#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f1h s VAL 3 N 0.00 0.01 -0.09 0.00 1.01 -1.26 -4.08 120.40 115.99 3f1h s VAL 3 Ca 0.00 -0.10 -0.20 0.00 0.00 0.00 0.00 61.98 61.67 3f1h s VAL 3 Cb 0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 3f1h s VAL 3 CO 0.00 -0.06 0.57 -0.75 0.00 0.00 0.00 175.10 174.87 3f1h s LYS 4 N -0.14 4.37 0.04 2.72 2.20 -0.27 -4.93 119.74 123.74 3f1h s LYS 4 Ca -0.03 0.64 0.00 0.00 -0.36 0.00 0.00 55.97 56.23 3f1h s LYS 4 Cb -0.03 -3.43 0.01 0.00 -1.51 0.00 0.00 37.83 32.87 3f1h s LYS 4 CO 0.01 0.14 0.06 1.63 -0.36 0.00 0.00 175.35 176.83 3f1h n LYS 5 N 3.62 0.73 -3.72 4.03 4.01 -1.26 -2.45 118.16 123.12 3f1h n LYS 5 Ca -0.05 -0.19 -0.12 0.00 -0.51 0.00 0.00 58.31 57.45 3f1h n LYS 5 Cb 0.51 -0.03 -0.11 0.00 -0.51 0.00 0.00 35.03 34.89 3f1h n LYS 5 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 3f1h s PHE 6 N 0.31 -0.50 0.28 2.13 0.40 -1.26 -4.94 117.98 114.40 3f1h s PHE 6 Ca 0.04 1.13 -0.30 0.00 -0.60 0.00 0.00 56.93 57.20 3f1h s PHE 6 Cb -0.00 0.19 -0.10 0.00 0.51 0.00 0.00 43.02 43.62 3f1h s PHE 6 CO 0.03 -0.27 1.45 0.21 0.70 0.00 0.00 175.22 177.34 3f1h s LYS 7 N 0.88 4.24 -1.13 0.44 2.20 -1.26 -4.60 119.74 120.50 3f1h s LYS 7 Ca -0.05 2.37 -0.22 0.00 -0.36 0.00 0.00 55.97 57.70 3f1h s LYS 7 Cb -0.06 -3.07 -0.09 0.00 -1.51 0.00 0.00 37.83 33.10 3f1h s LYS 7 CO -0.07 -0.44 1.92 -0.35 -0.36 0.00 0.00 175.35 176.05 3f1h n PRO 8 N 1.90 1.71 -0.05 4.03 -0.04 -1.26 -4.60 135.00 136.70 3f1h n PRO 8 Ca 0.05 -2.43 0.11 0.00 -0.04 0.00 0.00 63.50 61.19 3f1h n PRO 8 Cb 0.40 -3.58 0.45 0.00 -0.04 0.00 0.00 33.50 30.73 3f1h n PRO 8 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 3f1h n TYR 9 N 12.75 0.14 -3.64 0.54 4.11 -1.26 -4.80 117.16 124.99 3f1h n TYR 9 Ca 0.46 -0.07 -0.07 0.00 -0.00 0.00 0.00 57.90 58.22 3f1h n TYR 9 Cb 0.45 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.72 3f1h n TYR 9 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.86 176.78 3f1h s THR 10 N -1.86 0.00 1.29 -3.48 -1.32 -1.26 -5.13 115.64 103.87 3f1h s THR 10 Ca 0.32 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.62 3f1h s THR 10 Cb 0.17 -1.00 0.32 0.00 -1.51 0.00 0.00 72.50 70.48 3f1h s THR 10 CO 0.26 0.00 0.99 -2.16 -2.21 0.00 0.00 174.62 171.49 3f1h s PRO 11 N 0.23 -1.87 -1.41 7.08 0.04 -1.26 -2.87 135.00 134.93 3f1h s PRO 11 Ca 0.04 0.45 -0.04 0.00 0.04 0.00 0.00 61.00 61.49 3f1h s PRO 11 Cb -0.05 -1.47 0.00 0.00 0.04 0.00 0.00 34.50 33.02 3f1h s PRO 11 CO -0.09 -4.26 0.35 -1.13 0.04 0.00 0.00 177.00 171.91 3f1h n SER 12 N -5.24 -0.61 0.00 6.66 3.41 -1.26 -4.45 113.62 112.13 3f1h n SER 12 Ca 0.07 -1.10 0.00 0.00 -0.26 0.00 0.00 58.87 57.58 3f1h n SER 12 Cb 0.57 -2.58 0.00 0.00 -0.26 0.00 0.00 64.21 61.94 3f1h n SER 12 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3f1h n ARG 13 N -4.48 0.00 0.02 4.33 3.00 -1.14 -4.54 116.66 113.85 3f1h n ARG 13 Ca -0.29 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 57.67 3f1h n ARG 13 Cb 0.67 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 33.05 3f1h n ARG 13 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 3f1h n ARG 14 N 0.00 0.46 -0.04 -0.14 1.85 -1.17 -4.30 116.66 113.33 3f1h n ARG 14 Ca 0.00 -0.07 -0.02 0.00 -1.00 0.00 0.00 57.85 56.76 3f1h n ARG 14 Cb 0.00 -1.58 -0.09 0.00 -1.05 0.00 0.00 32.46 29.74 3f1h n ARG 14 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3f1h n PHE 15 N -2.14 0.00 -1.57 2.89 3.01 -1.26 -4.81 117.46 113.59 3f1h n PHE 15 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.03 3f1h n PHE 15 Cb 0.50 -0.46 0.01 0.00 -0.01 0.00 0.00 39.48 39.51 3f1h n PHE 15 CO 0.00 0.00 0.00 -0.12 1.01 0.00 0.00 176.76 177.65 3f1h n MET 16 N -2.26 1.12 -3.85 -1.08 1.56 -1.26 -4.78 117.12 106.57 3f1h n MET 16 Ca -0.13 0.40 -0.11 0.00 -0.27 0.00 0.00 57.70 57.59 3f1h n MET 16 Cb 0.69 -1.87 -0.09 0.00 2.15 0.00 0.00 33.22 34.10 3f1h n MET 16 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 3f1h s THR 17 N -1.29 0.10 0.00 1.12 -4.23 -0.77 -4.17 115.64 106.40 3f1h s THR 17 Ca 0.63 -0.81 -0.00 0.00 -1.18 0.00 0.00 61.69 60.33 3f1h s THR 17 Cb -0.59 -0.74 -0.00 0.00 1.34 0.00 0.00 72.50 72.50 3f1h s THR 17 CO 0.57 -0.44 -0.00 0.54 -0.54 0.00 0.00 174.62 174.75 3f1h s VAL 18 N -2.10 0.02 0.61 2.29 0.11 -1.03 -3.81 120.40 116.49 3f1h s VAL 18 Ca -0.09 -0.17 -0.18 0.00 -2.93 0.00 0.00 61.98 58.61 3f1h s VAL 18 Cb -0.03 -0.06 -0.03 0.00 -1.53 0.00 0.00 36.38 34.73 3f1h s VAL 18 CO -0.01 -0.09 1.17 0.00 -3.33 0.00 0.00 175.10 172.83 3f1h s ALA 19 N -0.27 2.53 -0.19 1.54 0.00 -1.26 -1.11 121.76 122.99 3f1h s ALA 19 Ca -0.03 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 52.49 3f1h s ALA 19 Cb -0.02 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 3f1h s ALA 19 CO -0.00 -1.15 1.24 0.16 0.00 0.00 0.00 175.76 176.01 3f1h s ASP 20 N -1.88 6.92 -0.15 0.00 -4.77 -1.26 -4.77 116.67 110.76 3f1h s ASP 20 Ca 0.74 1.58 0.01 0.00 -3.30 0.00 0.00 52.55 51.58 3f1h s ASP 20 Cb -0.26 -2.54 0.20 0.00 -1.09 0.00 0.00 42.92 39.23 3f1h s ASP 20 CO 0.34 -0.80 1.38 0.49 0.70 0.00 0.00 175.17 177.28 3f1h n PHE 21 N 6.73 0.96 -0.15 2.11 3.01 -1.26 -3.98 117.46 124.88 3f1h n PHE 21 Ca 0.14 -1.01 -0.09 0.00 1.01 0.00 0.00 57.45 57.50 3f1h n PHE 21 Cb 0.45 -0.51 0.04 0.00 -0.01 0.00 0.00 39.48 39.46 3f1h n PHE 21 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3f1h h SER 22 N 0.43 0.95 -0.10 4.37 4.64 -2.02 -2.78 113.55 119.05 3f1h h SER 22 Ca 0.20 -0.33 0.03 0.00 -0.47 0.00 0.00 61.79 61.22 3f1h h SER 22 Cb 1.50 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3f1h h SER 22 CO 0.36 1.09 0.10 -0.08 -0.87 0.00 0.00 176.83 177.43 3f1h h GLU 23 N 0.83 0.00 -6.37 4.77 4.22 -1.96 -3.40 114.58 112.67 3f1h h GLU 23 Ca 0.12 0.00 -0.57 0.00 0.08 0.00 0.00 59.36 58.99 3f1h h GLU 23 Cb 0.71 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 3f1h h GLU 23 CO 0.05 0.00 1.18 0.42 -2.18 0.00 0.00 179.01 178.48 3f1h s ILE 24 N -4.73 3.67 -0.91 2.32 1.01 -1.05 -4.75 121.20 116.76 3f1h s ILE 24 Ca -0.05 0.69 -0.26 0.00 0.00 0.00 0.00 60.65 61.03 3f1h s ILE 24 Cb 0.16 -3.87 -0.16 0.00 0.01 0.00 0.00 42.46 38.60 3f1h s ILE 24 CO 0.58 -0.53 2.26 0.28 0.00 0.00 0.00 174.94 177.52 3f1h s THR 25 N 6.12 3.08 0.00 2.92 -1.32 -0.82 -4.59 115.64 121.03 3f1h s THR 25 Ca 0.72 -0.09 0.00 0.00 -1.21 0.00 0.00 61.69 61.11 3f1h s THR 25 Cb -0.19 -3.48 0.00 0.00 -1.51 0.00 0.00 72.50 67.31 3f1h s THR 25 CO 0.33 -0.15 0.00 0.29 -2.21 0.00 0.00 174.62 172.88 3f1h n LYS 26 N 8.59 0.00 -2.95 7.08 5.02 -1.26 -4.65 118.16 129.99 3f1h n LYS 26 Ca 0.44 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.76 3f1h n LYS 26 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.46 3f1h n LYS 26 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3f1h s THR 27 N 0.00 -0.42 0.01 -0.18 -1.32 -1.26 -5.04 115.64 107.42 3f1h s THR 27 Ca 0.00 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.37 3f1h s THR 27 Cb 0.00 -0.10 -0.06 0.00 -1.51 0.00 0.00 72.50 70.83 3f1h s THR 27 CO 0.00 0.00 0.89 -0.08 -2.21 0.00 0.00 174.62 173.22 3f1h h GLU 28 N 6.22 -0.39 -6.89 7.08 4.22 -1.99 -3.43 114.58 119.41 3f1h h GLU 28 Ca -0.03 0.03 -0.54 0.00 0.08 0.00 0.00 59.36 58.89 3f1h h GLU 28 Cb 1.21 0.09 0.11 0.00 0.50 0.00 0.00 28.75 30.65 3f1h h GLU 28 CO -0.03 -0.26 0.76 -2.30 -2.18 0.00 0.00 179.01 175.00 3f1h n PRO 29 N -3.39 2.62 -2.15 0.92 -0.02 -1.26 -4.90 135.00 126.82 3f1h n PRO 29 Ca -0.05 0.92 -0.27 0.00 -2.02 0.00 0.00 63.50 62.08 3f1h n PRO 29 Cb 0.16 -2.65 0.10 0.00 -0.02 0.00 0.00 33.50 31.09 3f1h n PRO 29 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3f1h s GLU 30 N -1.82 1.76 -1.26 -0.52 0.41 -1.26 -4.93 118.70 111.08 3f1h s GLU 30 Ca 0.55 -0.35 -0.19 0.00 -0.41 0.00 0.00 54.97 54.58 3f1h s GLU 30 Cb -0.49 -2.09 0.06 0.00 -1.78 0.00 0.00 34.13 29.83 3f1h s GLU 30 CO 0.61 -1.58 1.72 0.21 -0.49 0.00 0.00 175.26 175.74 3f1h s LYS 31 N -5.42 3.84 0.44 1.61 2.47 -1.26 -4.80 119.74 116.62 3f1h s LYS 31 Ca 0.64 -1.83 0.33 0.00 -1.56 0.00 0.00 55.97 53.56 3f1h s LYS 31 Cb -0.09 -5.50 1.50 0.00 -1.46 0.00 0.00 37.83 32.28 3f1h s LYS 31 CO 0.47 -2.37 1.55 0.45 0.16 0.00 0.00 175.35 175.61 3f1h n SER 32 N 8.87 0.20 -3.24 1.43 2.88 -1.26 -3.58 113.62 118.92 3f1h n SER 32 Ca 0.47 1.35 -0.09 0.00 -1.33 0.00 0.00 58.87 59.27 3f1h n SER 32 Cb 0.47 -0.66 0.09 0.00 -0.75 0.00 0.00 64.21 63.35 3f1h n SER 32 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3f1h n LEU 33 N -4.65 0.00 -4.03 2.46 -0.00 -1.26 -4.22 117.00 105.30 3f1h n LEU 33 Ca 0.40 -0.26 -0.11 0.00 -0.00 0.00 0.00 56.01 56.04 3f1h n LEU 33 Cb 1.58 -0.41 -0.05 0.00 -0.00 0.00 0.00 43.42 44.55 3f1h n LEU 33 CO 0.20 -1.91 0.95 0.55 -0.00 0.00 0.00 177.39 177.17 3f1h n VAL 34 N -3.63 0.00 0.14 1.47 3.14 -1.26 -3.37 118.33 114.82 3f1h n VAL 34 Ca 0.04 -0.31 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 3f1h n VAL 34 Cb 0.18 -0.76 0.00 0.00 -1.06 0.00 0.00 33.84 32.20 3f1h n VAL 34 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 3f1h n LYS 35 N 5.57 0.00 -2.02 1.45 4.01 -1.23 -4.91 118.16 121.02 3f1h n LYS 35 Ca 0.17 0.00 -0.28 0.00 -0.51 0.00 0.00 58.31 57.69 3f1h n LYS 35 Cb 0.41 0.00 0.07 0.00 -0.51 0.00 0.00 35.03 35.00 3f1h n LYS 35 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 3f1h s PRO 36 N -2.00 2.22 -0.29 1.97 0.02 -1.22 -0.03 135.00 135.68 3f1h s PRO 36 Ca 0.00 0.05 -0.25 0.00 0.02 0.00 0.00 61.00 60.81 3f1h s PRO 36 Cb 0.00 -2.04 0.17 0.00 0.02 0.00 0.00 34.50 32.64 3f1h s PRO 36 CO 0.00 -1.36 1.30 -1.17 -0.33 0.00 0.00 177.00 175.44 3f1h s LEU 37 N -5.41 -0.19 0.75 -5.54 2.96 -0.95 -4.92 118.68 105.39 3f1h s LEU 37 Ca 0.60 0.35 -0.15 0.00 -0.22 0.00 0.00 54.13 54.71 3f1h s LEU 37 Cb -0.11 1.37 0.03 0.00 0.50 0.00 0.00 46.19 47.99 3f1h s LEU 37 CO 0.48 -0.07 1.06 2.29 -1.32 0.00 0.00 176.35 178.79 3f1h n LYS 38 N 1.71 0.43 -4.01 1.98 2.85 -1.26 -1.96 118.16 117.90 3f1h n LYS 38 Ca -0.10 0.21 -0.09 0.00 -1.05 0.00 0.00 58.31 57.28 3f1h n LYS 38 Cb 0.57 -2.32 -0.09 0.00 -0.65 0.00 0.00 35.03 32.54 3f1h n LYS 38 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 3f1h s LYS 39 N -3.62 0.86 0.13 -1.58 2.20 -1.26 -4.75 119.74 111.71 3f1h s LYS 39 Ca 0.74 -1.19 -0.25 0.00 -0.36 0.00 0.00 55.97 54.91 3f1h s LYS 39 Cb -0.32 0.29 0.07 0.00 -1.51 0.00 0.00 37.83 36.35 3f1h s LYS 39 CO 0.50 -0.25 0.85 0.99 -0.36 0.00 0.00 175.35 177.08 3f1h s THR 40 N -3.94 0.00 0.00 3.43 2.01 -1.26 -4.95 115.64 110.92 3f1h s THR 40 Ca 0.13 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.69 3f1h s THR 40 Cb 0.06 -1.58 0.00 0.00 0.01 0.00 0.00 72.50 70.99 3f1h s THR 40 CO -0.05 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.49 3f1h n GLY 41 N -0.39 -0.35 0.07 4.40 0.00 -1.26 -5.03 105.19 102.63 3f1h n GLY 41 Ca -0.08 -1.01 0.13 0.00 0.00 0.00 0.00 46.02 45.06 3f1h n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1h n GLY 42 N 2.01 -1.09 3.76 -0.02 0.00 -1.26 -4.98 105.19 103.60 3f1h n GLY 42 Ca 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 46.02 45.66 3f1h n GLY 42 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3f1h s ARG 43 N -2.83 1.05 0.00 1.61 1.70 -1.26 -4.79 118.95 114.42 3f1h s ARG 43 Ca 0.16 -0.60 0.00 0.00 -0.47 0.00 0.00 55.73 54.82 3f1h s ARG 43 Cb 0.18 0.34 0.00 0.00 -0.57 0.00 0.00 34.95 34.90 3f1h s ARG 43 CO 0.62 -0.48 0.00 0.27 -1.08 0.00 0.00 175.30 174.63 3f1h n ASN 44 N -0.65 -1.22 0.15 -2.89 6.94 -0.92 -4.96 115.26 111.71 3f1h n ASN 44 Ca -0.06 -0.14 0.09 0.00 -0.02 0.00 0.00 54.58 54.46 3f1h n ASN 44 Cb 0.61 0.00 0.06 0.00 -2.36 0.00 0.00 39.78 38.09 3f1h n ASN 44 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 3f1h h ASN 45 N -1.22 0.00 -4.21 0.53 7.08 -2.03 -3.41 115.58 112.33 3f1h h ASN 45 Ca 0.00 0.00 -0.46 0.00 -3.08 0.00 0.00 56.30 52.76 3f1h h ASN 45 Cb 0.00 0.00 0.12 0.00 -2.08 0.00 0.00 38.32 36.36 3f1h h ASN 45 CO 0.00 0.15 0.39 -1.10 -2.08 0.00 0.00 177.43 174.79 3f1h s GLN 46 N -3.18 1.45 0.00 4.14 -0.21 -1.26 -4.95 119.66 115.65 3f1h s GLN 46 Ca 0.03 -0.18 0.27 0.00 0.02 0.00 0.00 55.36 55.50 3f1h s GLN 46 Cb 0.07 -1.94 1.60 0.00 1.00 0.00 0.00 33.01 33.74 3f1h s GLN 46 CO 0.74 -1.88 1.96 0.41 -2.12 0.00 0.00 175.29 174.40 3f1h n GLY 47 N -3.44 -0.87 3.78 3.09 0.00 -1.26 -4.88 105.19 101.61 3f1h n GLY 47 Ca 0.11 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 3f1h n GLY 47 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f1h s ARG 48 N -2.00 3.70 0.24 1.61 1.81 -1.26 -4.83 118.95 118.21 3f1h s ARG 48 Ca 0.40 1.54 -0.30 0.00 -1.72 0.00 0.00 55.73 55.65 3f1h s ARG 48 Cb 0.18 -2.18 -0.09 0.00 -0.45 0.00 0.00 34.95 32.41 3f1h s ARG 48 CO 0.31 -0.55 1.05 0.42 -0.68 0.00 0.00 175.30 175.85 3f1h s ILE 49 N -1.79 3.77 0.00 1.52 1.01 -1.26 -2.18 121.20 122.27 3f1h s ILE 49 Ca 0.67 1.71 0.00 0.00 0.00 0.00 0.00 60.65 63.03 3f1h s ILE 49 Cb -0.22 -4.09 0.00 0.00 0.01 0.00 0.00 42.46 38.16 3f1h s ILE 49 CO 0.26 0.38 0.42 0.35 0.00 0.00 0.00 174.94 176.34 3f1h n THR 50 N 1.58 0.17 -3.58 2.92 -2.24 -1.26 -4.88 114.28 106.99 3f1h n THR 50 Ca -0.00 -0.31 -0.22 0.00 -2.27 0.00 0.00 64.05 61.25 3f1h n THR 50 Cb 0.46 1.25 -0.16 0.00 -2.10 0.00 0.00 70.33 69.79 3f1h n THR 50 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3f1h s VAL 51 N -0.17 -0.19 0.86 2.28 1.01 -1.26 -5.06 120.40 117.87 3f1h s VAL 51 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 61.98 61.84 3f1h s VAL 51 Cb 0.00 -0.54 0.11 0.00 0.00 0.00 0.00 36.38 35.95 3f1h s VAL 51 CO 0.00 -0.17 1.12 -0.13 0.00 0.00 0.00 175.10 175.92 3f1h s ARG 52 N 2.22 1.48 -1.26 2.72 0.52 -1.26 -4.02 118.95 119.34 3f1h s ARG 52 Ca 0.04 1.36 -0.05 0.00 -0.52 0.00 0.00 55.73 56.56 3f1h s ARG 52 Cb -0.15 -1.79 0.01 0.00 0.52 0.00 0.00 34.95 33.53 3f1h s ARG 52 CO -0.09 -2.25 0.70 1.19 0.02 0.00 0.00 175.30 174.86 3f1h n PHE 53 N -3.96 -1.96 -3.76 -0.53 3.72 -1.26 -4.98 117.46 104.73 3f1h n PHE 53 Ca 0.10 0.60 -0.22 0.00 -0.05 0.00 0.00 57.45 57.88 3f1h n PHE 53 Cb 0.53 -4.15 -0.04 0.00 -0.94 0.00 0.00 39.48 34.87 3f1h n PHE 53 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3f1h s ARG 54 N -5.74 2.50 0.00 -1.08 1.81 -1.26 -1.88 118.95 113.31 3f1h s ARG 54 Ca 0.34 -1.54 0.00 0.00 -1.72 0.00 0.00 55.73 52.82 3f1h s ARG 54 Cb -0.15 -2.31 0.00 0.00 -0.45 0.00 0.00 34.95 32.04 3f1h s ARG 54 CO 0.43 -0.09 0.00 0.41 -0.68 0.00 0.00 175.30 175.37 3f1h n GLY 55 N -1.42 1.98 0.11 -3.53 0.00 -1.06 -4.68 105.19 96.59 3f1h n GLY 55 Ca 0.01 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.99 3f1h n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1h n GLY 56 N 0.74 2.96 0.25 -0.02 0.00 -1.26 -4.13 105.19 103.73 3f1h n GLY 56 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 3f1h n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1h n GLY 57 N 0.00 0.02 3.04 -0.02 0.00 -1.26 -4.83 105.19 102.15 3f1h n GLY 57 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 3f1h n GLY 57 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3f1h s HIS 58 N 0.00 -1.26 0.00 1.61 5.65 -1.24 -4.59 115.29 115.45 3f1h s HIS 58 Ca 0.00 0.04 0.00 0.00 0.25 0.00 0.00 55.06 55.35 3f1h s HIS 58 Cb 0.00 0.06 0.00 0.00 -1.18 0.00 0.00 32.58 31.46 3f1h s HIS 58 CO 0.00 -1.09 0.00 1.17 -0.65 0.00 0.00 174.74 174.17 3f1h n LYS 59 N 4.57 0.00 -4.51 2.88 4.81 -1.26 -4.92 118.16 119.73 3f1h n LYS 59 Ca 0.09 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.30 3f1h n LYS 59 Cb 0.52 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 35.41 3f1h n LYS 59 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3f1h s ARG 60 N 0.00 1.55 0.06 1.64 0.52 -1.26 -5.11 118.95 116.34 3f1h s ARG 60 Ca 0.00 -0.36 -0.25 0.00 -0.52 0.00 0.00 55.73 54.60 3f1h s ARG 60 Cb 0.00 -1.31 -0.06 0.00 0.52 0.00 0.00 34.95 34.11 3f1h s ARG 60 CO 0.00 0.01 0.77 -0.51 0.02 0.00 0.00 175.30 175.58 3f1h s LEU 61 N 0.72 4.46 -0.25 2.53 2.01 -1.26 -4.34 118.68 122.55 3f1h s LEU 61 Ca -0.14 1.47 -0.16 0.00 0.01 0.00 0.00 54.13 55.31 3f1h s LEU 61 Cb -0.16 -3.24 -0.03 0.00 0.01 0.00 0.00 46.19 42.77 3f1h s LEU 61 CO 0.03 0.03 0.43 -0.47 1.01 0.00 0.00 176.35 177.39 3f1h s TYR 62 N -0.17 3.28 -0.09 0.29 6.14 -0.83 -4.86 117.35 121.11 3f1h s TYR 62 Ca 0.38 0.54 -0.21 0.00 0.64 0.00 0.00 57.07 58.42 3f1h s TYR 62 Cb -0.21 -2.62 -0.04 0.00 0.42 0.00 0.00 41.96 39.51 3f1h s TYR 62 CO 0.23 -0.21 0.61 1.03 0.64 0.00 0.00 175.55 177.85 3f1h s ARG 63 N 2.02 4.39 -0.12 4.97 3.00 -1.26 -2.23 118.95 129.72 3f1h s ARG 63 Ca 0.18 0.69 -0.29 0.00 0.00 0.00 0.00 55.73 56.31 3f1h s ARG 63 Cb -0.16 -3.45 -0.01 0.00 0.00 0.00 0.00 34.95 31.33 3f1h s ARG 63 CO 0.09 0.08 1.00 0.42 0.00 0.00 0.00 175.30 176.89 3f1h s ILE 64 N 0.79 4.78 -0.12 1.52 1.01 0.96 -4.98 121.20 125.16 3f1h s ILE 64 Ca 0.32 2.02 -0.08 0.00 0.00 0.00 0.00 60.65 62.91 3f1h s ILE 64 Cb -0.17 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 37.96 3f1h s ILE 64 CO 0.14 -0.01 0.16 -0.63 0.00 0.00 0.00 174.94 174.61 3f1h s ILE 65 N 2.09 5.47 -0.90 2.92 -1.09 -1.26 -4.11 121.20 124.31 3f1h s ILE 65 Ca 0.47 0.25 -0.24 0.00 -2.23 0.00 0.00 60.65 58.90 3f1h s ILE 65 Cb -0.18 -3.43 0.02 0.00 -1.58 0.00 0.00 42.46 37.29 3f1h s ILE 65 CO 0.17 0.59 1.58 -0.62 -1.23 0.00 0.00 174.94 175.43 3f1h s ASP 66 N -0.84 5.99 0.00 3.58 2.15 0.60 -4.78 116.67 123.37 3f1h s ASP 66 Ca 0.15 -0.91 0.19 0.00 0.43 0.00 0.00 52.55 52.40 3f1h s ASP 66 Cb -0.12 -2.56 0.53 0.00 -0.30 0.00 0.00 42.92 40.47 3f1h s ASP 66 CO 0.04 -1.95 1.44 0.49 -0.17 0.00 0.00 175.17 175.02 3f1h n PHE 67 N 10.58 0.76 -2.02 -5.34 0.99 -1.26 -4.04 117.46 117.12 3f1h n PHE 67 Ca 0.28 -0.38 0.04 0.00 -0.00 0.00 0.00 57.45 57.40 3f1h n PHE 67 Cb 0.50 0.00 0.08 0.00 -1.00 0.00 0.00 39.48 39.06 3f1h n PHE 67 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.76 177.12 3f1h n LYS 68 N 1.24 0.55 -1.50 -1.08 2.85 -1.26 -0.54 118.16 118.42 3f1h n LYS 68 Ca 0.20 -2.21 -0.57 0.00 -1.05 0.00 0.00 58.31 54.68 3f1h n LYS 68 Cb 0.51 -0.67 -0.07 0.00 -0.65 0.00 0.00 35.03 34.15 3f1h n LYS 68 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 3f1h n ARG 69 N -0.22 0.17 0.00 -1.58 0.63 -1.26 -3.54 116.66 110.86 3f1h n ARG 69 Ca 0.09 0.06 0.00 0.00 -0.92 0.00 0.00 57.85 57.08 3f1h n ARG 69 Cb 0.89 -1.53 0.00 0.00 0.45 0.00 0.00 32.46 32.28 3f1h n ARG 69 CO 0.00 0.00 0.00 -2.67 -2.51 0.00 0.00 177.63 172.45 3f1h n TRP 70 N 1.46 0.00 0.31 -0.14 2.14 -1.26 -4.92 117.44 115.03 3f1h n TRP 70 Ca 0.19 0.00 0.20 0.00 2.07 0.00 0.00 57.50 59.96 3f1h n TRP 70 Cb 0.11 0.00 0.96 0.00 -0.81 0.00 0.00 31.31 31.58 3f1h n TRP 70 CO 0.00 0.00 0.00 0.38 2.07 0.00 0.00 177.69 180.14 3f1h h ASP 71 N 0.59 0.00 -1.98 -0.67 -0.00 -1.98 -2.89 116.42 109.47 3f1h h ASP 71 Ca 0.00 0.00 -0.65 0.00 -0.00 0.00 0.00 57.03 56.38 3f1h h ASP 71 Cb 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 39.33 38.95 3f1h h ASP 71 CO 0.00 0.01 -0.18 0.29 -0.00 0.00 0.00 179.24 179.37 3f1h n LYS 72 N -3.16 3.58 -1.35 4.15 5.02 -1.26 -5.07 118.16 120.07 3f1h n LYS 72 Ca -0.02 -4.53 -0.35 0.00 -2.02 0.00 0.00 58.31 51.39 3f1h n LYS 72 Cb 0.18 -2.28 0.09 0.00 -0.02 0.00 0.00 35.03 33.00 3f1h n LYS 72 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3f1h n VAL 73 N -0.34 2.90 0.00 -0.18 0.31 -1.10 -2.99 118.33 116.93 3f1h n VAL 73 Ca 0.39 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 3f1h n VAL 73 Cb 0.44 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 3f1h n VAL 73 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3f1h n GLY 74 N 0.99 0.96 3.62 2.92 0.00 -0.94 -4.89 105.19 107.86 3f1h n GLY 74 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 3f1h n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f1h s ILE 75 N 0.00 4.13 1.07 -0.61 -1.09 -1.16 -4.93 121.20 118.62 3f1h s ILE 75 Ca 0.00 1.24 -0.18 0.00 -2.23 0.00 0.00 60.65 59.49 3f1h s ILE 75 Cb 0.00 -4.25 0.24 0.00 -1.58 0.00 0.00 42.46 36.88 3f1h s ILE 75 CO 0.00 -0.60 1.25 -2.16 -1.23 0.00 0.00 174.94 172.19 3f1h s PRO 76 N 4.32 -0.24 -0.25 2.79 0.04 -1.26 -4.57 135.00 135.83 3f1h s PRO 76 Ca 0.55 -0.32 -0.26 0.00 0.04 0.00 0.00 61.00 61.01 3f1h s PRO 76 Cb -0.14 -1.74 0.08 0.00 0.04 0.00 0.00 34.50 32.74 3f1h s PRO 76 CO 0.25 -3.02 0.77 0.00 0.04 0.00 0.00 177.00 175.05 3f1h s ALA 77 N -3.56 -1.81 -0.06 8.56 0.00 -0.68 -2.31 121.76 121.90 3f1h s ALA 77 Ca 0.74 1.93 -0.25 0.00 0.00 0.00 0.00 51.96 54.38 3f1h s ALA 77 Cb -0.05 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.94 3f1h s ALA 77 CO 0.54 -0.33 0.75 0.21 0.00 0.00 0.00 175.76 176.94 3f1h s LYS 78 N 0.18 4.44 -0.68 0.00 2.20 0.10 -2.56 119.74 123.43 3f1h s LYS 78 Ca -0.01 0.97 -0.27 0.00 -0.36 0.00 0.00 55.97 56.31 3f1h s LYS 78 Cb -0.04 -3.46 0.01 0.00 -1.51 0.00 0.00 37.83 32.83 3f1h s LYS 78 CO 0.01 0.02 1.50 0.08 -0.36 0.00 0.00 175.35 176.59 3f1h s VAL 79 N 0.94 3.60 -0.59 4.02 1.01 -1.14 -0.84 120.40 127.41 3f1h s VAL 79 Ca 0.40 0.36 0.24 0.00 0.00 0.00 0.00 61.98 62.98 3f1h s VAL 79 Cb -0.18 -4.53 0.03 0.00 0.00 0.00 0.00 36.38 31.70 3f1h s VAL 79 CO 0.19 -1.46 1.26 0.00 0.00 0.00 0.00 175.10 175.09 3f1h h ALA 80 N 11.85 0.55 -2.56 5.51 0.00 -1.77 0.44 119.26 133.28 3f1h h ALA 80 Ca -0.27 0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.74 3f1h h ALA 80 Cb 1.09 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.78 3f1h h ALA 80 CO 1.25 0.00 0.39 0.00 0.00 0.00 0.00 179.25 180.89 3f1h s ALA 81 N -3.19 -1.63 -0.34 0.00 0.00 -0.92 -4.91 121.76 110.76 3f1h s ALA 81 Ca 0.05 0.41 -0.01 0.00 0.00 0.00 0.00 51.96 52.42 3f1h s ALA 81 Cb 0.13 0.65 0.12 0.00 0.00 0.00 0.00 23.12 24.03 3f1h s ALA 81 CO 0.74 -0.87 0.18 0.42 0.00 0.00 0.00 175.76 176.22 3f1h s ILE 82 N -3.43 0.34 0.53 0.00 -1.09 -1.26 -1.71 121.20 114.58 3f1h s ILE 82 Ca 0.07 -1.55 0.00 0.00 -2.23 0.00 0.00 60.65 56.95 3f1h s ILE 82 Cb -0.02 -1.26 0.02 0.00 -1.58 0.00 0.00 42.46 39.62 3f1h s ILE 82 CO -0.04 -0.88 0.76 -1.61 -1.23 0.00 0.00 174.94 171.95 3f1h s GLU 83 N 1.30 2.72 0.31 2.79 2.02 0.21 -1.94 118.70 126.11 3f1h s GLU 83 Ca 0.15 -0.61 -0.23 0.00 0.02 0.00 0.00 54.97 54.29 3f1h s GLU 83 Cb -0.21 -2.48 -0.10 0.00 0.10 0.00 0.00 34.13 31.44 3f1h s GLU 83 CO -0.12 -0.59 0.87 -0.47 0.02 0.00 0.00 175.26 174.98 3f1h s TYR 84 N -2.73 3.61 -0.14 1.61 5.04 -1.26 -2.66 117.35 120.82 3f1h s TYR 84 Ca 0.54 1.62 -0.04 0.00 -2.44 0.00 0.00 57.07 56.76 3f1h s TYR 84 Cb -0.10 -2.81 0.05 0.00 0.35 0.00 0.00 41.96 39.45 3f1h s TYR 84 CO 0.39 0.19 0.07 0.34 -1.34 0.00 0.00 175.55 175.20 3f1h s ASP 85 N -1.74 2.14 0.59 4.32 3.68 -1.26 -4.87 116.67 119.53 3f1h s ASP 85 Ca 0.50 -0.47 0.37 0.00 2.13 0.00 0.00 52.55 55.09 3f1h s ASP 85 Cb -0.16 -0.31 1.73 0.00 -1.45 0.00 0.00 42.92 42.73 3f1h s ASP 85 CO 0.21 -0.31 2.12 1.55 0.13 0.00 0.00 175.17 178.87 3f1h h PRO 86 N 8.38 0.00 -0.51 4.34 0.13 -1.92 -3.10 132.00 139.31 3f1h h PRO 86 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 3f1h h PRO 86 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3f1h h PRO 86 CO 0.27 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.13 3f1h n ASN 87 N -3.10 2.77 -3.80 1.44 3.02 -1.26 -4.92 115.26 109.41 3f1h n ASN 87 Ca -0.01 -2.08 -0.09 0.00 -0.03 0.00 0.00 54.58 52.38 3f1h n ASN 87 Cb 0.23 -0.36 -0.03 0.00 -0.61 0.00 0.00 39.78 39.00 3f1h n ASN 87 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3f1h s ARG 88 N -1.46 1.72 0.16 3.52 1.70 -1.17 -5.02 118.95 118.39 3f1h s ARG 88 Ca 0.32 -1.21 -0.01 0.00 -0.47 0.00 0.00 55.73 54.37 3f1h s ARG 88 Cb 0.18 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 35.08 3f1h s ARG 88 CO 0.20 -0.76 1.37 0.66 -1.08 0.00 0.00 175.30 175.70 3f1h h SER 89 N 2.13 0.41 -4.01 -2.89 4.64 -1.88 -3.46 113.55 108.48 3f1h h SER 89 Ca -0.24 -0.31 -0.48 0.00 -0.47 0.00 0.00 61.79 60.29 3f1h h SER 89 Cb 1.25 -0.12 0.07 0.00 -0.31 0.00 0.00 62.40 63.28 3f1h h SER 89 CO 0.32 1.09 0.28 0.00 -0.87 0.00 0.00 176.83 177.65 3f1h s ALA 90 N -3.34 3.12 0.30 5.18 0.00 -1.26 -4.59 121.76 121.17 3f1h s ALA 90 Ca -0.05 -0.57 -0.06 0.00 0.00 0.00 0.00 51.96 51.28 3f1h s ALA 90 Cb 0.10 -2.78 -0.05 0.00 0.00 0.00 0.00 23.12 20.39 3f1h s ALA 90 CO 0.84 -0.98 0.58 1.03 0.00 0.00 0.00 175.76 177.23 3f1h s ARG 91 N -5.16 3.66 0.11 0.00 1.81 -1.26 -4.49 118.95 113.61 3f1h s ARG 91 Ca 0.56 0.09 0.06 0.00 -1.72 0.00 0.00 55.73 54.72 3f1h s ARG 91 Cb -0.11 -2.61 -0.04 0.00 -0.45 0.00 0.00 34.95 31.74 3f1h s ARG 91 CO 0.48 0.19 -0.06 0.96 -0.68 0.00 0.00 175.30 176.19 3f1h s ILE 92 N -2.10 3.60 -0.20 1.52 -4.36 -1.09 0.82 121.20 119.40 3f1h s ILE 92 Ca 0.45 -1.20 -0.05 0.00 -0.26 0.00 0.00 60.65 59.59 3f1h s ILE 92 Cb -0.11 -2.70 -0.03 0.00 1.25 0.00 0.00 42.46 40.87 3f1h s ILE 92 CO 0.29 0.10 0.01 0.00 0.24 0.00 0.00 174.94 175.58 3f1h s ALA 93 N -1.28 3.09 -0.09 2.27 0.00 0.57 -0.62 121.76 125.69 3f1h s ALA 93 Ca 0.23 -0.94 -0.25 0.00 0.00 0.00 0.00 51.96 51.00 3f1h s ALA 93 Cb -0.11 -1.79 -0.03 0.00 0.00 0.00 0.00 23.12 21.19 3f1h s ALA 93 CO 0.16 -0.08 0.81 -1.17 0.00 0.00 0.00 175.76 175.47 3f1h s LEU 94 N 0.87 4.27 -0.10 0.00 0.20 -0.70 -0.87 118.68 122.35 3f1h s LEU 94 Ca 0.01 1.27 0.03 0.00 0.69 0.00 0.00 54.13 56.14 3f1h s LEU 94 Cb -0.14 -3.24 0.01 0.00 -0.43 0.00 0.00 46.19 42.39 3f1h s LEU 94 CO 0.02 -0.26 -0.19 -1.48 -0.29 0.00 0.00 176.35 174.15 3f1h s LEU 95 N 1.38 1.92 -0.37 -0.68 0.05 -0.45 -2.00 118.68 118.54 3f1h s LEU 95 Ca 0.41 -0.48 -0.24 0.00 0.05 0.00 0.00 54.13 53.86 3f1h s LEU 95 Cb -0.18 -1.21 0.01 0.00 -2.05 0.00 0.00 46.19 42.76 3f1h s LEU 95 CO 0.18 0.10 0.85 -1.00 -0.55 0.00 0.00 176.35 175.93 3f1h s HIS 96 N 0.56 3.09 0.94 3.48 3.76 -0.02 -2.44 115.29 124.67 3f1h s HIS 96 Ca -0.15 0.65 -0.12 0.00 -0.15 0.00 0.00 55.06 55.29 3f1h s HIS 96 Cb -0.17 -3.53 0.16 0.00 1.11 0.00 0.00 32.58 30.15 3f1h s HIS 96 CO 0.05 -0.79 1.11 0.71 -0.85 0.00 0.00 174.74 174.97 3f1h s TYR 97 N 3.29 2.31 0.08 1.40 1.51 0.14 0.01 117.35 126.09 3f1h s TYR 97 Ca 0.35 1.00 0.12 0.00 -1.01 0.00 0.00 57.07 57.53 3f1h s TYR 97 Cb -0.12 -3.27 0.14 0.00 -0.11 0.00 0.00 41.96 38.59 3f1h s TYR 97 CO 0.18 -2.58 1.47 -0.39 -1.11 0.00 0.00 175.55 173.12 3f1h h VAL 98 N -1.67 1.26 -0.89 0.71 -1.51 -1.76 -3.04 116.25 109.36 3f1h h VAL 98 Ca -0.52 -2.48 0.26 0.00 -1.23 0.00 0.00 66.70 62.72 3f1h h VAL 98 Cb 1.32 2.43 -0.04 0.00 -2.13 0.00 0.00 31.29 32.87 3f1h h VAL 98 CO 0.59 0.66 0.68 0.44 -1.23 0.00 0.00 177.57 178.71 3f1h h ASP 99 N 0.00 0.00 0.00 4.19 3.45 -1.93 -3.45 116.42 118.68 3f1h h ASP 99 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 3f1h h ASP 99 Cb 1.37 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.14 3f1h h ASP 99 CO 0.09 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.37 3f1h n GLY 100 N -1.69 2.47 3.74 2.75 0.00 -1.15 -5.08 105.19 106.23 3f1h n GLY 100 Ca 0.19 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 3f1h n GLY 100 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3f1h n GLU 101 N 0.00 2.65 -4.38 1.61 2.13 -1.26 -4.56 120.64 116.83 3f1h n GLU 101 Ca 0.00 0.94 -0.33 0.00 0.66 0.00 0.00 57.16 58.43 3f1h n GLU 101 Cb 0.00 -2.71 -0.10 0.00 0.27 0.00 0.00 31.44 28.91 3f1h n GLU 101 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3f1h s LYS 102 N -0.72 2.71 0.23 5.31 1.02 -1.26 -0.69 119.74 126.34 3f1h s LYS 102 Ca 0.63 -0.63 -0.09 0.00 0.02 0.00 0.00 55.97 55.89 3f1h s LYS 102 Cb -0.50 -2.61 -0.01 0.00 -0.52 0.00 0.00 37.83 34.18 3f1h s LYS 102 CO 0.51 0.63 0.37 1.03 -0.92 0.00 0.00 175.35 176.97 3f1h s ARG 103 N -1.39 1.42 -0.18 1.68 0.52 -1.02 -5.00 118.95 114.97 3f1h s ARG 103 Ca 0.18 -1.34 -0.05 0.00 -0.52 0.00 0.00 55.73 54.00 3f1h s ARG 103 Cb -0.11 0.41 -0.03 0.00 0.52 0.00 0.00 34.95 35.74 3f1h s ARG 103 CO 0.08 -0.56 -0.01 0.71 0.02 0.00 0.00 175.30 175.54 3f1h s TYR 104 N -4.05 3.05 0.23 -0.53 2.02 -1.26 -1.35 117.35 115.46 3f1h s TYR 104 Ca 0.26 -0.36 0.06 0.00 -0.37 0.00 0.00 57.07 56.66 3f1h s TYR 104 Cb 0.02 -2.03 -0.03 0.00 -0.40 0.00 0.00 41.96 39.51 3f1h s TYR 104 CO 0.09 -0.13 0.23 -1.50 -1.57 0.00 0.00 175.55 172.67 3f1h s ILE 105 N 0.70 4.69 0.18 2.71 1.10 -0.05 -0.29 121.20 130.23 3f1h s ILE 105 Ca -0.01 -1.21 -0.30 0.00 -0.51 0.00 0.00 60.65 58.62 3f1h s ILE 105 Cb -0.14 -3.51 -0.09 0.00 0.15 0.00 0.00 42.46 38.87 3f1h s ILE 105 CO 0.02 -0.29 1.35 0.27 -2.11 0.00 0.00 174.94 174.18 3f1h s ILE 106 N -2.01 3.18 -0.56 2.00 -5.25 -1.26 -0.32 121.20 116.98 3f1h s ILE 106 Ca 0.33 0.93 -0.28 0.00 -0.99 0.00 0.00 60.65 60.64 3f1h s ILE 106 Cb -0.09 -3.59 0.01 0.00 2.95 0.00 0.00 42.46 41.74 3f1h s ILE 106 CO 0.26 0.12 1.44 0.00 -1.79 0.00 0.00 174.94 174.96 3f1h s ALA 107 N 0.42 2.79 0.99 2.27 0.00 0.24 -4.58 121.76 123.90 3f1h s ALA 107 Ca 0.60 -0.65 -0.12 0.00 0.00 0.00 0.00 51.96 51.79 3f1h s ALA 107 Cb -0.37 -4.11 0.19 0.00 0.00 0.00 0.00 23.12 18.83 3f1h s ALA 107 CO 0.36 -2.95 1.08 -1.25 0.00 0.00 0.00 175.76 173.00 3f1h s PRO 108 N 5.55 0.45 -0.22 0.00 0.04 -1.26 -1.59 135.00 137.97 3f1h s PRO 108 Ca 0.53 0.81 -0.28 0.00 0.04 0.00 0.00 61.00 62.11 3f1h s PRO 108 Cb -0.11 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.72 3f1h s PRO 108 CO 0.25 -2.79 0.99 0.34 0.04 0.00 0.00 177.00 175.83 3f1h s ASP 109 N -3.13 7.06 0.00 6.66 3.68 0.39 -3.75 116.67 127.57 3f1h s ASP 109 Ca 0.65 1.32 0.00 0.00 2.13 0.00 0.00 52.55 56.65 3f1h s ASP 109 Cb -0.20 -2.52 0.00 0.00 -1.45 0.00 0.00 42.92 38.75 3f1h s ASP 109 CO 0.59 -0.61 0.00 0.61 0.13 0.00 0.00 175.17 175.89 3f1h n GLY 110 N 3.39 0.82 3.06 2.66 0.00 -1.26 -4.72 105.19 109.14 3f1h n GLY 110 Ca 0.10 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.34 3f1h n GLY 110 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3f1h s LEU 111 N -0.90 5.31 0.34 0.99 1.98 -1.25 -5.02 118.68 120.13 3f1h s LEU 111 Ca 0.00 -3.52 -0.27 0.00 -2.89 0.00 0.00 54.13 47.45 3f1h s LEU 111 Cb 0.00 -1.84 -0.09 0.00 0.66 0.00 0.00 46.19 44.92 3f1h s LEU 111 CO 0.00 -0.21 1.13 -1.10 -1.89 0.00 0.00 176.35 174.28 3f1h s GLN 112 N -1.03 4.37 0.37 1.98 1.11 -1.26 -4.96 119.66 120.24 3f1h s GLN 112 Ca 0.24 1.80 -0.28 0.00 0.01 0.00 0.00 55.36 57.13 3f1h s GLN 112 Cb -0.10 -2.92 -0.11 0.00 -1.01 0.00 0.00 33.01 28.86 3f1h s GLN 112 CO -0.11 -0.03 1.50 0.08 0.01 0.00 0.00 175.29 176.74 3f1h s VAL 113 N -1.32 2.03 0.00 1.09 1.01 -1.26 -3.24 120.40 118.72 3f1h s VAL 113 Ca 0.51 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.52 3f1h s VAL 113 Cb -0.30 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.05 3f1h s VAL 113 CO 0.39 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3f1h n GLY 114 N 0.54 1.45 1.15 4.51 0.00 0.15 -5.00 105.19 107.99 3f1h n GLY 114 Ca 0.01 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 3f1h n GLY 114 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3f1h n GLN 115 N -1.35 0.08 -2.65 1.61 6.02 -1.20 -4.80 117.38 115.09 3f1h n GLN 115 Ca 0.00 -0.72 -0.10 0.00 -0.01 0.00 0.00 57.00 56.17 3f1h n GLN 115 Cb 0.07 -0.28 0.03 0.00 1.02 0.00 0.00 30.24 31.07 3f1h n GLN 115 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 3f1h n GLN 116 N -1.67 1.37 -1.45 -1.09 -0.06 -1.25 -2.86 117.38 110.37 3f1h n GLN 116 Ca 0.05 -3.37 -0.37 0.00 -2.00 0.00 0.00 57.00 51.31 3f1h n GLN 116 Cb 0.17 -1.35 0.06 0.00 -4.06 0.00 0.00 30.24 25.07 3f1h n GLN 116 CO 0.00 0.00 0.00 1.55 -0.20 0.00 0.00 177.06 178.41 3f1h n VAL 117 N -0.13 2.72 -3.87 1.69 3.14 -1.06 -4.56 118.33 116.26 3f1h n VAL 117 Ca 0.11 -0.45 -0.11 0.00 -2.96 0.00 0.00 64.34 60.93 3f1h n VAL 117 Cb 0.81 -0.91 -0.01 0.00 -1.06 0.00 0.00 33.84 32.67 3f1h n VAL 117 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 3f1h n VAL 118 N -2.03 0.00 -3.67 1.55 3.14 -1.26 -1.69 118.33 114.37 3f1h n VAL 118 Ca 0.12 -1.25 -0.14 0.00 -2.96 0.00 0.00 64.34 60.11 3f1h n VAL 118 Cb 0.48 0.87 -0.08 0.00 -1.06 0.00 0.00 33.84 34.05 3f1h n VAL 118 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3f1h s ALA 119 N -2.35 -1.38 0.00 1.55 0.00 -1.26 -2.47 121.76 115.86 3f1h s ALA 119 Ca 0.20 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.59 3f1h s ALA 119 Cb -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.40 3f1h s ALA 119 CO 0.15 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 176.04 3f1h n GLY 120 N 2.38 3.58 0.26 0.00 0.00 -0.70 -2.21 105.19 108.51 3f1h n GLY 120 Ca -0.15 -1.40 0.12 0.00 0.00 0.00 0.00 46.02 44.60 3f1h n GLY 120 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3f1h h PRO 121 N 0.00 0.00 -0.13 1.61 0.11 -1.96 -1.12 132.00 130.51 3f1h h PRO 121 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 3f1h h PRO 121 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 3f1h h PRO 121 CO 0.00 0.11 -0.23 0.38 -0.21 0.00 0.00 178.00 178.05 3f1h h ASP 122 N 0.00 0.21 -2.78 -2.05 -0.00 -1.97 -3.47 116.42 106.37 3f1h h ASP 122 Ca -0.00 -0.06 -0.59 0.00 -0.00 0.00 0.00 57.03 56.38 3f1h h ASP 122 Cb 0.30 -0.06 0.13 0.00 -0.00 0.00 0.00 39.33 39.70 3f1h h ASP 122 CO 0.01 0.45 0.07 0.00 -0.00 0.00 0.00 179.24 179.78 3f1h n ALA 123 N -2.48 -0.18 -2.31 4.15 0.00 -0.42 -4.94 120.51 114.33 3f1h n ALA 123 Ca -0.01 0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.28 3f1h n ALA 123 Cb 0.34 -2.02 -0.03 0.00 0.00 0.00 0.00 19.45 17.74 3f1h n ALA 123 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3f1h s PRO 124 N -1.81 4.48 -0.67 0.00 0.04 -1.26 -4.96 135.00 130.82 3f1h s PRO 124 Ca 0.62 1.76 -0.26 0.00 0.04 0.00 0.00 61.00 63.16 3f1h s PRO 124 Cb -0.61 -3.32 -0.02 0.00 0.04 0.00 0.00 34.50 30.59 3f1h s PRO 124 CO 0.58 -0.16 1.83 0.42 0.04 0.00 0.00 177.00 179.71 3f1h s ILE 125 N 0.64 3.40 -0.28 0.56 1.09 -1.26 -4.84 121.20 120.51 3f1h s ILE 125 Ca 0.56 0.12 -0.21 0.00 -1.10 0.00 0.00 60.65 60.02 3f1h s ILE 125 Cb -0.30 -4.04 0.09 0.00 -1.06 0.00 0.00 42.46 37.16 3f1h s ILE 125 CO 0.31 -1.00 0.81 -1.58 -0.10 0.00 0.00 174.94 173.38 3f1h s GLN 126 N 6.92 0.66 0.14 2.79 0.74 -1.26 -5.11 119.66 124.54 3f1h s GLN 126 Ca 0.65 0.95 -0.21 0.00 0.05 0.00 0.00 55.36 56.79 3f1h s GLN 126 Cb -0.11 0.24 -0.13 0.00 1.10 0.00 0.00 33.01 34.11 3f1h s GLN 126 CO 0.17 -0.11 0.41 1.55 -0.55 0.00 0.00 175.29 176.76 3f1h n VAL 127 N 3.29 1.41 0.00 1.34 3.14 -1.26 -1.84 118.33 124.42 3f1h n VAL 127 Ca -0.16 -0.35 0.00 0.00 -2.96 0.00 0.00 64.34 60.86 3f1h n VAL 127 Cb 0.57 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.35 3f1h n VAL 127 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3f1h n GLY 128 N 1.47 2.96 3.75 7.55 0.00 -0.80 -4.93 105.19 115.19 3f1h n GLY 128 Ca 0.13 -0.58 -0.31 0.00 0.00 0.00 0.00 46.02 45.27 3f1h n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f1h s ASN 129 N 0.27 4.14 -0.11 1.61 0.01 -0.76 -4.61 114.94 115.49 3f1h s ASN 129 Ca 0.00 1.71 -0.06 0.00 -0.71 0.00 0.00 52.86 53.80 3f1h s ASN 129 Cb 0.00 -2.40 0.04 0.00 0.41 0.00 0.00 41.25 39.30 3f1h s ASN 129 CO 0.00 -2.25 0.25 0.00 -1.51 0.00 0.00 177.10 173.60 3f1h s ALA 130 N -2.91 -0.59 0.23 0.60 0.00 -1.03 -0.01 121.76 118.04 3f1h s ALA 130 Ca 0.62 0.98 -0.23 0.00 0.00 0.00 0.00 51.96 53.33 3f1h s ALA 130 Cb -0.17 -0.61 0.04 0.00 0.00 0.00 0.00 23.12 22.37 3f1h s ALA 130 CO 0.56 -0.19 0.81 -0.48 0.00 0.00 0.00 175.76 176.47 3f1h s LEU 131 N 1.09 -0.23 0.35 0.00 2.34 -1.26 -1.71 118.68 119.25 3f1h s LEU 131 Ca -0.08 -0.52 -0.28 0.00 0.06 0.00 0.00 54.13 53.31 3f1h s LEU 131 Cb -0.09 2.51 -0.12 0.00 -0.56 0.00 0.00 46.19 47.93 3f1h s LEU 131 CO -0.07 -1.17 1.39 -2.65 -1.06 0.00 0.00 176.35 172.79 3f1h n PRO 132 N -0.46 2.36 -0.23 1.48 -0.02 -1.26 -0.76 135.00 136.10 3f1h n PRO 132 Ca -0.05 0.83 0.10 0.00 -2.02 0.00 0.00 63.50 62.36 3f1h n PRO 132 Cb 0.60 -2.48 0.38 0.00 -0.02 0.00 0.00 33.50 31.97 3f1h n PRO 132 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3f1h h LEU 133 N 2.92 0.64 -1.94 2.45 3.38 -0.18 0.62 115.31 123.20 3f1h h LEU 133 Ca -0.48 0.02 0.29 0.00 0.09 0.00 0.00 57.88 57.81 3f1h h LEU 133 Cb 1.26 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.86 3f1h h LEU 133 CO 0.65 0.36 0.73 0.03 0.09 0.00 0.00 178.44 180.29 3f1h h ARG 134 N 0.70 0.04 0.00 1.13 3.08 -1.56 -1.63 114.38 116.13 3f1h h ARG 134 Ca 0.39 -0.00 -0.18 0.00 0.07 0.00 0.00 59.98 60.26 3f1h h ARG 134 Cb 0.56 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 3f1h h ARG 134 CO -0.16 0.02 -1.87 1.19 -1.07 0.00 0.00 179.97 178.08 3f1h n PHE 135 N -4.26 0.40 -2.33 3.04 3.01 0.20 -4.85 117.46 112.67 3f1h n PHE 135 Ca 0.22 0.13 -0.42 0.00 1.01 0.00 0.00 57.45 58.39 3f1h n PHE 135 Cb 1.06 -0.89 -0.03 0.00 -0.01 0.00 0.00 39.48 39.60 3f1h n PHE 135 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3f1h s ILE 136 N -2.97 3.80 0.26 4.37 1.09 -0.62 -4.96 121.20 122.18 3f1h s ILE 136 Ca -0.06 1.27 -0.31 0.00 -1.10 0.00 0.00 60.65 60.45 3f1h s ILE 136 Cb 0.09 -3.82 -0.13 0.00 -1.06 0.00 0.00 42.46 37.55 3f1h s ILE 136 CO 0.84 0.08 1.50 -2.65 -0.10 0.00 0.00 174.94 174.61 3f1h n PRO 137 N 4.22 2.34 -1.67 2.79 -0.02 -1.26 -4.91 135.00 136.49 3f1h n PRO 137 Ca 0.10 0.83 -0.42 0.00 -2.02 0.00 0.00 63.50 62.00 3f1h n PRO 137 Cb 0.45 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 3f1h n PRO 137 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 3f1h n VAL 138 N 2.12 2.33 -0.10 -1.45 3.14 -1.26 -1.65 118.33 121.46 3f1h n VAL 138 Ca 0.11 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.99 3f1h n VAL 138 Cb 0.34 -1.41 0.00 0.00 -1.06 0.00 0.00 33.84 31.71 3f1h n VAL 138 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3f1h n GLY 139 N 0.93 0.82 3.76 7.55 0.00 -0.85 -5.02 105.19 112.39 3f1h n GLY 139 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 3f1h n GLY 139 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f1h s THR 140 N -2.40 3.83 0.25 2.61 2.01 -0.66 -4.79 115.64 116.49 3f1h s THR 140 Ca 0.00 1.72 -0.12 0.00 0.31 0.00 0.00 61.69 63.59 3f1h s THR 140 Cb 0.00 -4.04 -0.08 0.00 0.01 0.00 0.00 72.50 68.39 3f1h s THR 140 CO 0.00 0.31 0.61 0.68 -0.69 0.00 0.00 174.62 175.54 3f1h s VAL 141 N -1.32 4.83 0.07 3.82 -7.23 -1.26 -1.64 120.40 117.67 3f1h s VAL 141 Ca 0.46 0.71 -0.27 0.00 -1.81 0.00 0.00 61.98 61.08 3f1h s VAL 141 Cb -0.26 -3.64 0.08 0.00 0.56 0.00 0.00 36.38 33.12 3f1h s VAL 141 CO 0.33 -0.05 0.84 0.54 -0.31 0.00 0.00 175.10 176.45 3f1h s VAL 142 N -1.80 0.00 0.00 1.32 0.11 -0.39 -2.27 120.40 117.36 3f1h s VAL 142 Ca 0.48 -0.18 0.00 0.00 -2.93 0.00 0.00 61.98 59.35 3f1h s VAL 142 Cb -0.12 -1.24 0.00 0.00 -1.53 0.00 0.00 36.38 33.49 3f1h s VAL 142 CO 0.20 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.97 3f1h n HIS 143 N -0.33 0.00 -4.44 1.54 1.44 -0.91 -1.59 115.22 110.93 3f1h n HIS 143 Ca -0.10 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.21 3f1h n HIS 143 Cb 0.62 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.65 3f1h n HIS 143 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3f1h n ALA 144 N -3.00 -1.30 -2.17 1.59 0.00 -0.22 -3.39 120.51 112.02 3f1h n ALA 144 Ca 0.00 -0.24 -0.41 0.00 0.00 0.00 0.00 53.44 52.79 3f1h n ALA 144 Cb 0.00 -2.20 -0.04 0.00 0.00 0.00 0.00 19.45 17.21 3f1h n ALA 144 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3f1h s VAL 145 N -3.37 4.13 0.19 0.00 1.01 -0.37 -4.61 120.40 117.39 3f1h s VAL 145 Ca 0.69 1.79 -0.03 0.00 0.00 0.00 0.00 61.98 64.43 3f1h s VAL 145 Cb -0.41 -4.14 0.05 0.00 0.00 0.00 0.00 36.38 31.88 3f1h s VAL 145 CO 1.00 0.28 0.16 -0.62 0.00 0.00 0.00 175.10 175.92 3f1h n GLU 146 N 2.64 -1.59 0.00 2.72 1.02 -1.08 0.36 120.64 124.71 3f1h n GLU 146 Ca 0.03 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 56.92 3f1h n GLU 146 Cb 0.47 -0.26 0.00 0.00 -0.02 0.00 0.00 31.44 31.64 3f1h n GLU 146 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3f1h n LEU 147 N 0.00 0.00 -4.14 -4.62 7.94 -1.26 -4.53 117.00 110.38 3f1h n LEU 147 Ca 0.02 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.64 3f1h n LEU 147 Cb 0.09 0.04 -0.17 0.00 0.53 0.00 0.00 43.42 43.91 3f1h n LEU 147 CO 0.06 -0.25 -0.52 -1.61 -1.11 0.00 0.00 177.39 173.96 3f1h s GLU 148 N -1.50 2.28 -0.23 1.96 2.02 -1.26 -4.26 118.70 117.71 3f1h s GLU 148 Ca 0.00 -0.67 -0.41 0.00 0.02 0.00 0.00 54.97 53.91 3f1h s GLU 148 Cb 0.00 -1.83 -0.17 0.00 0.10 0.00 0.00 34.13 32.23 3f1h s GLU 148 CO 0.00 0.17 1.59 -0.35 0.02 0.00 0.00 175.26 176.69 3f1h n PRO 149 N 3.46 0.87 -0.98 0.39 -0.04 -1.26 -1.23 135.00 136.20 3f1h n PRO 149 Ca -0.20 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 3f1h n PRO 149 Cb 0.52 -1.95 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 3f1h n PRO 149 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3f1h n LYS 150 N 4.30 0.00 -0.17 0.54 4.76 -1.26 -4.93 118.16 121.41 3f1h n LYS 150 Ca 0.25 0.21 0.11 0.00 -2.87 0.00 0.00 58.31 56.01 3f1h n LYS 150 Cb 0.10 -3.36 0.19 0.00 -1.84 0.00 0.00 35.03 30.13 3f1h n LYS 150 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3f1h n LYS 151 N -2.98 2.39 0.00 1.97 5.02 -0.37 -5.07 118.16 119.12 3f1h n LYS 151 Ca 0.00 -2.19 0.00 0.00 -2.02 0.00 0.00 58.31 54.10 3f1h n LYS 151 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 3f1h n LYS 151 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f1h n GLY 152 N 1.37 2.12 3.68 0.72 0.00 -1.26 -4.97 105.19 106.85 3f1h n GLY 152 Ca 0.18 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.95 3f1h n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f1h s ALA 153 N -2.67 3.46 0.00 4.61 0.00 0.30 -4.09 121.76 123.36 3f1h s ALA 153 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.09 3f1h s ALA 153 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.88 3f1h s ALA 153 CO 0.00 -0.55 0.00 1.63 0.00 0.00 0.00 175.76 176.84 3f1h n LYS 154 N 4.94 4.38 -3.51 0.00 5.02 0.14 -4.88 118.16 124.26 3f1h n LYS 154 Ca 0.05 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.97 3f1h n LYS 154 Cb 0.49 -0.49 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 3f1h n LYS 154 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3f1h s LEU 155 N -0.45 4.29 -0.26 -0.35 1.02 0.16 -4.76 118.68 118.34 3f1h s LEU 155 Ca 0.00 0.64 -0.06 0.00 0.02 0.00 0.00 54.13 54.73 3f1h s LEU 155 Cb 0.00 -2.45 0.01 0.00 0.02 0.00 0.00 46.19 43.77 3f1h s LEU 155 CO 0.00 0.13 0.15 0.00 0.02 0.00 0.00 176.35 176.65 3f1h n ALA 156 N 3.23 -2.94 -0.22 4.21 0.00 -1.26 -1.24 120.51 122.28 3f1h n ALA 156 Ca -0.12 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.79 3f1h n ALA 156 Cb 0.52 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3f1h n ALA 156 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3f1h n ARG 157 N 0.63 1.47 -1.58 0.00 1.74 -1.26 -1.05 116.66 116.60 3f1h n ARG 157 Ca 0.01 -0.06 -0.31 0.00 -0.77 0.00 0.00 57.85 56.72 3f1h n ARG 157 Cb 0.26 -0.34 0.05 0.00 -1.02 0.00 0.00 32.46 31.41 3f1h n ARG 157 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3f1h s ALA 158 N -0.23 2.69 -0.04 7.54 0.00 -1.26 -4.55 121.76 125.92 3f1h s ALA 158 Ca 0.00 0.09 -0.37 0.00 0.00 0.00 0.00 51.96 51.68 3f1h s ALA 158 Cb 0.00 -3.18 -0.15 0.00 0.00 0.00 0.00 23.12 19.79 3f1h s ALA 158 CO 0.00 -1.21 1.56 0.00 0.00 0.00 0.00 175.76 176.11 3f1h n ALA 159 N -3.10 -0.19 -0.94 0.00 0.00 -1.26 -1.69 120.51 113.33 3f1h n ALA 159 Ca 0.08 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.96 3f1h n ALA 159 Cb 0.53 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.78 3f1h n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f1h n GLY 160 N 3.38 0.33 3.66 0.00 0.00 -0.87 -4.81 105.19 106.88 3f1h n GLY 160 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 3f1h n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3f1h s THR 161 N -1.80 1.89 0.00 2.61 -4.23 -0.68 -4.62 115.64 108.81 3f1h s THR 161 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 3f1h s THR 161 Cb 0.00 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.32 3f1h s THR 161 CO 0.00 0.00 0.00 -0.24 -0.54 0.00 0.00 174.62 173.84 3f1h n SER 162 N -4.33 0.00 -4.89 3.99 2.88 -1.26 -2.18 113.62 107.82 3f1h n SER 162 Ca 0.08 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.28 3f1h n SER 162 Cb 0.58 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.99 3f1h n SER 162 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3f1h s ALA 163 N 0.00 3.87 -0.06 -1.46 0.00 -0.62 -4.06 121.76 119.43 3f1h s ALA 163 Ca 0.00 -0.62 0.03 0.00 0.00 0.00 0.00 51.96 51.37 3f1h s ALA 163 Cb 0.00 -2.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 3f1h s ALA 163 CO 0.00 0.68 -0.13 -1.14 0.00 0.00 0.00 175.76 175.17 3f1h s GLN 164 N -1.95 2.60 0.08 0.00 0.74 -1.03 -1.27 119.66 118.85 3f1h s GLN 164 Ca 0.30 -0.67 -0.30 0.00 0.05 0.00 0.00 55.36 54.73 3f1h s GLN 164 Cb -0.13 -2.43 -0.06 0.00 1.10 0.00 0.00 33.01 31.49 3f1h s GLN 164 CO 0.18 0.60 1.17 0.42 -0.55 0.00 0.00 175.29 177.12 3f1h s ILE 165 N -0.67 4.02 -0.19 -2.34 1.01 -0.65 -0.04 121.20 122.34 3f1h s ILE 165 Ca 0.10 1.51 0.10 0.00 0.00 0.00 0.00 60.65 62.36 3f1h s ILE 165 Cb -0.11 -3.97 -0.18 0.00 0.01 0.00 0.00 42.46 38.21 3f1h s ILE 165 CO 0.01 0.15 -0.04 1.67 0.00 0.00 0.00 174.94 176.72 3f1h n GLN 166 N 3.58 0.94 0.00 2.79 -0.06 0.25 -2.00 117.38 122.89 3f1h n GLN 166 Ca 0.07 0.05 0.00 0.00 -2.00 0.00 0.00 57.00 55.12 3f1h n GLN 166 Cb 0.46 -1.44 0.00 0.00 -4.06 0.00 0.00 30.24 25.21 3f1h n GLN 166 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3f1h n GLY 167 N 2.15 2.94 3.98 1.69 0.00 -1.19 -4.77 105.19 110.00 3f1h n GLY 167 Ca -0.32 -0.93 -0.20 0.00 0.00 0.00 0.00 46.02 44.56 3f1h n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f1h s ARG 168 N -2.00 2.50 0.00 1.61 3.00 -1.26 0.65 118.95 123.45 3f1h s ARG 168 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 55.73 54.79 3f1h s ARG 168 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 34.95 32.42 3f1h s ARG 168 CO 0.00 -0.71 0.00 -1.91 0.00 0.00 0.00 175.30 172.68 3f1h n GLU 169 N -2.29 0.00 0.00 3.54 0.00 -0.64 -4.88 120.64 116.37 3f1h n GLU 169 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.25 3f1h n GLU 169 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.04 3f1h n GLU 169 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3f1h n GLY 170 N 0.00 -1.61 0.00 8.31 0.00 -1.26 -3.40 105.19 107.23 3f1h n GLY 170 Ca 0.00 -1.33 0.07 0.00 0.00 0.00 0.00 46.02 44.76 3f1h n GLY 170 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3f1h n ASP 171 N 0.18 0.00 -4.78 1.61 8.00 -1.26 -4.78 116.55 115.52 3f1h n ASP 171 Ca 0.00 -0.55 -0.27 0.00 0.71 0.00 0.00 54.79 54.68 3f1h n ASP 171 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 3f1h n ASP 171 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3f1h s TYR 172 N -2.00 3.12 0.19 1.24 2.02 -1.22 -0.80 117.35 119.90 3f1h s TYR 172 Ca 0.21 -0.02 0.11 0.00 -0.37 0.00 0.00 57.07 57.01 3f1h s TYR 172 Cb 0.10 -1.51 -0.04 0.00 -0.40 0.00 0.00 41.96 40.10 3f1h s TYR 172 CO 0.16 0.52 -0.23 0.54 -1.57 0.00 0.00 175.55 174.97 3f1h s VAL 173 N -1.70 2.29 -0.32 0.71 0.11 0.05 -1.63 120.40 119.91 3f1h s VAL 173 Ca 0.30 -2.04 -0.08 0.00 -2.93 0.00 0.00 61.98 57.24 3f1h s VAL 173 Cb -0.10 -2.10 0.02 0.00 -1.53 0.00 0.00 36.38 32.67 3f1h s VAL 173 CO 0.23 -0.16 0.11 -0.63 -3.33 0.00 0.00 175.10 171.32 3f1h s ILE 174 N -1.77 4.06 0.26 7.04 1.09 0.21 -0.70 121.20 131.38 3f1h s ILE 174 Ca 0.21 -0.80 0.00 0.00 -1.10 0.00 0.00 60.65 58.96 3f1h s ILE 174 Cb -0.07 -3.17 -0.04 0.00 -1.06 0.00 0.00 42.46 38.12 3f1h s ILE 174 CO 0.10 -0.03 0.45 -0.76 -0.10 0.00 0.00 174.94 174.60 3f1h s LEU 175 N 1.49 4.16 -0.43 2.97 1.43 -0.59 0.86 118.68 128.58 3f1h s LEU 175 Ca 0.02 0.39 -0.07 0.00 -1.03 0.00 0.00 54.13 53.43 3f1h s LEU 175 Cb -0.18 -3.19 0.10 0.00 0.03 0.00 0.00 46.19 42.95 3f1h s LEU 175 CO 0.03 -0.13 0.26 -0.60 0.23 0.00 0.00 176.35 176.14 3f1h s ARG 176 N -3.74 2.39 1.14 1.70 3.52 0.94 -2.06 118.95 122.84 3f1h s ARG 176 Ca 0.39 -1.66 -0.15 0.00 -0.13 0.00 0.00 55.73 54.18 3f1h s ARG 176 Cb -0.10 -3.75 0.21 0.00 -1.56 0.00 0.00 34.95 29.75 3f1h s ARG 176 CO 0.31 -1.06 0.62 1.28 -0.81 0.00 0.00 175.30 175.64 3f1h n LEU 177 N 4.81 -1.55 0.28 -0.88 4.77 -0.72 -2.45 117.00 121.26 3f1h n LEU 177 Ca -0.07 -0.11 0.16 0.00 -0.03 0.00 0.00 56.01 55.96 3f1h n LEU 177 Cb 0.42 -1.15 0.83 0.00 -2.33 0.00 0.00 43.42 41.18 3f1h n LEU 177 CO 0.38 -3.20 1.03 -0.65 -1.33 0.00 0.00 177.39 173.62 3f1h h PRO 178 N -2.39 0.00 0.00 3.23 0.11 -1.90 -0.58 132.00 130.46 3f1h h PRO 178 Ca -0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.54 3f1h h PRO 178 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 3f1h h PRO 178 CO 0.44 0.07 0.00 0.43 -0.21 0.00 0.00 178.00 178.73 3f1h n SER 179 N -3.40 0.00 0.00 -2.05 7.64 -1.26 -4.83 113.62 109.72 3f1h n SER 179 Ca -0.02 -0.59 0.00 0.00 1.01 0.00 0.00 58.87 59.28 3f1h n SER 179 Cb 0.21 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 3f1h n SER 179 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f1h n GLY 180 N 0.42 1.98 3.75 0.23 0.00 -0.23 -4.98 105.19 106.35 3f1h n GLY 180 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3f1h n GLY 180 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3f1h s GLU 181 N -0.04 4.16 -0.19 1.61 2.12 -1.26 -4.75 118.70 120.35 3f1h s GLU 181 Ca 0.00 2.51 -0.16 0.00 0.36 0.00 0.00 54.97 57.68 3f1h s GLU 181 Cb 0.00 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.30 3f1h s GLU 181 CO 0.00 -0.59 0.41 -0.51 -0.54 0.00 0.00 175.26 174.02 3f1h s LEU 182 N -0.28 4.18 -0.02 2.70 1.43 -1.16 -1.76 118.68 123.76 3f1h s LEU 182 Ca 0.63 0.57 -0.05 0.00 -1.03 0.00 0.00 54.13 54.25 3f1h s LEU 182 Cb -0.46 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.22 3f1h s LEU 182 CO 0.45 -0.05 0.11 -0.60 0.23 0.00 0.00 176.35 176.49 3f1h s ARG 183 N 1.14 0.27 0.21 1.70 3.52 -0.88 0.72 118.95 125.63 3f1h s ARG 183 Ca 0.20 -0.09 -0.24 0.00 -0.13 0.00 0.00 55.73 55.47 3f1h s ARG 183 Cb -0.15 0.12 -0.08 0.00 -1.56 0.00 0.00 34.95 33.28 3f1h s ARG 183 CO 0.08 -0.05 0.79 0.15 -0.81 0.00 0.00 175.30 175.46 3f1h s LYS 184 N -0.56 4.51 0.01 5.12 1.02 -0.54 -1.55 119.74 127.75 3f1h s LYS 184 Ca -0.06 1.13 0.01 0.00 0.02 0.00 0.00 55.97 57.06 3f1h s LYS 184 Cb -0.04 -3.10 -0.01 0.00 -0.52 0.00 0.00 37.83 34.16 3f1h s LYS 184 CO 0.00 0.49 -0.04 0.08 -0.92 0.00 0.00 175.35 174.96 3f1h s VAL 185 N -1.31 0.27 0.20 3.17 1.01 0.12 -4.88 120.40 118.98 3f1h s VAL 185 Ca 0.40 -0.35 -0.31 0.00 0.00 0.00 0.00 61.98 61.71 3f1h s VAL 185 Cb -0.21 -0.27 -0.11 0.00 0.00 0.00 0.00 36.38 35.79 3f1h s VAL 185 CO 0.25 -0.06 1.61 -2.28 0.00 0.00 0.00 175.10 174.62 3f1h s HIS 186 N -0.41 2.97 0.63 5.22 2.46 -1.26 -0.77 115.29 124.12 3f1h s HIS 186 Ca -0.02 0.59 0.32 0.00 0.47 0.00 0.00 55.06 56.41 3f1h s HIS 186 Cb -0.03 -4.01 1.76 0.00 -0.13 0.00 0.00 32.58 30.17 3f1h s HIS 186 CO -0.00 -3.68 2.06 0.78 -2.47 0.00 0.00 174.74 171.43 3f1h h GLY 187 N 6.40 0.00 1.75 1.59 0.00 -1.27 -0.96 103.07 110.58 3f1h h GLY 187 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3f1h h GLY 187 CO 0.90 0.00 -0.09 1.18 0.00 0.00 0.00 176.54 178.54 3f1h n GLU 188 N -3.35 0.07 -1.96 4.80 -0.58 -1.26 -1.08 120.64 117.27 3f1h n GLU 188 Ca 0.00 -0.01 -0.41 0.00 -0.42 0.00 0.00 57.16 56.32 3f1h n GLU 188 Cb 0.34 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.70 3f1h n GLU 188 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3f1h s TYR 190 N -0.72 3.45 0.00 0.00 1.51 -1.26 -1.67 117.35 118.66 3f1h s TYR 190 Ca 0.54 1.32 0.00 0.00 -1.01 0.00 0.00 57.07 57.92 3f1h s TYR 190 Cb -0.43 -2.79 0.00 0.00 -0.11 0.00 0.00 41.96 38.63 3f1h s TYR 190 CO 0.53 -0.89 0.00 0.00 -1.11 0.00 0.00 175.55 174.08 3f1h n ALA 191 N -2.88 0.00 0.00 3.71 0.00 0.06 -2.63 120.51 118.76 3f1h n ALA 191 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3f1h n ALA 191 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 3f1h n ALA 191 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3f1h n THR 192 N 0.00 0.00 -1.67 0.00 5.66 -1.22 -4.36 114.28 112.70 3f1h n THR 192 Ca 0.00 0.00 -0.50 0.00 -3.05 0.00 0.00 64.05 60.50 3f1h n THR 192 Cb 0.00 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.73 3f1h n THR 192 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 3f1h n VAL 193 N 0.00 0.24 0.00 1.08 3.14 0.98 -2.33 118.33 121.45 3f1h n VAL 193 Ca 0.00 -0.04 0.00 0.00 -2.96 0.00 0.00 64.34 61.34 3f1h n VAL 193 Cb 0.00 -1.44 0.00 0.00 -1.06 0.00 0.00 33.84 31.34 3f1h n VAL 193 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3f1h n GLY 194 N 3.70 1.13 3.73 7.55 0.00 -0.96 -1.90 105.19 118.44 3f1h n GLY 194 Ca 0.21 -2.08 -0.26 0.00 0.00 0.00 0.00 46.02 43.89 3f1h n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f1h s ALA 195 N -1.08 3.38 0.45 4.61 0.00 -1.26 -2.15 121.76 125.70 3f1h s ALA 195 Ca 0.00 -1.34 -0.23 0.00 0.00 0.00 0.00 51.96 50.39 3f1h s ALA 195 Cb 0.00 -1.15 -0.08 0.00 0.00 0.00 0.00 23.12 21.89 3f1h s ALA 195 CO 0.00 0.45 1.13 0.08 0.00 0.00 0.00 175.76 177.43 3f1h s VAL 196 N -1.82 3.27 0.55 0.00 1.01 -0.93 0.15 120.40 122.63 3f1h s VAL 196 Ca 0.30 0.95 -0.09 0.00 0.00 0.00 0.00 61.98 63.13 3f1h s VAL 196 Cb -0.09 -3.48 0.13 0.00 0.00 0.00 0.00 36.38 32.94 3f1h s VAL 196 CO 0.21 -0.02 0.75 0.61 0.00 0.00 0.00 175.10 176.66 3f1h n GLY 197 N 0.40 -1.26 4.01 4.51 0.00 -0.62 -2.50 105.19 109.72 3f1h n GLY 197 Ca 0.07 -1.70 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 3f1h n GLY 197 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3f1h n ASN 198 N -3.47 -4.23 0.22 1.61 4.05 -1.26 -2.05 115.26 110.13 3f1h n ASN 198 Ca 0.10 -0.85 0.14 0.00 0.45 0.00 0.00 54.58 54.42 3f1h n ASN 198 Cb 0.33 -3.40 0.76 0.00 1.23 0.00 0.00 39.78 38.70 3f1h n ASN 198 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3f1h h ALA 199 N 0.95 1.03 0.00 5.20 0.00 -1.88 -1.08 119.26 123.48 3f1h h ALA 199 Ca -0.58 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3f1h h ALA 199 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3f1h h ALA 199 CO 0.71 -0.03 0.00 -3.47 0.00 0.00 0.00 179.25 176.47 3f1h n ASP 200 N -2.50 0.00 -0.05 0.00 -0.08 -1.26 -4.00 116.55 108.66 3f1h n ASP 200 Ca -0.02 -0.51 -0.08 0.00 -1.51 0.00 0.00 54.79 52.67 3f1h n ASP 200 Cb 0.08 -0.11 -0.01 0.00 2.34 0.00 0.00 41.12 43.41 3f1h n ASP 200 CO 0.00 0.00 0.00 -0.74 0.12 0.00 0.00 177.20 176.58 3f1h h HIS 201 N 0.00 -0.31 0.00 -0.67 -0.00 -1.56 -2.16 115.15 110.46 3f1h h HIS 201 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 3f1h h HIS 201 Cb 0.09 0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.67 3f1h h HIS 201 CO 0.00 -0.19 0.11 0.36 -0.00 0.00 0.00 177.93 178.21 3f1h n LYS 202 N -5.29 0.00 0.00 5.26 2.85 -1.26 -1.61 118.16 118.11 3f1h n LYS 202 Ca -0.01 0.35 0.12 0.00 -1.05 0.00 0.00 58.31 57.72 3f1h n LYS 202 Cb 0.21 -1.61 0.11 0.00 -0.65 0.00 0.00 35.03 33.08 3f1h n LYS 202 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3f1h n ASN 203 N -1.34 1.95 -4.46 -5.58 3.02 -0.81 -4.93 115.26 103.11 3f1h n ASN 203 Ca 0.00 -1.46 -0.31 0.00 -0.03 0.00 0.00 54.58 52.77 3f1h n ASN 203 Cb 0.11 0.33 0.17 0.00 -0.61 0.00 0.00 39.78 39.78 3f1h n ASN 203 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3f1h n ILE 204 N 0.05 0.00 -3.45 2.41 -6.64 -0.63 -4.98 119.36 106.12 3f1h n ILE 204 Ca 0.11 -0.22 -0.18 0.00 -1.77 0.00 0.00 62.75 60.68 3f1h n ILE 204 Cb 0.46 -0.79 -0.11 0.00 -1.44 0.00 0.00 39.64 37.76 3f1h n ILE 204 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 3f1h s VAL 205 N -2.42 -0.35 0.41 7.28 1.01 -1.25 -4.97 120.40 120.11 3f1h s VAL 205 Ca 0.62 -0.34 0.18 0.00 0.00 0.00 0.00 61.98 62.44 3f1h s VAL 205 Cb -0.20 -0.85 0.38 0.00 0.00 0.00 0.00 36.38 35.71 3f1h s VAL 205 CO 0.64 -0.37 1.82 -0.07 0.00 0.00 0.00 175.10 177.13 3f1h h LEU 206 N 8.29 0.43 0.00 3.92 3.38 -1.91 -2.05 115.31 127.38 3f1h h LEU 206 Ca -0.16 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3f1h h LEU 206 Cb 1.11 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3f1h h LEU 206 CO 0.32 0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.60 3f1h n GLY 207 N -1.50 2.35 3.74 0.83 0.00 -1.26 -4.73 105.19 104.62 3f1h n GLY 207 Ca 0.22 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 3f1h n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f1h s LYS 208 N 0.00 2.49 0.10 1.61 -2.85 -1.26 -4.79 119.74 115.04 3f1h s LYS 208 Ca 0.00 -1.39 -0.30 0.00 -1.00 0.00 0.00 55.97 53.28 3f1h s LYS 208 Cb 0.00 -2.28 -0.13 0.00 -2.06 0.00 0.00 37.83 33.37 3f1h s LYS 208 CO 0.00 0.23 1.63 0.00 0.10 0.00 0.00 175.35 177.31 3f1h h ALA 209 N 1.59 -0.63 -0.92 0.59 0.00 -1.96 -2.63 119.26 115.30 3f1h h ALA 209 Ca -0.45 -0.10 0.18 0.00 0.00 0.00 0.00 54.91 54.54 3f1h h ALA 209 Cb 1.25 0.42 -0.17 0.00 0.00 0.00 0.00 17.79 19.29 3f1h h ALA 209 CO 0.61 -0.89 -0.25 0.78 0.00 0.00 0.00 179.25 179.51 3f1h h GLY 210 N -0.63 0.59 0.56 0.00 0.00 -1.96 0.73 103.07 102.36 3f1h h GLY 210 Ca -0.02 0.32 0.21 0.00 0.00 0.00 0.00 47.33 47.85 3f1h h GLY 210 CO -0.05 -0.33 0.52 -0.09 0.00 0.00 0.00 176.54 176.59 3f1h h ARG 211 N -0.00 0.00 -0.23 4.80 2.43 -1.75 1.24 114.38 120.85 3f1h h ARG 211 Ca 0.43 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 59.40 3f1h h ARG 211 Cb 0.66 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 3f1h h ARG 211 CO -0.94 0.00 -0.64 1.03 -1.51 0.00 0.00 179.97 177.91 3f1h h SER 212 N 0.00 0.95 -0.80 -3.80 0.87 -0.93 -3.13 113.55 106.71 3f1h h SER 212 Ca 0.34 -0.55 0.06 0.00 -1.23 0.00 0.00 61.79 60.41 3f1h h SER 212 Cb 1.37 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 63.00 3f1h h SER 212 CO -0.00 1.35 0.49 0.03 -0.53 0.00 0.00 176.83 178.17 3f1h h ARG 213 N 0.61 0.87 -0.78 2.24 2.47 0.16 -0.80 114.38 119.15 3f1h h ARG 213 Ca -0.01 -0.05 0.10 0.00 -1.26 0.00 0.00 59.98 58.75 3f1h h ARG 213 Cb 1.25 -0.20 -0.07 0.00 -1.65 0.00 0.00 29.97 29.30 3f1h h ARG 213 CO 0.14 0.58 0.43 -1.49 0.56 0.00 0.00 179.97 180.18 3f1h h TRP 214 N 0.90 0.77 0.00 3.04 6.55 -1.18 0.15 115.95 126.17 3f1h h TRP 214 Ca 0.35 0.03 0.00 0.00 0.95 0.00 0.00 58.89 60.22 3f1h h TRP 214 Cb 0.17 -0.23 0.00 0.00 -0.86 0.00 0.00 29.16 28.24 3f1h h TRP 214 CO -0.04 0.30 0.00 -0.07 -1.05 0.00 0.00 178.44 177.57 3f1h h LEU 215 N 0.71 0.00 0.00 -4.49 3.38 -1.12 -3.29 115.31 110.51 3f1h h LEU 215 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 3f1h h LEU 215 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3f1h h LEU 215 CO -0.26 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.88 3f1h n GLY 216 N -0.70 0.94 3.64 0.83 0.00 0.51 -4.66 105.19 105.76 3f1h n GLY 216 Ca -0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 3f1h n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f1h s ARG 217 N -0.82 4.12 0.63 1.61 3.00 -0.91 -2.57 118.95 124.02 3f1h s ARG 217 Ca 0.00 0.31 -0.03 0.00 0.00 0.00 0.00 55.73 56.01 3f1h s ARG 217 Cb 0.00 -3.60 0.05 0.00 0.00 0.00 0.00 34.95 31.40 3f1h s ARG 217 CO 0.00 -0.22 0.90 1.03 0.00 0.00 0.00 175.30 177.01 3f1h s ARG 218 N 1.89 2.36 0.39 3.54 1.81 -0.79 -3.61 118.95 124.54 3f1h s ARG 218 Ca 0.21 -0.50 -0.27 0.00 -1.72 0.00 0.00 55.73 53.46 3f1h s ARG 218 Cb -0.15 -2.32 -0.10 0.00 -0.45 0.00 0.00 34.95 31.93 3f1h s ARG 218 CO 0.09 -1.00 1.38 -1.25 -0.68 0.00 0.00 175.30 173.84 3f1h s PRO 219 N -5.02 4.04 -0.29 3.54 0.04 -1.26 -4.91 135.00 131.13 3f1h s PRO 219 Ca 0.59 2.34 -0.08 0.00 0.04 0.00 0.00 61.00 63.89 3f1h s PRO 219 Cb -0.11 -2.87 0.00 0.00 0.04 0.00 0.00 34.50 31.57 3f1h s PRO 219 CO 0.42 -0.50 0.10 -1.58 0.04 0.00 0.00 177.00 175.48 3f1h s HIS 220 N -1.18 3.15 -0.10 0.56 2.46 -1.26 -4.79 115.29 114.12 3f1h s HIS 220 Ca 0.55 -0.79 -0.13 0.00 0.47 0.00 0.00 55.06 55.15 3f1h s HIS 220 Cb -0.42 -2.28 -0.05 0.00 -0.13 0.00 0.00 32.58 29.70 3f1h s HIS 220 CO 0.55 -0.52 0.31 0.54 -2.47 0.00 0.00 174.74 173.16 3f1h s VAL 221 N 1.55 5.25 0.38 0.89 0.11 -1.26 -5.05 120.40 122.27 3f1h s VAL 221 Ca 0.04 0.60 -0.26 0.00 -2.93 0.00 0.00 61.98 59.42 3f1h s VAL 221 Cb -0.17 -3.63 -0.09 0.00 -1.53 0.00 0.00 36.38 30.97 3f1h s VAL 221 CO 0.04 0.48 1.25 -0.13 -3.33 0.00 0.00 175.10 173.40 3f1h s ARG 222 N -0.22 4.11 0.27 1.54 0.52 -1.26 -4.87 118.95 119.04 3f1h s ARG 222 Ca 0.19 2.04 0.00 0.00 -0.52 0.00 0.00 55.73 57.44 3f1h s ARG 222 Cb -0.14 -2.82 0.58 0.00 0.52 0.00 0.00 34.95 33.10 3f1h s ARG 222 CO 0.07 -0.33 1.75 0.78 0.02 0.00 0.00 175.30 177.59 3f1h h GLY 223 N 2.87 1.43 1.67 -3.53 0.00 -1.97 -0.68 103.07 102.86 3f1h h GLY 223 Ca -0.49 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.60 3f1h h GLY 223 CO 0.63 -0.09 0.00 0.00 0.00 0.00 0.00 176.54 177.08 3f1h n ALA 224 N -2.44 1.20 0.94 3.60 0.00 -1.03 -0.70 120.51 122.08 3f1h n ALA 224 Ca 0.18 -0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.72 3f1h n ALA 224 Cb 0.49 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 3f1h n ALA 224 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f1h n ALA 225 N -1.33 3.97 -2.11 0.00 0.00 -0.26 -4.65 120.51 116.13 3f1h n ALA 225 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.85 3f1h n ALA 225 Cb 0.01 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 18.72 3f1h n ALA 225 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3f1h n MET 226 N -0.67 0.93 -3.71 0.00 2.81 0.12 -5.01 117.12 111.60 3f1h n MET 226 Ca 0.07 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.75 3f1h n MET 226 Cb 0.38 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.86 3f1h n MET 226 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 3f1h s ASN 227 N -1.00 5.24 0.47 7.83 0.02 -1.26 -4.08 114.94 122.16 3f1h s ASN 227 Ca 0.00 -0.56 0.27 0.00 -1.02 0.00 0.00 52.86 51.55 3f1h s ASN 227 Cb 0.00 -0.85 1.32 0.00 0.02 0.00 0.00 41.25 41.74 3f1h s ASN 227 CO 0.00 -0.45 1.81 1.55 0.02 0.00 0.00 177.10 180.02 3f1h h PRO 228 N 1.16 0.19 -0.21 -0.60 0.13 0.11 0.25 132.00 133.03 3f1h h PRO 228 Ca -0.44 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.62 3f1h h PRO 228 Cb 1.26 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 3f1h h PRO 228 CO 0.58 0.12 -0.14 0.28 -0.23 0.00 0.00 178.00 178.60 3f1h h VAL 229 N 0.19 1.21 0.00 1.56 2.07 -1.94 -3.04 116.25 116.30 3f1h h VAL 229 Ca 0.55 -0.94 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3f1h h VAL 229 Cb 1.80 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 3f1h h VAL 229 CO -0.14 0.30 -1.25 0.47 0.02 0.00 0.00 177.57 176.96 3f1h n ASP 230 N -4.23 0.71 -3.59 0.57 8.00 0.06 -5.00 116.55 113.07 3f1h n ASP 230 Ca -0.00 0.28 -0.09 0.00 0.71 0.00 0.00 54.79 55.69 3f1h n ASP 230 Cb 0.30 0.64 -0.05 0.00 -0.02 0.00 0.00 41.12 41.99 3f1h n ASP 230 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3f1h s HIS 231 N -3.29 -0.35 0.05 1.24 2.46 -1.11 -4.92 115.29 109.37 3f1h s HIS 231 Ca -0.02 0.65 -0.16 0.00 0.47 0.00 0.00 55.06 55.99 3f1h s HIS 231 Cb 0.10 0.44 -0.07 0.00 -0.13 0.00 0.00 32.58 32.92 3f1h s HIS 231 CO 0.81 -0.29 1.26 -1.35 -2.47 0.00 0.00 174.74 172.70 3f1h h PRO 232 N 2.76 -0.35 -3.85 2.88 0.11 -1.81 -3.15 132.00 128.59 3f1h h PRO 232 Ca -0.19 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.81 3f1h h PRO 232 Cb 1.17 0.08 0.01 0.00 0.11 0.00 0.00 31.00 32.36 3f1h h PRO 232 CO 0.27 -0.23 1.51 0.72 -0.21 0.00 0.00 178.00 180.06 3f1h n HIS 233 N -3.86 0.43 -3.14 0.65 8.25 -1.26 -4.64 115.22 111.66 3f1h n HIS 233 Ca -0.04 -0.96 -0.19 0.00 -0.26 0.00 0.00 57.72 56.27 3f1h n HIS 233 Cb 0.20 -0.94 -0.05 0.00 1.12 0.00 0.00 29.99 30.31 3f1h n HIS 233 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3f1h n GLY 234 N 3.95 1.34 0.49 -1.41 0.00 -1.19 -2.47 105.19 105.90 3f1h n GLY 234 Ca 0.15 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.42 3f1h n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1h n GLY 235 N 2.54 0.89 2.81 -0.02 0.00 -1.26 0.15 105.19 110.30 3f1h n GLY 235 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3f1h n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1h n GLY 236 N 0.00 0.00 1.38 -0.02 0.00 -1.26 -4.64 105.19 100.65 3f1h n GLY 236 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 3f1h n GLY 236 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3f1h n GLU 237 N 3.71 1.24 0.00 1.61 0.00 -1.26 -4.71 120.64 121.23 3f1h n GLU 237 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 57.16 56.64 3f1h n GLU 237 Cb 0.34 -1.20 0.00 0.00 0.00 0.00 0.00 31.44 30.58 3f1h n GLU 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3f1h n GLY 238 N 0.57 3.65 1.55 8.31 0.00 -1.26 -4.98 105.19 113.03 3f1h n GLY 238 Ca 0.10 -1.38 -0.29 0.00 0.00 0.00 0.00 46.02 44.46 3f1h n GLY 238 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f1h n ARG 239 N 0.27 0.00 -4.16 1.61 5.12 -1.26 -4.80 116.66 113.44 3f1h n ARG 239 Ca 0.00 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.76 3f1h n ARG 239 Cb 0.00 -0.71 -0.12 0.00 -1.16 0.00 0.00 32.46 30.47 3f1h n ARG 239 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3f1h s ALA 240 N 2.72 0.89 1.16 7.54 0.00 -1.26 -5.12 121.76 127.69 3f1h s ALA 240 Ca 0.56 -0.82 -0.19 0.00 0.00 0.00 0.00 51.96 51.51 3f1h s ALA 240 Cb -0.71 -0.06 0.27 0.00 0.00 0.00 0.00 23.12 22.62 3f1h s ALA 240 CO 0.32 0.10 1.15 -2.14 0.00 0.00 0.00 175.76 175.19 3f1h s PRO 241 N -1.44 -0.91 0.18 0.00 0.02 -1.26 -4.96 135.00 126.63 3f1h s PRO 241 Ca -0.04 -0.13 -0.30 0.00 0.02 0.00 0.00 61.00 60.55 3f1h s PRO 241 Cb -0.09 -1.64 -0.08 0.00 0.02 0.00 0.00 34.50 32.71 3f1h s PRO 241 CO 0.01 -3.49 1.21 1.03 -0.33 0.00 0.00 177.00 175.43 3f1h s ARG 242 N -5.50 4.48 0.00 5.54 3.00 -1.26 -4.86 118.95 120.35 3f1h s ARG 242 Ca 0.71 1.89 0.00 0.00 0.00 0.00 0.00 55.73 58.33 3f1h s ARG 242 Cb -0.09 -3.24 0.00 0.00 0.00 0.00 0.00 34.95 31.63 3f1h s ARG 242 CO 0.55 -0.10 0.39 0.41 0.00 0.00 0.00 175.30 176.55 3f1h n GLY 243 N 2.22 -0.22 0.68 -3.53 0.00 -1.26 -4.93 105.19 98.15 3f1h n GLY 243 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3f1h n GLY 243 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3f1h n ARG 244 N -0.35 -1.87 -3.94 1.61 0.63 -1.26 -5.04 116.66 106.44 3f1h n ARG 244 Ca 0.00 1.42 -0.25 0.00 -0.92 0.00 0.00 57.85 58.10 3f1h n ARG 244 Cb 0.02 -1.70 -0.03 0.00 0.45 0.00 0.00 32.46 31.20 3f1h n ARG 244 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 3f1h s PRO 245 N -4.77 3.44 -0.09 -0.14 0.02 -1.26 -5.00 135.00 127.20 3f1h s PRO 245 Ca 0.00 -0.62 -0.38 0.00 0.02 0.00 0.00 61.00 60.02 3f1h s PRO 245 Cb 0.00 -2.95 -0.18 0.00 0.02 0.00 0.00 34.50 31.39 3f1h s PRO 245 CO 0.00 0.50 1.07 -2.30 -0.33 0.00 0.00 177.00 175.94 3f1h n PRO 246 N -0.70 0.00 -3.93 5.54 -0.02 -1.26 -4.90 135.00 129.72 3f1h n PRO 246 Ca -0.07 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.32 3f1h n PRO 246 Cb 0.54 -1.37 -0.09 0.00 -0.02 0.00 0.00 33.50 32.57 3f1h n PRO 246 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3f1h s ALA 247 N 0.54 -0.03 0.65 3.55 0.00 -1.26 -2.50 121.76 122.70 3f1h s ALA 247 Ca 0.86 -0.63 -0.11 0.00 0.00 0.00 0.00 51.96 52.08 3f1h s ALA 247 Cb -1.20 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 3f1h s ALA 247 CO 0.57 -0.36 1.04 -1.54 0.00 0.00 0.00 175.76 175.46 3f1h s SER 248 N -2.36 5.85 0.50 0.00 1.04 0.18 -4.80 113.70 114.11 3f1h s SER 248 Ca -0.02 1.22 0.39 0.00 0.48 0.00 0.00 55.95 58.03 3f1h s SER 248 Cb 0.01 -2.17 1.56 0.00 0.10 0.00 0.00 66.02 65.52 3f1h s SER 248 CO -0.06 -1.07 1.63 -0.65 0.98 0.00 0.00 173.24 174.06 3f1h h PRO 249 N -0.43 0.04 -0.01 4.02 0.11 -1.91 0.44 132.00 134.27 3f1h h PRO 249 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3f1h h PRO 249 Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3f1h h PRO 249 CO 0.63 0.03 -0.40 0.91 -0.21 0.00 0.00 178.00 178.95 3f1h n TRP 250 N -4.34 0.00 0.00 0.65 8.01 -1.26 -4.63 117.44 115.87 3f1h n TRP 250 Ca 0.39 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.58 3f1h n TRP 250 Cb 1.63 -0.04 0.00 0.00 -2.01 0.00 0.00 31.31 30.89 3f1h n TRP 250 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3f1h n GLY 251 N 1.39 0.69 3.87 6.99 0.00 0.16 -5.09 105.19 113.19 3f1h n GLY 251 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 3f1h n GLY 251 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3f1h s TRP 252 N -2.00 3.42 0.81 1.61 1.48 -1.26 -4.69 118.94 118.31 3f1h s TRP 252 Ca 0.00 1.03 -0.14 0.00 -1.06 0.00 0.00 56.10 55.93 3f1h s TRP 252 Cb 0.00 -2.41 0.02 0.00 -1.16 0.00 0.00 33.47 29.92 3f1h s TRP 252 CO 0.00 0.07 0.73 1.04 -4.06 0.00 0.00 176.95 174.73 3f1h n GLN 253 N -0.67 0.13 0.00 3.25 1.13 -1.26 -0.65 117.38 119.31 3f1h n GLN 253 Ca 0.02 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.18 3f1h n GLN 253 Cb 0.53 -2.05 0.00 0.00 0.11 0.00 0.00 30.24 28.84 3f1h n GLN 253 CO 0.00 0.00 0.00 -2.37 -1.44 0.00 0.00 177.06 173.25 3f1h n THR 254 N -2.98 0.00 -3.74 5.09 5.66 -1.04 -4.68 114.28 112.60 3f1h n THR 254 Ca 0.10 -0.01 -0.36 0.00 -3.05 0.00 0.00 64.05 60.73 3f1h n THR 254 Cb 0.51 1.00 -0.10 0.00 -1.55 0.00 0.00 70.33 70.19 3f1h n THR 254 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 3f1h s LYS 255 N -0.02 3.98 -0.21 1.09 0.00 -1.26 -4.83 119.74 118.49 3f1h s LYS 255 Ca 0.00 -0.32 -0.15 0.00 0.00 0.00 0.00 55.97 55.50 3f1h s LYS 255 Cb 0.00 -3.46 0.02 0.00 0.00 0.00 0.00 37.83 34.40 3f1h s LYS 255 CO 0.00 0.04 0.27 0.41 0.00 0.00 0.00 175.35 176.07 3f1h n GLY 256 N 4.32 -0.28 3.05 0.59 0.00 -1.26 -5.02 105.19 106.59 3f1h n GLY 256 Ca -0.15 0.52 -0.03 0.00 0.00 0.00 0.00 46.02 46.36 3f1h n GLY 256 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3f1h s LEU 257 N -1.65 -1.29 0.15 0.99 0.20 -1.26 -5.10 118.68 110.72 3f1h s LEU 257 Ca 0.15 -1.13 -0.34 0.00 0.69 0.00 0.00 54.13 53.50 3f1h s LEU 257 Cb -0.02 1.75 -0.15 0.00 -0.43 0.00 0.00 46.19 47.34 3f1h s LEU 257 CO 0.41 -0.15 1.42 0.29 -0.29 0.00 0.00 176.35 178.02 3f1h n LYS 258 N 4.05 1.65 -0.00 1.98 5.02 -1.26 -4.87 118.16 124.72 3f1h n LYS 258 Ca 0.13 0.59 0.05 0.00 -2.02 0.00 0.00 58.31 57.07 3f1h n LYS 258 Cb 0.55 -2.27 -0.07 0.00 -0.02 0.00 0.00 35.03 33.22 3f1h n LYS 258 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3f1h n THR 259 N 2.64 0.00 -1.64 -0.18 -2.24 -1.26 -5.01 114.28 106.59 3f1h n THR 259 Ca 0.16 -0.25 -0.51 0.00 -2.27 0.00 0.00 64.05 61.19 3f1h n THR 259 Cb 0.25 0.73 -0.05 0.00 -2.10 0.00 0.00 70.33 69.16 3f1h n THR 259 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3f1h n ARG 260 N -1.49 1.59 -1.69 -0.78 0.63 -1.26 -4.84 116.66 108.83 3f1h n ARG 260 Ca 0.01 0.58 -0.44 0.00 -0.92 0.00 0.00 57.85 57.07 3f1h n ARG 260 Cb 0.22 -2.29 -0.04 0.00 0.45 0.00 0.00 32.46 30.80 3f1h n ARG 260 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 3f1h n LYS 261 N 3.73 2.55 0.07 -0.14 4.81 -1.26 -4.90 118.16 123.03 3f1h n LYS 261 Ca 0.20 0.93 -0.05 0.00 -0.87 0.00 0.00 58.31 58.51 3f1h n LYS 261 Cb 0.22 -2.78 -0.03 0.00 0.02 0.00 0.00 35.03 32.46 3f1h n LYS 261 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3f1h h ARG 262 N 7.80 -0.27 -0.99 1.64 3.08 -2.00 -3.19 114.38 120.45 3f1h h ARG 262 Ca -0.46 0.02 -0.12 0.00 0.07 0.00 0.00 59.98 59.49 3f1h h ARG 262 Cb 1.23 0.06 -0.07 0.00 0.08 0.00 0.00 29.97 31.27 3f1h h ARG 262 CO 0.93 -0.18 0.15 2.89 -1.07 0.00 0.00 179.97 182.70 3f1h n ARG 263 N -3.30 1.41 -1.69 0.04 1.85 -1.26 -4.91 116.66 108.80 3f1h n ARG 263 Ca -0.03 -0.79 -0.44 0.00 -1.00 0.00 0.00 57.85 55.58 3f1h n ARG 263 Cb 0.14 -1.35 -0.04 0.00 -1.05 0.00 0.00 32.46 30.16 3f1h n ARG 263 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 3f1h n LYS 264 N 0.08 2.48 -0.13 2.89 4.81 -1.21 -4.86 118.16 122.22 3f1h n LYS 264 Ca 0.15 0.89 0.04 0.00 -0.87 0.00 0.00 58.31 58.53 3f1h n LYS 264 Cb 0.77 -2.72 0.36 0.00 0.02 0.00 0.00 35.03 33.46 3f1h n LYS 264 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 3f1h h PRO 265 N 6.82 0.72 -0.95 1.64 0.13 -1.94 -1.21 132.00 137.21 3f1h h PRO 265 Ca -0.45 -0.04 0.27 0.00 -0.87 0.00 0.00 66.00 64.91 3f1h h PRO 265 Cb 1.23 -0.16 -0.14 0.00 0.13 0.00 0.00 31.00 32.06 3f1h h PRO 265 CO 0.93 0.48 0.46 1.03 -0.23 0.00 0.00 178.00 180.66 3f1h h SER 266 N 0.74 0.39 -1.00 1.44 0.87 -1.98 -3.23 113.55 110.78 3f1h h SER 266 Ca 0.25 0.18 0.11 0.00 -1.23 0.00 0.00 61.79 61.10 3f1h h SER 266 Cb 0.08 0.15 -0.13 0.00 -0.44 0.00 0.00 62.40 62.05 3f1h h SER 266 CO -0.07 -0.07 -0.52 -1.20 -0.53 0.00 0.00 176.83 174.44 3f1h n SER 267 N -5.06 -0.91 -0.02 6.23 7.64 -0.46 -1.05 113.62 119.98 3f1h n SER 267 Ca 0.27 1.77 0.00 0.00 1.01 0.00 0.00 58.87 61.91 3f1h n SER 267 Cb 0.81 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 3f1h n SER 267 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 3f1h n ARG 268 N -5.33 0.17 -0.41 1.43 1.85 -1.22 -1.22 116.66 111.94 3f1h n ARG 268 Ca 0.05 0.00 0.08 0.00 -1.00 0.00 0.00 57.85 56.98 3f1h n ARG 268 Cb 0.31 -1.00 0.24 0.00 -1.05 0.00 0.00 32.46 30.96 3f1h n ARG 268 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3f1h n PHE 269 N -0.46 0.88 -4.21 2.89 3.01 -0.22 -5.03 117.46 114.34 3f1h n PHE 269 Ca 0.00 -0.81 -0.12 0.00 1.01 0.00 0.00 57.45 57.53 3f1h n PHE 269 Cb 0.00 -0.27 -0.10 0.00 -0.01 0.00 0.00 39.48 39.10 3f1h n PHE 269 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 3f1h s ILE 270 N -2.51 0.41 -0.26 4.37 -5.25 -0.36 -1.46 121.20 116.15 3f1h s ILE 270 Ca 0.39 -1.95 -0.04 0.00 -0.99 0.00 0.00 60.65 58.06 3f1h s ILE 270 Cb 0.30 -2.14 0.09 0.00 2.95 0.00 0.00 42.46 43.67 3f1h s ILE 270 CO 0.10 -0.42 0.13 -0.63 -1.79 0.00 0.00 174.94 172.32 3f1h s ILE 271 N -3.84 -0.09 0.00 8.37 1.09 0.22 -4.96 121.20 121.99 3f1h s ILE 271 Ca 0.25 -0.60 0.00 0.00 -1.10 0.00 0.00 60.65 59.21 3f1h s ILE 271 Cb 0.07 -0.88 0.00 0.00 -1.06 0.00 0.00 42.46 40.59 3f1h s ILE 271 CO 0.04 -0.61 0.00 0.00 -0.10 0.00 0.00 174.94 174.27