 33.50 31.89 1xf2 n PRO 9 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xf2 s GLU 10 N -1.96 1.86 -0.21 0.54 0.41 -0.76 -5.01 118.70 113.58 1xf2 s GLU 10 Ca 0.63 -0.52 -0.04 0.00 -0.41 0.00 0.00 54.97 54.62 1xf2 s GLU 10 Cb -0.57 -1.54 -0.02 0.00 -1.78 0.00 0.00 34.13 30.23 1xf2 s GLU 10 CO 0.57 0.11 -0.02 -1.17 -0.49 0.00 0.00 175.26 174.26 1xf2 s LEU 11 N 0.43 3.04 0.03 1.80 2.96 -1.26 -0.61 118.68 125.07 1xf2 s LEU 11 Ca -0.12 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 1xf2 s LEU 11 Cb -0.15 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 1xf2 s LEU 11 CO 0.04 0.01 -0.05 0.68 -1.32 0.00 0.00 176.35 175.70 1xf2 s VAL 12 N 1.32 0.33 0.59 1.68 -7.23 -0.34 -5.00 120.40 111.76 1xf2 s VAL 12 Ca 0.04 -0.87 -0.16 0.00 -1.81 0.00 0.00 61.98 59.19 1xf2 s VAL 12 Cb -0.14 -0.41 -0.04 0.00 0.56 0.00 0.00 36.38 36.34 1xf2 s VAL 12 CO -0.01 -0.36 1.05 -0.54 -0.31 0.00 0.00 175.10 174.94 1xf2 s LYS 13 N -1.30 3.34 0.25 4.82 1.02 -1.25 -1.33 119.74 125.29 1xf2 s LYS 13 Ca -0.10 1.18 -0.31 0.00 0.02 0.00 0.00 55.97 56.76 1xf2 s LYS 13 Cb -0.09 -2.04 -0.13 0.00 -0.52 0.00 0.00 37.83 35.06 1xf2 s LYS 13 CO -0.00 -0.79 1.48 -2.30 -0.92 0.00 0.00 175.35 172.82 1xf2 n PRO 14 N -2.04 2.24 0.00 -1.68 -0.02 -1.26 -2.61 135.00 129.63 1xf2 n PRO 14 Ca 0.09 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1xf2 n PRO 14 Cb 0.53 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1xf2 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xf2 n GLY 15 N 2.28 3.21 3.93 -1.23 0.00 0.18 -4.90 105.19 108.65 1xf2 n GLY 15 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1xf2 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xf2 s ALA 16 N -2.58 2.15 0.23 4.61 0.00 -1.07 -4.08 121.76 121.02 1xf2 s ALA 16 Ca 0.00 -1.25 0.11 0.00 0.00 0.00 0.00 51.96 50.81 1xf2 s ALA 16 Cb 0.00 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.31 1xf2 s ALA 16 CO 0.00 -2.55 -0.14 -1.12 0.00 0.00 0.00 175.76 171.95 1xf2 s SER 17 N -4.90 3.93 0.01 0.00 0.01 -1.26 -1.98 113.70 109.51 1xf2 s SER 17 Ca 0.75 -0.80 0.02 0.00 1.31 0.00 0.00 55.95 57.23 1xf2 s SER 17 Cb -0.03 -0.51 -0.01 0.00 0.21 0.00 0.00 66.02 65.68 1xf2 s SER 17 CO 0.53 0.06 -0.06 0.54 0.41 0.00 0.00 173.24 174.73 1xf2 s VAL 18 N -2.09 0.44 -0.08 3.43 0.11 -0.66 -5.00 120.40 116.56 1xf2 s VAL 18 Ca 0.27 -0.40 0.02 0.00 -2.93 0.00 0.00 61.98 58.94 1xf2 s VAL 18 Cb -0.07 -0.41 0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1xf2 s VAL 18 CO 0.15 0.01 -0.13 -0.75 -3.33 0.00 0.00 175.10 171.06 1xf2 s LYS 19 N -0.42 1.80 0.17 1.54 2.20 -1.26 -0.97 119.74 122.80 1xf2 s LYS 19 Ca -0.00 -0.43 0.09 0.00 -0.36 0.00 0.00 55.97 55.26 1xf2 s LYS 19 Cb -0.04 -1.52 -0.04 0.00 -1.51 0.00 0.00 37.83 34.73 1xf2 s LYS 19 CO -0.00 -0.01 -0.19 0.00 -0.36 0.00 0.00 175.35 174.79 1xf2 s MET 20 N 0.80 1.32 0.27 4.03 0.23 0.27 -4.97 119.30 121.25 1xf2 s MET 20 Ca -0.12 -1.43 0.12 0.00 -1.03 0.00 0.00 55.69 53.22 1xf2 s MET 20 Cb -0.15 -1.41 -0.05 0.00 -1.53 0.00 0.00 34.83 31.68 1xf2 s MET 20 CO 0.02 0.29 -0.20 -1.54 -2.03 0.00 0.00 175.02 171.56 1xf2 s SER 21 N -2.69 3.52 -0.29 -1.18 1.04 -1.26 -1.32 113.70 111.51 1xf2 s SER 21 Ca 0.17 -1.01 0.01 0.00 0.48 0.00 0.00 55.95 55.59 1xf2 s SER 21 Cb -0.06 -0.29 0.15 0.00 0.10 0.00 0.00 66.02 65.92 1xf2 s SER 21 CO 0.07 0.04 0.35 0.00 0.98 0.00 0.00 173.24 174.68 1xf2 s LYS 23 N 2.45 4.13 0.02 0.00 2.20 -0.34 -0.73 119.74 127.46 1xf2 s LYS 23 Ca 0.09 0.15 -0.00 0.00 -0.36 0.00 0.00 55.97 55.85 1xf2 s LYS 23 Cb -0.13 -3.56 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 1xf2 s LYS 23 CO -0.32 -0.09 0.13 0.00 -0.36 0.00 0.00 175.35 174.71 1xf2 s ALA 24 N 1.48 3.75 0.20 3.13 0.00 0.45 -0.92 121.76 129.85 1xf2 s ALA 24 Ca 0.18 -0.86 -0.09 0.00 0.00 0.00 0.00 51.96 51.18 1xf2 s ALA 24 Cb -0.15 -1.68 -0.01 0.00 0.00 0.00 0.00 23.12 21.29 1xf2 s ALA 24 CO 0.08 0.74 0.33 -1.54 0.00 0.00 0.00 175.76 175.37 1xf2 s SER 25 N -2.02 0.00 0.00 0.00 1.04 -0.93 -4.81 113.70 106.98 1xf2 s SER 25 Ca 0.27 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.75 1xf2 s SER 25 Cb -0.12 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.48 1xf2 s SER 25 CO 0.19 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 174.04 1xf2 n GLY 26 N -0.28 0.75 3.66 7.32 0.00 -1.25 -2.02 105.19 113.37 1xf2 n GLY 26 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 1xf2 n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xf2 s TYR 27 N -2.68 0.39 -0.66 1.61 1.13 -1.26 -4.22 117.35 111.65 1xf2 s TYR 27 Ca 0.00 -0.81 -0.28 0.00 -1.41 0.00 0.00 57.07 54.58 1xf2 s TYR 27 Cb 0.00 0.36 0.03 0.00 -1.10 0.00 0.00 41.96 41.25 1xf2 s TYR 27 CO 0.00 -1.20 1.24 0.99 -2.51 0.00 0.00 175.55 174.07 1xf2 s THR 28 N -3.37 3.86 0.27 -3.49 2.01 -1.26 -4.89 115.64 108.77 1xf2 s THR 28 Ca 0.21 0.65 -0.05 0.00 0.31 0.00 0.00 61.69 62.81 1xf2 s THR 28 Cb -0.03 -4.82 0.34 0.00 0.01 0.00 0.00 72.50 68.01 1xf2 s THR 28 CO 0.12 -1.60 1.61 0.15 -0.69 0.00 0.00 174.62 174.21 1xf2 h PHE 29 N 9.85 -0.12 0.00 4.92 3.57 -1.95 0.24 116.94 133.44 1xf2 h PHE 29 Ca -0.27 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.30 1xf2 h PHE 29 Cb 1.05 0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.98 1xf2 h PHE 29 CO 1.08 -0.32 0.00 0.25 -2.23 0.00 0.00 178.31 177.10 1xf2 n THR 30 N -5.42 0.20 0.89 4.41 -2.24 -1.26 -3.58 114.28 107.28 1xf2 n THR 30 Ca 0.16 0.05 0.12 0.00 -2.27 0.00 0.00 64.05 62.12 1xf2 n THR 30 Cb 0.55 -0.63 0.29 0.00 -2.10 0.00 0.00 70.33 68.45 1xf2 n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1xf2 n SER 31 N -1.33 0.47 -4.09 3.42 7.64 0.07 -3.70 113.62 116.10 1xf2 n SER 31 Ca 0.11 -0.03 -0.20 0.00 1.01 0.00 0.00 58.87 59.75 1xf2 n SER 31 Cb 0.22 0.10 -0.14 0.00 -1.01 0.00 0.00 64.21 63.38 1xf2 n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1xf2 s TYR 32 N -3.04 1.10 0.56 1.43 2.02 -1.23 -4.80 117.35 113.39 1xf2 s TYR 32 Ca 0.10 -0.26 -0.17 0.00 -0.37 0.00 0.00 57.07 56.37 1xf2 s TYR 32 Cb 0.17 -0.68 -0.05 0.00 -0.40 0.00 0.00 41.96 40.99 1xf2 s TYR 32 CO 0.68 -0.00 1.05 0.14 -1.57 0.00 0.00 175.55 175.84 1xf2 s VAL 33 N -0.52 3.87 -0.32 0.71 -7.23 -1.26 -4.53 120.40 111.12 1xf2 s VAL 33 Ca 0.03 0.95 -0.06 0.00 -1.81 0.00 0.00 61.98 61.09 1xf2 s VAL 33 Cb -0.06 -3.43 0.03 0.00 0.56 0.00 0.00 36.38 33.48 1xf2 s VAL 33 CO 0.00 -0.46 0.08 -0.32 -0.31 0.00 0.00 175.10 174.09 1xf2 s MET 34 N -3.87 2.77 0.60 4.82 1.75 -0.17 -0.78 119.30 124.41 1xf2 s MET 34 Ca 0.64 -1.07 -0.12 0.00 -1.25 0.00 0.00 55.69 53.89 1xf2 s MET 34 Cb -0.16 -3.38 -0.05 0.00 2.84 0.00 0.00 34.83 34.09 1xf2 s MET 34 CO 0.32 -0.57 1.02 -1.01 -0.65 0.00 0.00 175.02 174.13 1xf2 s HIS 35 N 1.42 3.56 -0.02 4.11 3.76 0.55 -1.68 115.29 126.99 1xf2 s HIS 35 Ca -0.00 1.34 0.04 0.00 -0.15 0.00 0.00 55.06 56.29 1xf2 s HIS 35 Cb -0.19 -2.75 -0.01 0.00 1.11 0.00 0.00 32.58 30.75 1xf2 s HIS 35 CO 0.02 -0.64 -0.14 -1.58 -0.85 0.00 0.00 174.74 171.55 1xf2 s TRP 36 N -3.04 1.30 -0.01 1.40 0.52 -0.37 -0.71 118.94 118.03 1xf2 s TRP 36 Ca 0.56 -0.28 0.02 0.00 0.02 0.00 0.00 56.10 56.42 1xf2 s TRP 36 Cb -0.11 -0.86 -0.00 0.00 -1.15 0.00 0.00 33.47 31.35 1xf2 s TRP 36 CO 0.48 -0.06 -0.07 0.08 0.02 0.00 0.00 176.95 177.40 1xf2 s VAL 37 N -0.20 0.62 -0.11 4.03 1.01 0.16 -0.97 120.40 124.93 1xf2 s VAL 37 Ca 0.03 -0.31 -0.05 0.00 0.00 0.00 0.00 61.98 61.65 1xf2 s VAL 37 Cb -0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1xf2 s VAL 37 CO 0.00 0.19 0.10 -0.75 0.00 0.00 0.00 175.10 174.63 1xf2 s LYS 38 N -0.01 3.29 -0.19 2.72 2.20 0.96 -0.20 119.74 128.51 1xf2 s LYS 38 Ca 0.01 -0.23 -0.05 0.00 -0.36 0.00 0.00 55.97 55.34 1xf2 s LYS 38 Cb -0.05 -3.06 0.07 0.00 -1.51 0.00 0.00 37.83 33.28 1xf2 s LYS 38 CO -0.00 0.75 0.09 -1.14 -0.36 0.00 0.00 175.35 174.69 1xf2 s GLN 39 N -1.01 0.11 0.50 4.03 0.74 0.21 -0.97 119.66 123.26 1xf2 s GLN 39 Ca 0.15 -0.16 -0.21 0.00 0.05 0.00 0.00 55.36 55.19 1xf2 s GLN 39 Cb -0.12 -1.75 -0.07 0.00 1.10 0.00 0.00 33.01 32.17 1xf2 s GLN 39 CO 0.04 -0.72 1.12 0.15 -0.55 0.00 0.00 175.29 175.33 1xf2 s LYS 40 N 2.12 3.61 0.08 1.67 1.02 -1.26 -1.16 119.74 125.82 1xf2 s LYS 40 Ca 0.03 1.60 -0.33 0.00 0.02 0.00 0.00 55.97 57.29 1xf2 s LYS 40 Cb -0.16 -2.17 -0.12 0.00 -0.52 0.00 0.00 37.83 34.86 1xf2 s LYS 40 CO -0.13 -0.64 1.76 -2.30 -0.92 0.00 0.00 175.35 173.13 1xf2 n PRO 41 N -0.92 2.40 -1.31 -1.68 -0.02 -1.26 -1.64 135.00 130.57 1xf2 n PRO 41 Ca 0.10 0.87 -0.09 0.00 -2.02 0.00 0.00 63.50 62.36 1xf2 n PRO 41 Cb 0.50 -2.71 -0.04 0.00 -0.02 0.00 0.00 33.50 31.24 1xf2 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xf2 n GLY 42 N 4.01 1.00 3.32 -1.23 0.00 -1.26 -5.01 105.19 106.02 1xf2 n GLY 42 Ca 0.19 -0.63 -0.19 0.00 0.00 0.00 0.00 46.02 45.39 1xf2 n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xf2 s GLN 43 N -2.84 1.63 0.00 1.61 -0.21 -0.65 -5.18 119.66 114.01 1xf2 s GLN 43 Ca 0.00 -1.93 0.00 0.00 0.02 0.00 0.00 55.36 53.45 1xf2 s GLN 43 Cb 0.00 0.00 0.00 0.00 1.00 0.00 0.00 33.01 34.01 1xf2 s GLN 43 CO 0.00 -0.50 0.00 0.41 -2.12 0.00 0.00 175.29 173.08 1xf2 n GLY 44 N -0.59 -1.18 3.42 3.09 0.00 -1.26 -4.52 105.19 104.15 1xf2 n GLY 44 Ca 0.02 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.13 1xf2 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xf2 s LEU 45 N 0.00 2.55 -0.06 0.99 1.43 -1.26 -4.06 118.68 118.27 1xf2 s LEU 45 Ca 0.00 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 52.82 1xf2 s LEU 45 Cb 0.00 -1.51 0.02 0.00 0.03 0.00 0.00 46.19 44.73 1xf2 s LEU 45 CO 0.00 0.31 -0.05 -0.70 0.23 0.00 0.00 176.35 176.14 1xf2 s GLU 46 N -0.52 0.96 -0.01 1.70 2.12 -0.15 -4.99 118.70 117.81 1xf2 s GLU 46 Ca 0.07 -0.11 -0.29 0.00 0.36 0.00 0.00 54.97 55.01 1xf2 s GLU 46 Cb -0.11 -1.02 -0.03 0.00 0.26 0.00 0.00 34.13 33.22 1xf2 s GLU 46 CO 0.01 -0.15 0.93 -0.46 -0.54 0.00 0.00 175.26 175.05 1xf2 s TRP 47 N 1.24 3.65 -0.24 5.30 -0.00 -1.26 -0.03 118.94 127.60 1xf2 s TRP 47 Ca -0.06 1.62 -0.12 0.00 -0.00 0.00 0.00 56.10 57.54 1xf2 s TRP 47 Cb -0.14 -3.06 -0.16 0.00 -0.00 0.00 0.00 33.47 30.11 1xf2 s TRP 47 CO -0.02 0.02 -0.12 -0.89 -0.00 0.00 0.00 176.95 175.94 1xf2 n ILE 48 N 3.81 1.55 -1.01 5.86 5.41 -0.15 -4.64 119.36 130.19 1xf2 n ILE 48 Ca 0.04 -0.36 0.00 0.00 1.00 0.00 0.00 62.75 63.44 1xf2 n ILE 48 Cb 0.51 -1.83 0.00 0.00 -0.71 0.00 0.00 39.64 37.61 1xf2 n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xf2 n GLY 49 N 1.55 -2.29 3.07 7.39 0.00 -1.23 -1.26 105.19 112.42 1xf2 n GLY 49 Ca -0.45 -1.24 -0.07 0.00 0.00 0.00 0.00 46.02 44.25 1xf2 n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xf2 s TYR 50 N -2.27 0.48 -0.01 1.61 -0.85 -0.19 -1.23 117.35 114.89 1xf2 s TYR 50 Ca 0.00 -0.98 0.07 0.00 -0.52 0.00 0.00 57.07 55.63 1xf2 s TYR 50 Cb 0.00 -0.36 -0.02 0.00 0.38 0.00 0.00 41.96 41.96 1xf2 s TYR 50 CO 0.00 -0.35 -0.22 -1.50 -1.52 0.00 0.00 175.55 171.96 1xf2 s ILE 51 N -3.53 2.45 -0.46 -3.49 2.07 -0.68 -1.72 121.20 115.84 1xf2 s ILE 51 Ca 0.03 -1.06 -0.17 0.00 -1.41 0.00 0.00 60.65 58.05 1xf2 s ILE 51 Cb 0.05 -1.93 0.05 0.00 0.13 0.00 0.00 42.46 40.77 1xf2 s ILE 51 CO -0.09 0.52 0.44 0.21 -1.91 0.00 0.00 174.94 174.11 1xf2 s ASN 52 N -0.86 6.17 0.51 4.50 3.84 0.03 -1.00 114.94 128.11 1xf2 s ASN 52 Ca 0.11 -1.05 0.22 0.00 0.21 0.00 0.00 52.86 52.35 1xf2 s ASN 52 Cb -0.10 -2.21 1.34 0.00 -0.55 0.00 0.00 41.25 39.72 1xf2 s ASN 52 CO 0.01 -0.66 2.08 -0.65 -2.79 0.00 0.00 177.10 175.09 1xf2 h PRO 52 N 8.79 0.00 -0.70 0.43 0.11 -1.84 0.18 132.00 138.95 1xf2 h PRO 52 Ca -0.28 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.98 1xf2 h PRO 52 Cb 1.11 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.11 1xf2 h PRO 52 CO 0.86 0.11 0.16 -0.92 -0.21 0.00 0.00 178.00 178.01 1xf2 h TYR 53 N 0.00 0.25 0.00 0.65 3.20 -1.88 -3.33 116.97 115.86 1xf2 h TYR 53 Ca -0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1xf2 h TYR 53 Cb 0.25 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.51 1xf2 h TYR 53 CO 0.00 -0.07 -0.30 0.27 -1.64 0.00 0.00 178.16 176.42 1xf2 n ASN 54 N -5.15 0.60 -1.85 -2.11 0.23 -1.09 -5.02 115.26 100.88 1xf2 n ASN 54 Ca 0.13 -2.11 -0.11 0.00 -0.53 0.00 0.00 54.58 51.96 1xf2 n ASN 54 Cb 0.42 -0.22 -0.03 0.00 -2.08 0.00 0.00 39.78 37.88 1xf2 n ASN 54 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1xf2 n ASP 55 N -0.34 -3.28 -4.82 0.53 8.00 0.03 -4.96 116.55 111.72 1xf2 n ASP 55 Ca 0.03 0.25 -0.34 0.00 0.71 0.00 0.00 54.79 55.44 1xf2 n ASP 55 Cb 0.64 -2.97 -0.06 0.00 -0.02 0.00 0.00 41.12 38.70 1xf2 n ASP 55 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1xf2 s GLY 56 N -1.99 2.50 0.08 0.44 0.00 -1.18 -4.84 107.32 102.33 1xf2 s GLY 56 Ca 0.00 0.28 0.06 0.00 0.00 0.00 0.00 44.72 45.06 1xf2 s GLY 56 CO 0.00 0.59 -0.15 -0.51 0.00 0.00 0.00 173.10 173.03 1xf2 s THR 57 N -1.89 1.19 -0.04 0.90 -4.23 -1.26 -0.79 115.64 109.51 1xf2 s THR 57 Ca 0.54 -1.36 0.02 0.00 -1.18 0.00 0.00 61.69 59.71 1xf2 s THR 57 Cb -0.13 -1.16 0.01 0.00 1.34 0.00 0.00 72.50 72.57 1xf2 s THR 57 CO 0.18 -0.22 -0.10 -0.75 -0.54 0.00 0.00 174.62 173.19 1xf2 s LYS 58 N -1.82 1.24 0.06 3.99 2.47 -0.70 -5.00 119.74 119.97 1xf2 s LYS 58 Ca -0.00 -0.32 0.09 0.00 -1.56 0.00 0.00 55.97 54.18 1xf2 s LYS 58 Cb -0.10 -1.10 -0.03 0.00 -1.46 0.00 0.00 37.83 35.14 1xf2 s LYS 58 CO 0.03 0.06 -0.26 0.71 0.16 0.00 0.00 175.35 176.04 1xf2 s TYR 59 N 0.48 2.33 0.06 4.03 2.02 -1.26 -1.02 117.35 124.00 1xf2 s TYR 59 Ca -0.09 -0.40 -0.35 0.00 -0.37 0.00 0.00 57.07 55.86 1xf2 s TYR 59 Cb -0.12 -1.37 -0.15 0.00 -0.40 0.00 0.00 41.96 39.92 1xf2 s TYR 59 CO 0.02 0.17 1.56 -1.71 -1.57 0.00 0.00 175.55 174.01 1xf2 n ASN 60 N 1.62 2.61 -0.27 2.29 2.85 -0.39 -4.90 115.26 119.07 1xf2 n ASN 60 Ca -0.17 1.08 0.19 0.00 -0.11 0.00 0.00 54.58 55.57 1xf2 n ASN 60 Cb 0.52 -1.32 0.49 0.00 1.24 0.00 0.00 39.78 40.71 1xf2 n ASN 60 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1xf2 h GLU 61 N 6.03 0.43 0.00 1.20 4.81 -1.95 0.64 114.58 125.75 1xf2 h GLU 61 Ca -0.46 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.72 1xf2 h GLU 61 Cb 1.29 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.57 1xf2 h GLU 61 CO 0.87 0.29 -0.08 0.87 -0.73 0.00 0.00 179.01 180.22 1xf2 h LYS 62 N 0.45 0.00 -0.01 1.92 6.56 -1.94 -2.83 116.57 120.71 1xf2 h LYS 62 Ca 0.50 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.09 1xf2 h LYS 62 Cb 1.20 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 1xf2 h LYS 62 CO -0.21 0.08 -0.36 1.19 -2.06 0.00 0.00 179.45 178.08 1xf2 n PHE 63 N -3.66 0.00 -2.21 -1.35 3.72 0.17 -4.85 117.46 109.28 1xf2 n PHE 63 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 1xf2 n PHE 63 Cb 0.19 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 1xf2 n PHE 63 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1xf2 s LYS 64 N -1.90 3.87 0.00 -1.08 2.47 -0.90 -1.26 119.74 120.93 1xf2 s LYS 64 Ca 0.12 1.58 0.00 0.00 -1.56 0.00 0.00 55.97 56.11 1xf2 s LYS 64 Cb 0.12 -3.98 0.00 0.00 -1.46 0.00 0.00 37.83 32.52 1xf2 s LYS 64 CO 0.41 -1.20 0.00 0.41 0.16 0.00 0.00 175.35 175.14 1xf2 n GLY 65 N 4.49 1.42 0.73 5.54 0.00 -1.26 -4.91 105.19 111.20 1xf2 n GLY 65 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.13 1xf2 n GLY 65 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1xf2 n LYS 66 N -1.05 0.13 -4.16 1.61 3.00 -0.64 -5.03 118.16 112.03 1xf2 n LYS 66 Ca 0.00 0.06 -0.36 0.00 -0.00 0.00 0.00 58.31 58.01 1xf2 n LYS 66 Cb 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 35.03 34.19 1xf2 n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1xf2 s ALA 67 N -2.12 3.52 -0.21 3.14 0.00 -0.39 -4.25 121.76 121.45 1xf2 s ALA 67 Ca -0.09 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.14 1xf2 s ALA 67 Cb 0.03 -1.70 0.05 0.00 0.00 0.00 0.00 23.12 21.50 1xf2 s ALA 67 CO 0.11 0.57 -0.09 0.99 0.00 0.00 0.00 175.76 177.34 1xf2 s THR 68 N -0.84 1.63 -0.19 0.00 2.01 0.76 -4.77 115.64 114.24 1xf2 s THR 68 Ca 0.13 -1.06 -0.14 0.00 0.31 0.00 0.00 61.69 60.94 1xf2 s THR 68 Cb -0.12 -1.74 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 1xf2 s THR 68 CO 0.03 0.12 0.29 -0.76 -0.69 0.00 0.00 174.62 173.60 1xf2 s LEU 69 N 1.39 4.19 0.36 4.42 1.43 -1.26 -1.22 118.68 127.98 1xf2 s LEU 69 Ca -0.02 0.41 0.05 0.00 -1.03 0.00 0.00 54.13 53.53 1xf2 s LEU 69 Cb -0.17 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.68 1xf2 s LEU 69 CO -0.08 0.04 0.19 0.42 0.23 0.00 0.00 176.35 177.15 1xf2 s THR 70 N 0.86 0.33 -0.26 5.49 -4.23 -0.54 -4.98 115.64 112.31 1xf2 s THR 70 Ca 0.15 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.49 1xf2 s THR 70 Cb -0.13 -2.43 0.07 0.00 1.34 0.00 0.00 72.50 71.35 1xf2 s THR 70 CO 0.05 0.00 0.65 -0.55 -0.54 0.00 0.00 174.62 174.23 1xf2 s SER 71 N -3.47 -0.85 -0.27 3.99 0.15 -1.26 -0.48 113.70 111.51 1xf2 s SER 71 Ca 0.32 1.41 0.03 0.00 0.70 0.00 0.00 55.95 58.41 1xf2 s SER 71 Cb 0.03 1.31 0.07 0.00 -1.71 0.00 0.00 66.02 65.72 1xf2 s SER 71 CO 0.20 -0.23 -0.07 -0.62 1.20 0.00 0.00 173.24 173.71 1xf2 s ASP 72 N 1.34 4.36 0.25 5.45 2.15 0.23 -5.01 116.67 125.45 1xf2 s ASP 72 Ca -0.08 -1.46 -0.06 0.00 0.43 0.00 0.00 52.55 51.38 1xf2 s ASP 72 Cb -0.05 -1.47 0.26 0.00 -0.30 0.00 0.00 42.92 41.35 1xf2 s ASP 72 CO -0.15 -0.23 1.92 0.11 -0.17 0.00 0.00 175.17 176.66 1xf2 h LYS 73 N 7.79 1.32 0.00 4.34 1.57 -1.90 -1.49 116.57 128.20 1xf2 h LYS 73 Ca -0.17 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.46 1xf2 h LYS 73 Cb 1.04 -0.29 -0.01 0.00 0.08 0.00 0.00 32.23 33.05 1xf2 h LYS 73 CO 0.46 0.88 -0.31 0.66 -0.57 0.00 0.00 179.45 180.57 1xf2 h SER 74 N 1.35 0.00 -0.13 0.86 4.64 -1.96 -2.74 113.55 115.57 1xf2 h SER 74 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1xf2 h SER 74 Cb -0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 1xf2 h SER 74 CO -0.08 0.31 0.00 -1.54 -0.87 0.00 0.00 176.83 174.65 1xf2 n SER 75 N -3.44 2.37 -4.02 4.97 3.41 -1.14 -4.99 113.62 110.78 1xf2 n SER 75 Ca 0.00 -1.68 -0.32 0.00 -0.26 0.00 0.00 58.87 56.61 1xf2 n SER 75 Cb 0.48 -0.08 0.01 0.00 -0.26 0.00 0.00 64.21 64.36 1xf2 n SER 75 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xf2 n SER 76 N 0.70 -4.35 -4.17 4.04 7.64 -0.60 -4.73 113.62 112.14 1xf2 n SER 76 Ca 0.09 -0.85 -0.31 0.00 1.01 0.00 0.00 58.87 58.81 1xf2 n SER 76 Cb 0.36 -3.52 -0.17 0.00 -1.01 0.00 0.00 64.21 59.87 1xf2 n SER 76 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xf2 s THR 77 N -3.29 1.92 -0.04 0.44 2.01 -0.93 -0.41 115.64 115.34 1xf2 s THR 77 Ca 0.70 -0.92 -0.06 0.00 0.31 0.00 0.00 61.69 61.71 1xf2 s THR 77 Cb -0.36 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 1xf2 s THR 77 CO 0.86 0.53 0.22 0.00 -0.69 0.00 0.00 174.62 175.54 1xf2 s ALA 78 N 0.56 3.87 0.13 7.40 0.00 0.09 -0.60 121.76 133.21 1xf2 s ALA 78 Ca -0.14 -0.61 0.08 0.00 0.00 0.00 0.00 51.96 51.29 1xf2 s ALA 78 Cb -0.17 -2.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 1xf2 s ALA 78 CO 0.05 0.65 -0.19 0.71 0.00 0.00 0.00 175.76 176.98 1xf2 s TYR 79 N -1.21 1.75 -0.05 0.00 2.02 0.37 -0.68 117.35 119.55 1xf2 s TYR 79 Ca 0.23 -0.45 0.02 0.00 -0.37 0.00 0.00 57.07 56.50 1xf2 s TYR 79 Cb -0.13 -0.92 0.01 0.00 -0.40 0.00 0.00 41.96 40.52 1xf2 s TYR 79 CO 0.13 0.25 -0.12 1.41 -1.57 0.00 0.00 175.55 175.65 1xf2 s MET 80 N -2.36 1.50 -0.07 -0.62 -2.45 -0.44 -1.46 119.30 113.40 1xf2 s MET 80 Ca 0.10 -0.39 0.05 0.00 -1.25 0.00 0.00 55.69 54.20 1xf2 s MET 80 Cb -0.08 -1.28 -0.02 0.00 1.25 0.00 0.00 34.83 34.70 1xf2 s MET 80 CO 0.05 0.06 -0.20 -2.00 1.05 0.00 0.00 175.02 173.98 1xf2 s GLU 81 N 0.53 2.65 0.40 4.11 2.12 -0.36 -0.56 118.70 127.58 1xf2 s GLU 81 Ca -0.11 -0.82 0.07 0.00 0.36 0.00 0.00 54.97 54.48 1xf2 s GLU 81 Cb -0.14 -2.29 -0.08 0.00 0.26 0.00 0.00 34.13 31.89 1xf2 s GLU 81 CO 0.03 0.43 0.01 -0.51 -0.54 0.00 0.00 175.26 174.67 1xf2 s LEU 82 N -0.25 2.88 0.00 2.70 1.43 -0.14 -0.17 118.68 125.13 1xf2 s LEU 82 Ca -0.00 -1.32 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 1xf2 s LEU 82 Cb -0.13 -0.96 0.00 0.00 0.03 0.00 0.00 46.19 45.13 1xf2 s LEU 82 CO 0.03 -0.42 0.00 -1.20 0.23 0.00 0.00 176.35 174.99 1xf2 n SER 82 N -0.96 0.00 -4.75 2.29 7.64 -1.07 -1.66 113.62 115.11 1xf2 n SER 82 Ca -0.05 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.42 1xf2 n SER 82 Cb 0.66 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.85 1xf2 n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1xf2 s LEU 82 N -2.84 4.35 0.45 -3.43 1.43 -0.84 -4.60 118.68 113.21 1xf2 s LEU 82 Ca 0.00 2.90 0.03 0.00 -1.03 0.00 0.00 54.13 56.03 1xf2 s LEU 82 Cb 0.00 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.55 1xf2 s LEU 82 CO 0.00 -0.86 0.04 0.42 0.23 0.00 0.00 176.35 176.18 1xf2 s THR 83 N -0.14 1.20 0.47 5.49 -4.23 -1.26 -0.65 115.64 116.53 1xf2 s THR 83 Ca 0.61 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.40 1xf2 s THR 83 Cb -0.46 -2.42 0.32 0.00 1.34 0.00 0.00 72.50 71.27 1xf2 s THR 83 CO 0.49 0.00 2.14 0.77 -0.54 0.00 0.00 174.62 177.47 1xf2 h SER 84 N 1.59 0.00 0.15 3.99 4.64 -1.96 -0.75 113.55 121.20 1xf2 h SER 84 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1xf2 h SER 84 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1xf2 h SER 84 CO 0.71 0.08 0.00 -0.33 -0.87 0.00 0.00 176.83 176.42 1xf2 h GLU 85 N 0.00 0.00 -0.01 4.77 4.39 -1.96 -2.58 114.58 119.20 1xf2 h GLU 85 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xf2 h GLU 85 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 1xf2 h GLU 85 CO 0.01 0.00 -0.28 -0.25 -1.16 0.00 0.00 179.01 177.33 1xf2 n ASP 86 N -3.02 1.02 -4.62 1.42 10.43 -0.29 -4.84 116.55 116.66 1xf2 n ASP 86 Ca -0.02 -0.88 -0.43 0.00 2.57 0.00 0.00 54.79 56.03 1xf2 n ASP 86 Cb 0.10 0.15 -0.03 0.00 1.84 0.00 0.00 41.12 43.18 1xf2 n ASP 86 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1xf2 s SER 87 N -2.52 5.95 -0.03 -2.24 0.01 -0.97 -4.82 113.70 109.08 1xf2 s SER 87 Ca 0.24 1.86 -0.30 0.00 1.31 0.00 0.00 55.95 59.06 1xf2 s SER 87 Cb 0.19 -2.52 0.11 0.00 0.21 0.00 0.00 66.02 64.01 1xf2 s SER 87 CO 0.53 -1.57 1.30 0.00 0.41 0.00 0.00 173.24 173.91 1xf2 s ALA 88 N 6.55 -2.38 -0.06 1.44 0.00 -0.53 -4.67 121.76 122.11 1xf2 s ALA 88 Ca 0.87 0.39 -0.17 0.00 0.00 0.00 0.00 51.96 53.06 1xf2 s ALA 88 Cb -0.31 0.61 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 1xf2 s ALA 88 CO 0.35 -1.10 0.44 0.08 0.00 0.00 0.00 175.76 175.52 1xf2 s VAL 89 N -2.18 5.11 -0.18 0.00 1.01 -0.31 -0.01 120.40 123.83 1xf2 s VAL 89 Ca 0.22 0.89 -0.01 0.00 0.00 0.00 0.00 61.98 63.08 1xf2 s VAL 89 Cb 0.03 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.64 1xf2 s VAL 89 CO -0.03 0.44 -0.14 -0.31 0.00 0.00 0.00 175.10 175.07 1xf2 s TYR 90 N -0.14 2.83 -0.09 5.22 2.02 -0.04 -0.62 117.35 126.54 1xf2 s TYR 90 Ca 0.24 -1.24 -0.06 0.00 -0.37 0.00 0.00 57.07 55.65 1xf2 s TYR 90 Cb -0.16 -1.97 -0.04 0.00 -0.40 0.00 0.00 41.96 39.40 1xf2 s TYR 90 CO 0.11 -0.62 0.15 0.71 -1.57 0.00 0.00 175.55 174.33 1xf2 s TYR 91 N 1.20 3.57 0.18 2.71 2.02 0.73 -0.39 117.35 127.37 1xf2 s TYR 91 Ca 0.02 0.47 -0.08 0.00 -0.37 0.00 0.00 57.07 57.11 1xf2 s TYR 91 Cb -0.14 -1.90 -0.06 0.00 -0.40 0.00 0.00 41.96 39.45 1xf2 s TYR 91 CO -0.06 0.71 0.47 0.00 -1.57 0.00 0.00 175.55 175.10 1xf2 s VAL 93 N -1.71 -0.53 0.16 0.00 1.01 0.11 -1.01 120.40 118.43 1xf2 s VAL 93 Ca 0.43 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 62.22 1xf2 s VAL 93 Cb -0.12 -0.63 -0.08 0.00 0.00 0.00 0.00 36.38 35.55 1xf2 s VAL 93 CO 0.22 0.01 1.32 -0.60 0.00 0.00 0.00 175.10 176.05 1xf2 s ARG 94 N 2.50 4.37 0.44 2.72 3.52 -0.55 -0.33 118.95 131.62 1xf2 s ARG 94 Ca 0.04 2.03 -0.07 0.00 -0.13 0.00 0.00 55.73 57.60 1xf2 s ARG 94 Cb -0.13 -3.22 0.10 0.00 -1.56 0.00 0.00 34.95 30.13 1xf2 s ARG 94 CO -0.12 -0.30 0.59 0.41 -0.81 0.00 0.00 175.30 175.07 1xf2 n GLY 95 N 2.78 -1.22 0.00 8.12 0.00 0.04 -3.16 105.19 111.75 1xf2 n GLY 95 Ca 0.08 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1xf2 n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xf2 n GLY 96 N 1.10 1.38 0.30 -0.02 0.00 -1.26 -4.69 105.19 102.00 1xf2 n GLY 96 Ca 0.07 -2.01 0.18 0.00 0.00 0.00 0.00 46.02 44.26 1xf2 n GLY 96 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1xf2 h TYR 97 N -0.10 0.00 -4.03 1.61 0.99 -1.95 -3.40 116.97 110.09 1xf2 h TYR 97 Ca 0.00 0.00 -0.63 0.00 2.00 0.00 0.00 58.73 60.10 1xf2 h TYR 97 Cb 0.00 0.00 -0.23 0.00 1.00 0.00 0.00 36.73 37.50 1xf2 h TYR 97 CO 0.00 0.03 -0.85 -0.98 -0.00 0.00 0.00 178.16 176.35 1xf2 s ARG 98 N -4.28 1.38 0.00 4.88 3.03 -1.26 -4.97 118.95 117.73 1xf2 s ARG 98 Ca -0.04 -1.17 0.00 0.00 2.03 0.00 0.00 55.73 56.55 1xf2 s ARG 98 Cb 0.13 -1.68 0.00 0.00 -1.03 0.00 0.00 34.95 32.38 1xf2 s ARG 98 CO 0.50 0.41 0.00 -2.30 -1.13 0.00 0.00 175.30 172.78 1xf2 n PRO 99 N 1.29 0.00 -1.51 3.89 -0.02 -1.26 -4.89 135.00 132.50 1xf2 n PRO 99 Ca -0.18 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.32 1xf2 n PRO 99 Cb 0.53 -0.93 -0.01 0.00 -0.02 0.00 0.00 33.50 33.07 1xf2 n PRO 99 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xf2 n TYR 100 N 0.53 -3.80 -1.84 6.00 0.53 -1.26 -4.84 117.16 112.49 1xf2 n TYR 100 Ca 0.00 2.06 -0.38 0.00 -1.02 0.00 0.00 57.90 58.56 1xf2 n TYR 100 Cb 0.00 -3.22 0.03 0.00 -1.03 0.00 0.00 39.34 35.12 1xf2 n TYR 100 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1xf2 s ALA 100 N -5.15 2.89 -0.18 -0.72 0.00 -1.26 -4.37 121.76 112.97 1xf2 s ALA 100 Ca 0.00 1.31 -0.14 0.00 0.00 0.00 0.00 51.96 53.12 1xf2 s ALA 100 Cb 0.00 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 1xf2 s ALA 100 CO 0.00 -1.27 0.33 -1.64 0.00 0.00 0.00 175.76 173.17 1xf2 s MET 100 N -2.82 4.22 -0.16 0.00 1.00 -1.26 -4.29 119.30 115.99 1xf2 s MET 100 Ca 0.69 0.12 0.13 0.00 0.00 0.00 0.00 55.69 56.63 1xf2 s MET 100 Cb -0.40 -3.47 -0.19 0.00 0.00 0.00 0.00 34.83 30.77 1xf2 s MET 100 CO 0.47 0.13 0.03 -0.40 0.00 0.00 0.00 175.02 175.26 1xf2 n ASP 101 N 3.92 1.17 -3.92 3.03 5.68 -1.19 -4.87 116.55 120.38 1xf2 n ASP 101 Ca -0.11 -0.01 -0.30 0.00 -0.50 0.00 0.00 54.79 53.87 1xf2 n ASP 101 Cb 0.52 0.78 -0.15 0.00 -1.14 0.00 0.00 41.12 41.12 1xf2 n ASP 101 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 1xf2 s TYR 102 N -2.39 2.54 -0.08 2.11 2.02 -1.25 -5.05 117.35 115.24 1xf2 s TYR 102 Ca -0.10 -1.99 -0.15 0.00 -0.37 0.00 0.00 57.07 54.46 1xf2 s TYR 102 Cb 0.05 -1.86 -0.05 0.00 -0.40 0.00 0.00 41.96 39.70 1xf2 s TYR 102 CO 0.64 -0.83 0.38 -1.58 -1.57 0.00 0.00 175.55 172.59 1xf2 s TRP 103 N 1.34 3.59 1.35 2.71 0.52 -1.26 -1.48 118.94 125.70 1xf2 s TRP 103 Ca 0.00 0.83 -0.20 0.00 0.02 0.00 0.00 56.10 56.75 1xf2 s TRP 103 Cb -0.19 -2.36 0.34 0.00 -1.15 0.00 0.00 33.47 30.12 1xf2 s TRP 103 CO -0.10 0.40 0.97 0.20 0.02 0.00 0.00 176.95 178.44 1xf2 s GLY 104 N -0.16 1.45 0.33 0.98 0.00 -0.18 -4.92 107.32 104.84 1xf2 s GLY 104 Ca 0.22 -0.68 0.18 0.00 0.00 0.00 0.00 44.72 44.43 1xf2 s GLY 104 CO 0.09 0.26 1.52 1.46 0.00 0.00 0.00 173.10 176.43 1xf2 h GLN 105 N -3.18 0.00 0.00 2.90 1.08 -1.88 -3.46 115.11 110.57 1xf2 h GLN 105 Ca -0.48 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 1xf2 h GLN 105 Cb 1.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.77 1xf2 h GLN 105 CO 0.34 0.35 0.00 0.41 -0.95 0.00 0.00 178.83 178.98 1xf2 n GLY 106 N 1.10 1.90 3.06 3.46 0.00 -1.26 -4.98 105.19 108.46 1xf2 n GLY 106 Ca 0.02 -1.83 -0.31 0.00 0.00 0.00 0.00 46.02 43.90 1xf2 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xf2 s THR 107 N -2.80 1.79 -0.16 2.61 2.01 0.48 -4.86 115.64 114.71 1xf2 s THR 107 Ca 0.00 -0.82 -0.21 0.00 0.31 0.00 0.00 61.69 60.97 1xf2 s THR 107 Cb 0.00 -1.67 -0.03 0.00 0.01 0.00 0.00 72.50 70.81 1xf2 s THR 107 CO 0.00 0.45 0.62 -0.55 -0.69 0.00 0.00 174.62 174.45 1xf2 s SER 108 N 1.39 6.75 -0.15 3.53 0.15 -1.26 -0.86 113.70 123.25 1xf2 s SER 108 Ca 0.04 0.91 -0.00 0.00 0.70 0.00 0.00 55.95 57.59 1xf2 s SER 108 Cb -0.13 -2.35 -0.01 0.00 -1.71 0.00 0.00 66.02 61.82 1xf2 s SER 108 CO -0.11 -0.20 -0.13 -0.69 1.20 0.00 0.00 173.24 173.30 1xf2 s VAL 109 N 1.50 2.86 -0.21 4.45 1.01 0.98 -1.82 120.40 129.18 1xf2 s VAL 109 Ca 0.30 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.53 1xf2 s VAL 109 Cb -0.16 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1xf2 s VAL 109 CO 0.12 0.51 -0.03 -0.89 0.00 0.00 0.00 175.10 174.81 1xf2 s THR 110 N 0.71 3.62 -0.34 3.92 2.01 0.22 -1.45 115.64 124.32 1xf2 s THR 110 Ca -0.06 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.41 1xf2 s THR 110 Cb -0.15 -2.64 0.01 0.00 0.01 0.00 0.00 72.50 69.72 1xf2 s THR 110 CO 0.02 0.43 0.19 -0.69 -0.69 0.00 0.00 174.62 173.87 1xf2 s VAL 111 N 1.23 4.70 -0.01 3.82 1.01 -1.26 -1.19 120.40 128.71 1xf2 s VAL 111 Ca 0.03 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.15 1xf2 s VAL 111 Cb -0.14 -3.49 0.07 0.00 0.00 0.00 0.00 36.38 32.81 1xf2 s VAL 111 CO -0.00 -0.07 0.68 -0.55 0.00 0.00 0.00 175.10 175.16 1xf2 s SER 112 N 1.61 -0.62 0.00 3.32 0.15 -0.44 -4.53 113.70 113.19 1xf2 s SER 112 Ca 0.04 0.53 0.27 0.00 0.70 0.00 0.00 55.95 57.49 1xf2 s SER 112 Cb -0.18 0.54 0.80 0.00 -1.71 0.00 0.00 66.02 65.47 1xf2 s SER 112 CO 0.07 -0.68 1.60 -1.54 1.20 0.00 0.00 173.24 173.90 1xf2 n SER 113 N 0.59 1.78 -4.76 5.45 3.41 -1.26 -3.95 113.62 114.87 1xf2 n SER 113 Ca -0.18 -1.54 -0.38 0.00 -0.26 0.00 0.00 58.87 56.52 1xf2 n SER 113 Cb 0.59 0.03 0.01 0.00 -0.26 0.00 0.00 64.21 64.58 1xf2 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xf2 s ALA 114 N -2.07 2.94 0.16 7.33 0.00 -1.26 -5.00 121.76 123.85 1xf2 s ALA 114 Ca 0.34 1.07 -0.19 0.00 0.00 0.00 0.00 51.96 53.18 1xf2 s ALA 114 Cb 0.20 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.81 1xf2 s ALA 114 CO 0.36 -0.89 0.64 0.15 0.00 0.00 0.00 175.76 176.03 1xf2 s LYS 115 N -2.74 4.19 0.06 0.00 -0.14 -1.26 -5.00 119.74 114.85 1xf2 s LYS 115 Ca 0.66 0.76 -0.36 0.00 -1.36 0.00 0.00 55.97 55.67 1xf2 s LYS 115 Cb -0.33 -3.01 -0.16 0.00 -1.68 0.00 0.00 37.83 32.66 1xf2 s LYS 115 CO 0.39 0.49 1.46 2.41 -0.76 0.00 0.00 175.35 179.35 1xf2 n THR 116 N 1.05 0.06 -3.71 2.17 -1.04 -1.26 -4.67 114.28 106.88 1xf2 n THR 116 Ca -0.05 -0.01 -0.13 0.00 -2.04 0.00 0.00 64.05 61.82 1xf2 n THR 116 Cb 0.51 -1.09 -0.13 0.00 -1.82 0.00 0.00 70.33 67.80 1xf2 n THR 116 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1xf2 s THR 117 N 1.05 -0.13 0.66 12.58 2.01 0.62 -4.94 115.64 127.50 1xf2 s THR 117 Ca 0.85 0.19 -0.14 0.00 0.31 0.00 0.00 61.69 62.90 1xf2 s THR 117 Cb -0.88 -0.38 -0.00 0.00 0.01 0.00 0.00 72.50 71.24 1xf2 s THR 117 CO 0.47 0.08 1.08 -2.16 -0.69 0.00 0.00 174.62 173.39 1xf2 s PRO 118 N 1.55 2.91 0.40 4.92 0.04 -1.26 -1.53 135.00 142.02 1xf2 s PRO 118 Ca -0.07 1.23 -0.23 0.00 0.04 0.00 0.00 61.00 61.97 1xf2 s PRO 118 Cb -0.11 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 1xf2 s PRO 118 CO -0.08 -1.14 0.99 -1.25 0.04 0.00 0.00 177.00 175.56 1xf2 s PRO 119 N -4.36 4.26 0.07 0.56 0.04 -1.26 -4.30 135.00 130.00 1xf2 s PRO 119 Ca 0.64 1.34 -0.16 0.00 0.04 0.00 0.00 61.00 62.85 1xf2 s PRO 119 Cb -0.17 -2.47 -0.06 0.00 0.04 0.00 0.00 34.50 31.84 1xf2 s PRO 119 CO 0.44 -0.03 0.51 -1.12 0.04 0.00 0.00 177.00 176.84 1xf2 s SER 120 N -1.79 6.92 -0.14 6.66 0.01 0.06 -4.92 113.70 120.51 1xf2 s SER 120 Ca 0.58 1.11 0.02 0.00 1.31 0.00 0.00 55.95 58.96 1xf2 s SER 120 Cb -0.17 -2.30 0.02 0.00 0.21 0.00 0.00 66.02 63.77 1xf2 s SER 120 CO 0.22 0.25 -0.18 -0.69 0.41 0.00 0.00 173.24 173.25 1xf2 s VAL 121 N -1.19 1.77 -0.04 3.43 1.01 -1.26 -0.23 120.40 123.88 1xf2 s VAL 121 Ca 0.29 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 61.54 1xf2 s VAL 121 Cb -0.17 -1.60 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1xf2 s VAL 121 CO 0.17 0.49 -0.22 -0.31 0.00 0.00 0.00 175.10 175.23 1xf2 s TYR 122 N 1.07 2.13 0.41 5.22 1.51 0.73 -4.98 117.35 123.45 1xf2 s TYR 122 Ca -0.03 -0.56 -0.20 0.00 -1.01 0.00 0.00 57.07 55.27 1xf2 s TYR 122 Cb -0.14 -1.40 -0.11 0.00 -0.11 0.00 0.00 41.96 40.20 1xf2 s TYR 122 CO -0.05 -0.15 0.92 -1.25 -1.11 0.00 0.00 175.55 173.92 1xf2 s PRO 123 N -0.23 4.21 -0.36 -1.71 0.04 -1.26 -0.98 135.00 134.71 1xf2 s PRO 123 Ca 0.00 1.07 0.03 0.00 0.04 0.00 0.00 61.00 62.15 1xf2 s PRO 123 Cb -0.12 -2.23 0.11 0.00 0.04 0.00 0.00 34.50 32.30 1xf2 s PRO 123 CO 0.02 -0.00 0.10 -0.51 0.04 0.00 0.00 177.00 176.64 1xf2 s LEU 124 N -3.13 4.16 -0.04 -3.56 1.43 -0.17 -4.87 118.68 112.51 1xf2 s LEU 124 Ca 0.61 -2.21 0.02 0.00 -1.03 0.00 0.00 54.13 51.51 1xf2 s LEU 124 Cb -0.09 -1.47 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 1xf2 s LEU 124 CO 0.14 -0.36 -0.07 0.00 0.23 0.00 0.00 176.35 176.29 1xf2 s ALA 125 N 0.83 3.00 0.00 4.21 0.00 -1.26 -1.28 121.76 127.27 1xf2 s ALA 125 Ca 0.12 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.14 1xf2 s ALA 125 Cb -0.20 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.72 1xf2 s ALA 125 CO -0.09 0.59 0.00 -2.30 0.00 0.00 0.00 175.76 173.95 1xf2 n PRO 126 N 1.96 2.30 0.00 0.00 -0.02 -1.26 -4.89 135.00 133.09 1xf2 n PRO 126 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1xf2 n PRO 126 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.01 1xf2 n PRO 126 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1xf2 n SER 134 N 0.00 0.62 -4.49 2.55 3.41 -1.26 -4.60 113.62 109.85 1xf2 n SER 134 Ca 0.00 -0.57 -0.26 0.00 -0.26 0.00 0.00 58.87 57.78 1xf2 n SER 134 Cb 0.00 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 63.70 1xf2 n SER 134 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1xf2 s MET 135 N -0.01 1.77 -0.03 4.33 1.00 -1.26 -1.19 119.30 123.91 1xf2 s MET 135 Ca 0.00 -1.48 0.02 0.00 0.00 0.00 0.00 55.69 54.23 1xf2 s MET 135 Cb 0.00 -1.95 0.01 0.00 0.00 0.00 0.00 34.83 32.88 1xf2 s MET 135 CO 0.00 0.40 -0.07 0.54 0.00 0.00 0.00 175.02 175.89 1xf2 s VAL 136 N -1.86 0.62 -0.20 -6.03 0.11 -0.22 -4.71 120.40 108.11 1xf2 s VAL 136 Ca 0.24 -0.26 -0.10 0.00 -2.93 0.00 0.00 61.98 58.94 1xf2 s VAL 136 Cb -0.08 -0.57 -0.05 0.00 -1.53 0.00 0.00 36.38 34.15 1xf2 s VAL 136 CO 0.13 0.21 0.13 -0.89 -3.33 0.00 0.00 175.10 171.34 1xf2 s THR 137 N 0.32 5.37 0.44 5.04 2.01 -1.26 -1.14 115.64 126.41 1xf2 s THR 137 Ca -0.04 0.17 0.05 0.00 0.31 0.00 0.00 61.69 62.18 1xf2 s THR 137 Cb -0.09 -3.45 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 1xf2 s THR 137 CO 0.00 0.45 0.05 -0.76 -0.69 0.00 0.00 174.62 173.67 1xf2 s LEU 138 N 0.32 2.74 0.27 4.42 1.43 0.13 -4.56 118.68 123.43 1xf2 s LEU 138 Ca 0.08 -1.40 -0.21 0.00 -1.03 0.00 0.00 54.13 51.56 1xf2 s LEU 138 Cb -0.11 -0.94 0.02 0.00 0.03 0.00 0.00 46.19 45.19 1xf2 s LEU 138 CO -0.02 -0.60 0.72 -0.83 0.23 0.00 0.00 176.35 175.86 1xf2 s GLY 139 N -3.80 -0.10 -0.01 -3.19 0.00 -0.40 -0.73 107.32 99.08 1xf2 s GLY 139 Ca 0.28 -0.29 0.03 0.00 0.00 0.00 0.00 44.72 44.74 1xf2 s GLY 139 CO 0.15 -0.08 -0.10 0.00 0.00 0.00 0.00 173.10 173.07 1xf2 s LEU 141 N -0.11 3.20 -0.39 0.00 2.96 -0.15 -1.32 118.68 122.87 1xf2 s LEU 141 Ca 0.02 -0.70 -0.08 0.00 -0.22 0.00 0.00 54.13 53.15 1xf2 s LEU 141 Cb -0.05 -1.72 0.07 0.00 0.50 0.00 0.00 46.19 44.98 1xf2 s LEU 141 CO -0.00 -0.11 0.20 -0.69 -1.32 0.00 0.00 176.35 174.43 1xf2 s VAL 142 N 1.40 4.00 0.03 1.68 1.01 0.65 -0.19 120.40 128.97 1xf2 s VAL 142 Ca 0.02 -1.36 0.08 0.00 0.00 0.00 0.00 61.98 60.72 1xf2 s VAL 142 Cb -0.16 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 1xf2 s VAL 142 CO -0.03 -0.41 -0.23 -0.75 0.00 0.00 0.00 175.10 173.68 1xf2 s LYS 143 N 1.39 1.66 -0.58 2.72 2.20 0.67 -1.13 119.74 126.67 1xf2 s LYS 143 Ca 0.02 -0.96 -0.03 0.00 -0.36 0.00 0.00 55.97 54.63 1xf2 s LYS 143 Cb -0.22 -1.74 0.00 0.00 -1.51 0.00 0.00 37.83 34.36 1xf2 s LYS 143 CO 0.02 0.46 0.51 0.41 -0.36 0.00 0.00 175.35 176.38 1xf2 n GLY 144 N 2.01 0.27 3.65 5.54 0.00 -0.44 -0.76 105.19 115.47 1xf2 n GLY 144 Ca -0.17 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 1xf2 n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1xf2 s TYR 145 N -3.14 2.68 -0.28 1.61 1.13 -1.00 -4.52 117.35 113.83 1xf2 s TYR 145 Ca 0.22 -0.26 -0.24 0.00 -1.41 0.00 0.00 57.07 55.39 1xf2 s TYR 145 Cb -0.10 -1.25 0.10 0.00 -1.10 0.00 0.00 41.96 39.61 1xf2 s TYR 145 CO 0.32 0.59 0.88 0.12 -2.51 0.00 0.00 175.55 174.95 1xf2 s PHE 146 N -2.35 -0.64 0.05 -3.49 5.36 -0.59 -0.07 117.98 116.25 1xf2 s PHE 146 Ca 0.32 1.52 -0.00 0.00 -0.96 0.00 0.00 56.93 57.81 1xf2 s PHE 146 Cb -0.06 0.34 0.01 0.00 -0.34 0.00 0.00 43.02 42.97 1xf2 s PHE 146 CO 0.20 -0.31 0.06 -0.35 -1.46 0.00 0.00 175.22 173.37 1xf2 n PRO 147 N 2.59 0.34 -1.29 10.12 -0.04 -1.26 -0.28 135.00 145.18 1xf2 n PRO 147 Ca -0.14 -0.14 -0.31 0.00 -0.04 0.00 0.00 63.50 62.87 1xf2 n PRO 147 Cb 0.56 -0.05 0.09 0.00 -0.04 0.00 0.00 33.50 34.05 1xf2 n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1xf2 s GLU 148 N -2.76 2.31 0.46 0.54 0.41 -1.26 -4.72 118.70 113.67 1xf2 s GLU 148 Ca 0.04 1.17 0.05 0.00 -0.41 0.00 0.00 54.97 55.82 1xf2 s GLU 148 Cb -0.00 -1.90 0.02 0.00 -1.78 0.00 0.00 34.13 30.46 1xf2 s GLU 148 CO 0.03 -1.60 0.64 -1.25 -0.49 0.00 0.00 175.26 172.58 1xf2 s PRO 149 N -4.88 2.77 0.11 0.39 0.04 -1.26 -4.96 135.00 127.21 1xf2 s PRO 149 Ca 0.61 -1.02 0.06 0.00 0.04 0.00 0.00 61.00 60.69 1xf2 s PRO 149 Cb -0.17 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 1xf2 s PRO 149 CO 0.55 -0.39 -0.02 0.14 0.04 0.00 0.00 177.00 177.32 1xf2 s VAL 150 N -2.48 3.81 -0.05 -0.36 -7.23 -1.26 -4.35 120.40 108.47 1xf2 s VAL 150 Ca 0.54 -1.14 -0.01 0.00 -1.81 0.00 0.00 61.98 59.57 1xf2 s VAL 150 Cb -0.10 -2.83 -0.03 0.00 0.56 0.00 0.00 36.38 33.98 1xf2 s VAL 150 CO 0.35 0.07 0.01 0.42 -0.31 0.00 0.00 175.10 175.64 1xf2 s THR 151 N -1.37 4.32 -0.07 5.32 -4.23 -0.72 -4.97 115.64 113.93 1xf2 s THR 151 Ca 0.25 -0.38 0.03 0.00 -1.18 0.00 0.00 61.69 60.41 1xf2 s THR 151 Cb -0.11 -2.87 0.01 0.00 1.34 0.00 0.00 72.50 70.86 1xf2 s THR 151 CO 0.17 0.50 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.91 1xf2 s VAL 152 N -0.99 1.38 0.35 2.29 1.01 -1.26 -1.65 120.40 121.53 1xf2 s VAL 152 Ca 0.16 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1xf2 s VAL 152 Cb -0.11 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.99 1xf2 s VAL 152 CO 0.06 0.41 0.08 0.42 0.00 0.00 0.00 175.10 176.07 1xf2 s THR 153 N 0.52 0.95 -0.07 3.92 -4.23 -0.46 -4.98 115.64 111.28 1xf2 s THR 153 Ca -0.14 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.39 1xf2 s THR 153 Cb -0.16 -2.63 0.01 0.00 1.34 0.00 0.00 72.50 71.07 1xf2 s THR 153 CO 0.05 0.00 -0.13 0.26 -0.54 0.00 0.00 174.62 174.26 1xf2 s TRP 154 N -3.31 1.55 -1.56 3.99 0.52 -1.26 -0.64 118.94 118.23 1xf2 s TRP 154 Ca 0.32 -0.60 -0.10 0.00 0.02 0.00 0.00 56.10 55.74 1xf2 s TRP 154 Cb 0.07 -1.14 0.08 0.00 -1.15 0.00 0.00 33.47 31.34 1xf2 s TRP 154 CO 0.15 -0.31 0.66 0.09 0.02 0.00 0.00 176.95 177.55 1xf2 n ASN 155 N 3.89 -2.23 -4.19 2.95 4.13 0.25 -1.33 115.26 118.74 1xf2 n ASN 155 Ca -0.22 -0.98 -0.34 0.00 1.68 0.00 0.00 54.58 54.72 1xf2 n ASN 155 Cb 0.52 -3.00 -0.03 0.00 -1.54 0.00 0.00 39.78 35.72 1xf2 n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1xf2 n SER 156 N -2.81 -2.13 0.00 6.41 7.64 -1.26 -1.51 113.62 119.95 1xf2 n SER 156 Ca -0.09 -1.05 0.00 0.00 1.01 0.00 0.00 58.87 58.74 1xf2 n SER 156 Cb 0.58 -2.67 0.00 0.00 -1.01 0.00 0.00 64.21 61.11 1xf2 n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xf2 n GLY 157 N -1.62 1.28 0.21 0.23 0.00 -0.44 -4.92 105.19 99.92 1xf2 n GLY 157 Ca -0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1xf2 n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1xf2 h SER 158 N 0.00 0.00 -3.27 1.61 0.02 -1.21 -3.35 113.55 107.36 1xf2 h SER 158 Ca 0.00 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 60.21 1xf2 h SER 158 Cb 0.00 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 62.30 1xf2 h SER 158 CO 0.00 0.26 -0.33 -0.76 -1.14 0.00 0.00 176.83 174.87 1xf2 s LEU 159 N -6.87 5.71 -0.04 5.07 1.43 -1.09 -4.89 118.68 118.00 1xf2 s LEU 159 Ca 0.00 -1.52 0.01 0.00 -1.03 0.00 0.00 54.13 51.60 1xf2 s LEU 159 Cb 0.10 -2.15 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 1xf2 s LEU 159 CO 0.65 -0.69 -0.02 -1.54 0.23 0.00 0.00 176.35 174.98 1xf2 n SER 160 N 5.15 3.80 -4.88 2.29 3.41 -1.26 -4.31 113.62 117.81 1xf2 n SER 160 Ca -0.12 -0.02 -0.30 0.00 -0.26 0.00 0.00 58.87 58.17 1xf2 n SER 160 Cb 0.42 0.14 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 1xf2 n SER 160 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1xf2 s SER 161 N -4.12 6.54 -0.53 4.04 1.04 -1.26 -3.97 113.70 115.44 1xf2 s SER 161 Ca -0.05 0.94 0.00 0.00 0.48 0.00 0.00 55.95 57.32 1xf2 s SER 161 Cb 0.01 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 63.90 1xf2 s SER 161 CO 0.12 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.72 1xf2 n GLY 162 N -0.81 0.76 3.61 7.32 0.00 -1.26 -4.74 105.19 110.06 1xf2 n GLY 162 Ca 0.01 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 1xf2 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xf2 s VAL 163 N -2.17 4.33 -0.15 1.61 1.01 -1.25 -1.26 120.40 122.52 1xf2 s VAL 163 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.77 1xf2 s VAL 163 Cb 0.00 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.51 1xf2 s VAL 163 CO 0.00 0.52 -0.14 -1.00 0.00 0.00 0.00 175.10 174.48 1xf2 s HIS 164 N -0.06 2.20 -0.25 5.22 3.76 -0.00 -4.99 115.29 121.17 1xf2 s HIS 164 Ca 0.04 -1.25 -0.04 0.00 -0.15 0.00 0.00 55.06 53.66 1xf2 s HIS 164 Cb -0.13 -1.61 0.01 0.00 1.11 0.00 0.00 32.58 31.96 1xf2 s HIS 164 CO 0.02 -0.68 -0.01 0.99 -0.85 0.00 0.00 174.74 174.21 1xf2 s THR 165 N 1.48 3.40 0.10 1.30 2.01 -1.26 0.03 115.64 122.70 1xf2 s THR 165 Ca 0.05 -0.71 -0.20 0.00 0.31 0.00 0.00 61.69 61.13 1xf2 s THR 165 Cb -0.13 -2.67 -0.07 0.00 0.01 0.00 0.00 72.50 69.64 1xf2 s THR 165 CO -0.11 0.25 0.61 -0.36 -0.69 0.00 0.00 174.62 174.32 1xf2 s PHE 166 N 1.44 3.81 0.42 4.92 0.08 -0.19 -5.00 117.98 123.45 1xf2 s PHE 166 Ca 0.03 1.33 -0.26 0.00 0.12 0.00 0.00 56.93 58.15 1xf2 s PHE 166 Cb -0.16 -2.54 -0.10 0.00 -0.57 0.00 0.00 43.02 39.65 1xf2 s PHE 166 CO -0.02 0.56 1.38 -2.30 -0.10 0.00 0.00 175.22 174.74 1xf2 n PRO 167 N 1.61 2.23 -1.97 0.24 -0.02 -1.26 -4.32 135.00 131.50 1xf2 n PRO 167 Ca -0.09 0.79 -0.36 0.00 -2.02 0.00 0.00 63.50 61.82 1xf2 n PRO 167 Cb 0.50 -2.54 0.04 0.00 -0.02 0.00 0.00 33.50 31.49 1xf2 n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xf2 s ALA 168 N -1.17 2.54 -0.01 3.55 0.00 -1.26 -4.85 121.76 120.55 1xf2 s ALA 168 Ca 0.59 1.05 0.06 0.00 0.00 0.00 0.00 51.96 53.67 1xf2 s ALA 168 Cb -0.48 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 19.15 1xf2 s ALA 168 CO 0.59 -1.23 -0.20 0.08 0.00 0.00 0.00 175.76 175.00 1xf2 s VAL 169 N -1.55 1.61 -0.30 0.00 1.01 0.49 -4.92 120.40 116.75 1xf2 s VAL 169 Ca 0.78 -0.89 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 1xf2 s VAL 169 Cb -0.32 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1xf2 s VAL 169 CO 0.35 0.44 0.58 -0.22 0.00 0.00 0.00 175.10 176.24 1xf2 s LEU 170 N -0.52 4.14 -0.11 3.92 2.96 -1.26 -0.75 118.68 127.06 1xf2 s LEU 170 Ca 0.08 0.40 0.01 0.00 -0.22 0.00 0.00 54.13 54.40 1xf2 s LEU 170 Cb -0.08 -2.73 0.02 0.00 0.50 0.00 0.00 46.19 43.90 1xf2 s LEU 170 CO -0.01 -0.42 -0.13 -1.58 -1.32 0.00 0.00 176.35 172.90 1xf2 s GLN 171 N 2.48 2.04 -1.34 1.98 -0.44 0.37 -4.86 119.66 119.88 1xf2 s GLN 171 Ca 0.23 -0.48 -0.10 0.00 -2.50 0.00 0.00 55.36 52.51 1xf2 s GLN 171 Cb -0.15 -1.81 0.00 0.00 -1.64 0.00 0.00 33.01 29.41 1xf2 s GLN 171 CO 0.11 -0.12 0.47 0.43 0.50 0.00 0.00 175.29 176.68 1xf2 n SER 172 N 4.40 -1.75 -0.39 6.67 7.64 -1.26 -1.59 113.62 127.34 1xf2 n SER 172 Ca -0.18 -1.09 -0.05 0.00 1.01 0.00 0.00 58.87 58.56 1xf2 n SER 172 Cb 0.51 -2.71 -0.02 0.00 -1.01 0.00 0.00 64.21 60.98 1xf2 n SER 172 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1xf2 n ASP 173 N -2.79 -5.00 -4.15 6.43 9.92 -1.26 -4.98 116.55 114.72 1xf2 n ASP 173 Ca -0.24 0.12 -0.20 0.00 -0.53 0.00 0.00 54.79 53.95 1xf2 n ASP 173 Cb 0.65 -2.95 -0.13 0.00 -0.64 0.00 0.00 41.12 38.05 1xf2 n ASP 173 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1xf2 s LEU 174 N -1.15 2.19 0.11 0.64 1.43 -0.62 -4.83 118.68 116.45 1xf2 s LEU 174 Ca 0.00 -0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 52.55 1xf2 s LEU 174 Cb 0.00 -0.59 -0.06 0.00 0.03 0.00 0.00 46.19 45.58 1xf2 s LEU 174 CO 0.00 0.01 0.37 -0.31 0.23 0.00 0.00 176.35 176.65 1xf2 s TYR 175 N -0.93 3.51 -0.01 0.29 2.02 0.90 -0.48 117.35 122.64 1xf2 s TYR 175 Ca 0.01 0.61 0.03 0.00 -0.37 0.00 0.00 57.07 57.35 1xf2 s TYR 175 Cb -0.08 -2.04 -0.01 0.00 -0.40 0.00 0.00 41.96 39.43 1xf2 s TYR 175 CO 0.01 0.47 -0.11 0.99 -1.57 0.00 0.00 175.55 175.35 1xf2 s THR 176 N -1.56 0.87 0.02 -0.71 2.01 0.07 -1.32 115.64 115.02 1xf2 s THR 176 Ca 0.38 -0.47 -0.00 0.00 0.31 0.00 0.00 61.69 61.91 1xf2 s THR 176 Cb -0.13 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.63 1xf2 s THR 176 CO 0.22 0.25 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.16 1xf2 s LEU 177 N -0.21 2.17 0.17 4.42 0.20 -0.29 -0.38 118.68 124.76 1xf2 s LEU 177 Ca 0.03 -0.40 0.07 0.00 0.69 0.00 0.00 54.13 54.52 1xf2 s LEU 177 Cb -0.05 0.11 -0.04 0.00 -0.43 0.00 0.00 46.19 45.78 1xf2 s LEU 177 CO -0.00 -0.25 -0.14 -0.94 -0.29 0.00 0.00 176.35 174.72 1xf2 s SER 178 N -1.21 2.31 -0.02 3.68 1.04 -1.26 -0.26 113.70 117.98 1xf2 s SER 178 Ca -0.13 -0.94 0.00 0.00 0.48 0.00 0.00 55.95 55.36 1xf2 s SER 178 Cb -0.08 -0.10 0.03 0.00 0.10 0.00 0.00 66.02 65.96 1xf2 s SER 178 CO -0.01 -0.17 0.01 -0.55 0.98 0.00 0.00 173.24 173.50 1xf2 s SER 179 N -2.97 0.28 0.10 7.02 0.15 -0.44 -1.02 113.70 116.82 1xf2 s SER 179 Ca 0.17 -0.00 0.03 0.00 0.70 0.00 0.00 55.95 56.85 1xf2 s SER 179 Cb -0.02 -0.16 -0.04 0.00 -1.71 0.00 0.00 66.02 64.09 1xf2 s SER 179 CO 0.05 -0.10 0.10 -0.94 1.20 0.00 0.00 173.24 173.54 1xf2 s SER 180 N 0.97 5.56 -0.02 5.45 1.04 0.10 -0.91 113.70 125.90 1xf2 s SER 180 Ca -0.09 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 56.32 1xf2 s SER 180 Cb -0.13 -1.49 0.01 0.00 0.10 0.00 0.00 66.02 64.51 1xf2 s SER 180 CO -0.02 0.15 -0.02 0.54 0.98 0.00 0.00 173.24 174.87 1xf2 s VAL 181 N -1.48 0.24 -0.19 5.02 0.11 0.09 -0.82 120.40 123.37 1xf2 s VAL 181 Ca 0.30 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.30 1xf2 s VAL 181 Cb -0.12 -0.27 0.00 0.00 -1.53 0.00 0.00 36.38 34.46 1xf2 s VAL 181 CO 0.23 0.12 -0.11 -0.89 -3.33 0.00 0.00 175.10 171.11 1xf2 s THR 182 N 0.49 2.84 0.20 5.04 2.01 -0.38 0.21 115.64 126.05 1xf2 s THR 182 Ca -0.05 -0.68 0.07 0.00 0.31 0.00 0.00 61.69 61.33 1xf2 s THR 182 Cb -0.08 -2.25 -0.05 0.00 0.01 0.00 0.00 72.50 70.14 1xf2 s THR 182 CO -0.01 0.48 -0.12 0.68 -0.69 0.00 0.00 174.62 174.97 1xf2 s VAL 183 N 1.23 1.58 0.32 3.82 -7.23 -0.30 -4.71 120.40 115.11 1xf2 s VAL 183 Ca 0.03 -2.16 -0.29 0.00 -1.81 0.00 0.00 61.98 57.74 1xf2 s VAL 183 Cb -0.14 -2.08 -0.12 0.00 0.56 0.00 0.00 36.38 34.61 1xf2 s VAL 183 CO -0.05 -0.57 1.53 -2.65 -0.31 0.00 0.00 175.10 173.05 1xf2 n PRO 184 N -0.37 2.62 0.02 4.82 -0.02 -1.26 -1.06 135.00 139.75 1xf2 n PRO 184 Ca -0.08 0.93 -0.02 0.00 -2.02 0.00 0.00 63.50 62.31 1xf2 n PRO 184 Cb 0.61 -2.67 0.24 0.00 -0.02 0.00 0.00 33.50 31.65 1xf2 n PRO 184 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1xf2 h SER 185 N 3.99 0.46 0.21 2.55 4.64 -1.43 -2.68 113.55 121.29 1xf2 h SER 185 Ca -0.48 -0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 60.67 1xf2 h SER 185 Cb 1.24 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1xf2 h SER 185 CO 0.73 0.67 -0.15 0.28 -0.87 0.00 0.00 176.83 177.49 1xf2 h SER 186 N 0.42 0.00 0.92 4.97 0.02 -1.90 -2.61 113.55 115.37 1xf2 h SER 186 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1xf2 h SER 186 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1xf2 h SER 186 CO 0.04 0.15 -0.07 0.35 -1.14 0.00 0.00 176.83 176.16 1xf2 n THR 187 N -4.11 0.00 -4.92 -2.27 -2.24 -1.01 -4.70 114.28 95.02 1xf2 n THR 187 Ca -0.02 -0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.48 1xf2 n THR 187 Cb 0.23 -0.39 -0.16 0.00 -2.10 0.00 0.00 70.33 67.90 1xf2 n THR 187 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1xf2 s TRP 188 N -2.99 1.95 -1.59 4.78 -0.00 -0.98 -0.79 118.94 119.32 1xf2 s TRP 188 Ca 0.14 -0.67 0.11 0.00 -0.00 0.00 0.00 56.10 55.68 1xf2 s TRP 188 Cb 0.19 -1.33 0.38 0.00 -0.00 0.00 0.00 33.47 32.71 1xf2 s TRP 188 CO 0.55 -0.26 1.26 -0.35 -0.00 0.00 0.00 176.95 178.14 1xf2 n PRO 189 N 3.38 2.26 -0.00 5.86 -0.04 -1.26 -4.93 135.00 140.26 1xf2 n PRO 189 Ca -0.19 -1.50 -0.03 0.00 -0.04 0.00 0.00 63.50 61.74 1xf2 n PRO 189 Cb 0.53 -1.48 0.22 0.00 -0.04 0.00 0.00 33.50 32.72 1xf2 n PRO 189 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xf2 h SER 190 N 2.27 0.51 -3.46 3.54 4.64 -1.82 -3.38 113.55 115.84 1xf2 h SER 190 Ca 0.00 -0.15 -0.62 0.00 -0.47 0.00 0.00 61.79 60.55 1xf2 h SER 190 Cb 0.75 -0.14 -0.15 0.00 -0.31 0.00 0.00 62.40 62.55 1xf2 h SER 190 CO 0.08 0.70 -0.53 -1.61 -0.87 0.00 0.00 176.83 174.60 1xf2 s GLU 191 N -4.66 4.02 0.49 4.77 2.02 0.03 -5.08 118.70 120.28 1xf2 s GLU 191 Ca -0.07 -0.31 -0.20 0.00 0.02 0.00 0.00 54.97 54.41 1xf2 s GLU 191 Cb 0.14 -3.41 -0.08 0.00 0.10 0.00 0.00 34.13 30.88 1xf2 s GLU 191 CO 0.79 0.13 1.04 0.95 0.02 0.00 0.00 175.26 178.19 1xf2 s THR 192 N 0.81 3.78 -0.12 3.63 -4.23 -1.26 -4.57 115.64 113.68 1xf2 s THR 192 Ca 0.06 1.11 -0.00 0.00 -1.18 0.00 0.00 61.69 61.67 1xf2 s THR 192 Cb -0.13 -3.45 0.03 0.00 1.34 0.00 0.00 72.50 70.29 1xf2 s THR 192 CO 0.02 -0.24 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.11 1xf2 s VAL 193 N -1.97 1.01 -0.07 2.29 1.01 -1.26 -4.98 120.40 116.42 1xf2 s VAL 193 Ca 0.67 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 62.36 1xf2 s VAL 193 Cb -0.16 -1.06 0.01 0.00 0.00 0.00 0.00 36.38 35.16 1xf2 s VAL 193 CO 0.20 0.32 -0.18 -0.89 0.00 0.00 0.00 175.10 174.56 1xf2 s THR 194 N 1.71 1.55 -0.06 3.92 2.01 -1.26 -0.56 115.64 122.94 1xf2 s THR 194 Ca 0.04 -0.73 -0.12 0.00 0.31 0.00 0.00 61.69 61.19 1xf2 s THR 194 Cb -0.13 -1.36 -0.05 0.00 0.01 0.00 0.00 72.50 70.97 1xf2 s THR 194 CO -0.08 0.45 0.31 0.00 -0.69 0.00 0.00 174.62 174.61 1xf2 s ASN 196 N -0.76 4.37 -0.10 0.00 -0.87 0.19 -1.26 114.94 116.50 1xf2 s ASN 196 Ca 0.20 -0.53 0.02 0.00 -1.57 0.00 0.00 52.86 50.98 1xf2 s ASN 196 Cb -0.15 -1.74 -0.01 0.00 -0.02 0.00 0.00 41.25 39.34 1xf2 s ASN 196 CO 0.09 -0.06 -0.18 -0.69 -2.57 0.00 0.00 177.10 173.68 1xf2 s VAL 197 N 1.45 2.59 -0.06 1.60 1.01 -0.06 -1.36 120.40 125.57 1xf2 s VAL 197 Ca 0.04 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.22 1xf2 s VAL 197 Cb -0.15 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.19 1xf2 s VAL 197 CO -0.03 0.55 -0.18 0.00 0.00 0.00 0.00 175.10 175.44 1xf2 s ALA 198 N 0.20 1.62 -0.49 5.51 0.00 -0.66 -0.86 121.76 127.07 1xf2 s ALA 198 Ca -0.11 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.18 1xf2 s ALA 198 Cb -0.16 -0.58 0.13 0.00 0.00 0.00 0.00 23.12 22.51 1xf2 s ALA 198 CO 0.06 0.25 0.26 -1.58 0.00 0.00 0.00 175.76 174.75 1xf2 s HIS 199 N 0.22 2.71 0.52 0.00 2.46 0.73 -1.75 115.29 120.19 1xf2 s HIS 199 Ca -0.09 -2.88 0.16 0.00 0.47 0.00 0.00 55.06 52.72 1xf2 s HIS 199 Cb -0.14 -2.44 1.28 0.00 -0.13 0.00 0.00 32.58 31.16 1xf2 s HIS 199 CO 0.04 -0.75 2.15 -1.35 -2.47 0.00 0.00 174.74 172.36 1xf2 h PRO 200 N 6.54 0.00 -0.16 2.88 0.11 -1.79 -2.21 132.00 137.37 1xf2 h PRO 200 Ca -0.04 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.96 1xf2 h PRO 200 Cb 0.90 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1xf2 h PRO 200 CO 0.61 0.00 -0.35 0.00 -0.21 0.00 0.00 178.00 178.04 1xf2 h ALA 201 N 2.00 1.10 -0.65 -0.75 0.00 -1.91 -2.54 119.26 116.50 1xf2 h ALA 201 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1xf2 h ALA 201 Cb 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1xf2 h ALA 201 CO -0.00 0.57 0.00 -1.13 0.00 0.00 0.00 179.25 178.69 1xf2 n SER 202 N -4.06 3.74 -4.17 0.00 3.41 -0.98 -4.96 113.62 106.58 1xf2 n SER 202 Ca -0.01 -2.09 -0.42 0.00 -0.26 0.00 0.00 58.87 56.09 1xf2 n SER 202 Cb 0.45 -0.47 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 1xf2 n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1xf2 n SER 203 N 1.36 -2.36 -4.22 4.04 7.64 -0.96 -4.97 113.62 114.15 1xf2 n SER 203 Ca 0.23 -1.30 -0.29 0.00 1.01 0.00 0.00 58.87 58.51 1xf2 n SER 203 Cb 0.62 -1.59 -0.16 0.00 -1.01 0.00 0.00 64.21 62.06 1xf2 n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xf2 s THR 204 N -3.83 1.82 -0.02 0.44 2.01 -0.87 -5.02 115.64 110.18 1xf2 s THR 204 Ca 0.33 -0.94 0.05 0.00 0.31 0.00 0.00 61.69 61.44 1xf2 s THR 204 Cb -0.18 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 70.77 1xf2 s THR 204 CO 0.99 0.51 -0.17 -0.54 -0.69 0.00 0.00 174.62 174.72 1xf2 s LYS 205 N -0.12 1.39 -0.06 4.92 1.02 -1.26 -0.19 119.74 125.44 1xf2 s LYS 205 Ca -0.03 -0.59 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1xf2 s LYS 205 Cb -0.13 -1.33 0.02 0.00 -0.52 0.00 0.00 37.83 35.88 1xf2 s LYS 205 CO 0.03 0.35 -0.03 0.08 -0.92 0.00 0.00 175.35 174.85 1xf2 s VAL 206 N -0.34 0.51 -0.20 3.17 1.01 -0.04 -5.00 120.40 119.51 1xf2 s VAL 206 Ca 0.05 -0.06 -0.07 0.00 0.00 0.00 0.00 61.98 61.90 1xf2 s VAL 206 Cb -0.07 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1xf2 s VAL 206 CO -0.00 0.24 0.05 -1.81 0.00 0.00 0.00 175.10 173.58 1xf2 s ASP 207 N 1.25 5.34 -0.25 3.32 -0.00 -1.26 -0.88 116.67 124.18 1xf2 s ASP 207 Ca -0.06 -0.04 0.01 0.00 -0.00 0.00 0.00 52.55 52.46 1xf2 s ASP 207 Cb -0.14 -1.92 0.07 0.00 -0.00 0.00 0.00 42.92 40.93 1xf2 s ASP 207 CO -0.02 0.11 -0.03 -0.75 -0.00 0.00 0.00 175.17 174.48 1xf2 s LYS 208 N 0.76 1.48 0.23 8.23 2.47 -0.39 -4.98 119.74 127.54 1xf2 s LYS 208 Ca 0.03 -1.05 -0.30 0.00 -1.56 0.00 0.00 55.97 53.08 1xf2 s LYS 208 Cb -0.14 -2.57 -0.09 0.00 -1.46 0.00 0.00 37.83 33.58 1xf2 s LYS 208 CO 0.02 -0.67 1.19 0.21 0.16 0.00 0.00 175.35 176.27 1xf2 s LYS 209 N 1.39 4.51 -0.27 4.03 2.20 -1.26 -1.26 119.74 129.08 1xf2 s LYS 209 Ca -0.03 1.91 -0.19 0.00 -0.36 0.00 0.00 55.97 57.31 1xf2 s LYS 209 Cb -0.19 -3.20 -0.02 0.00 -1.51 0.00 0.00 37.83 32.91 1xf2 s LYS 209 CO -0.08 -0.03 0.57 0.42 -0.36 0.00 0.00 175.35 175.86 1xf2 s ILE 210 N -0.48 5.02 0.18 5.43 -1.09 0.28 -4.96 121.20 125.58 1xf2 s ILE 210 Ca 0.50 0.95 0.10 0.00 -2.23 0.00 0.00 60.65 59.98 1xf2 s ILE 210 Cb -0.34 -3.89 -0.04 0.00 -1.58 0.00 0.00 42.46 36.61 1xf2 s ILE 210 CO 0.40 0.03 -0.18 0.68 -1.23 0.00 0.00 174.94 174.65 1xf2 s VAL 211 N 2.41 2.73 0.49 2.92 -7.23 -1.26 -4.61 120.40 115.85 1xf2 s VAL 211 Ca 0.23 -1.83 -0.23 0.00 -1.81 0.00 0.00 61.98 58.34 1xf2 s VAL 211 Cb -0.15 -2.32 -0.07 0.00 0.56 0.00 0.00 36.38 34.39 1xf2 s VAL 211 CO 0.09 -0.09 1.28 -2.65 -0.31 0.00 0.00 175.10 173.42 1xf2 n PRO 212 N 0.22 1.74 0.00 4.82 -0.02 -1.26 -4.78 135.00 135.73 1xf2 n PRO 212 Ca -0.12 0.63 0.05 0.00 -2.02 0.00 0.00 63.50 62.04 1xf2 n PRO 212 Cb 0.55 -2.45 0.27 0.00 -0.02 0.00 0.00 33.50 31.86 1xf2 n PRO 212 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02