#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mfw n ARG 6 N 0.00 0.28 -2.81 -1.46 5.12 -1.26 -4.71 116.66 111.82 3mfw n ARG 6 Ca 0.00 0.02 -0.37 0.00 -1.93 0.00 0.00 57.85 55.57 3mfw n ARG 6 Cb 0.00 -1.93 -0.06 0.00 -1.16 0.00 0.00 32.46 29.30 3mfw n ARG 6 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3mfw s THR 7 N 9.06 4.23 0.00 0.55 2.01 -1.26 -3.78 115.64 126.46 3mfw s THR 7 Ca 1.25 1.80 0.06 0.00 0.31 0.00 0.00 61.69 65.11 3mfw s THR 7 Cb -1.06 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 67.40 3mfw s THR 7 CO 0.47 0.20 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.79 3mfw s ILE 8 N -1.54 1.42 -0.26 1.82 1.01 0.42 -0.39 121.20 123.68 3mfw s ILE 8 Ca 0.48 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 60.28 3mfw s ILE 8 Cb -0.19 -1.20 0.06 0.00 0.01 0.00 0.00 42.46 41.14 3mfw s ILE 8 CO 0.24 0.31 -0.07 -0.83 0.00 0.00 0.00 174.94 174.60 3mfw s GLY 9 N -0.64 1.52 0.04 6.18 0.00 0.86 -0.76 107.32 114.53 3mfw s GLY 9 Ca 0.06 -1.66 -0.30 0.00 0.00 0.00 0.00 44.72 42.82 3mfw s GLY 9 CO 0.00 0.78 1.13 -0.42 0.00 0.00 0.00 173.10 174.59 3mfw s ILE 10 N 1.21 4.31 -0.10 0.90 -1.09 0.69 -0.86 121.20 126.26 3mfw s ILE 10 Ca -0.06 1.66 0.01 0.00 -2.23 0.00 0.00 60.65 60.03 3mfw s ILE 10 Cb -0.19 -4.06 0.02 0.00 -1.58 0.00 0.00 42.46 36.64 3mfw s ILE 10 CO -0.06 0.13 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.05 3mfw s ILE 11 N 1.03 1.15 -0.07 2.92 1.01 0.30 -0.60 121.20 126.94 3mfw s ILE 11 Ca 0.56 -0.41 -0.22 0.00 0.00 0.00 0.00 60.65 60.58 3mfw s ILE 11 Cb -0.27 -1.11 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 3mfw s ILE 11 CO 0.29 0.38 0.65 -0.83 0.00 0.00 0.00 174.94 175.42 3mfw s GLY 12 N 1.29 2.58 -0.52 6.18 0.00 -0.26 -0.52 107.32 116.06 3mfw s GLY 12 Ca -0.02 0.06 0.06 0.00 0.00 0.00 0.00 44.72 44.81 3mfw s GLY 12 CO -0.04 1.06 0.50 0.00 0.00 0.00 0.00 173.10 174.61 3mfw n ALA 13 N 3.64 3.11 -2.18 3.20 0.00 0.50 -1.10 120.51 127.69 3mfw n ALA 13 Ca -0.03 -3.83 -0.31 0.00 0.00 0.00 0.00 53.44 49.27 3mfw n ALA 13 Cb 0.51 -0.86 -0.05 0.00 0.00 0.00 0.00 19.45 19.06 3mfw n ALA 13 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3mfw s PRO 14 N -1.09 2.82 -0.03 0.00 0.04 -1.26 -3.54 135.00 131.93 3mfw s PRO 14 Ca 0.33 -0.87 -0.02 0.00 0.04 0.00 0.00 61.00 60.48 3mfw s PRO 14 Cb 0.07 -5.21 0.02 0.00 0.04 0.00 0.00 34.50 29.42 3mfw s PRO 14 CO -0.14 -3.31 0.08 0.12 0.04 0.00 0.00 177.00 173.80 3mfw s PHE 15 N 9.11 -0.08 0.00 0.56 5.36 -1.26 -4.84 117.98 126.83 3mfw s PHE 15 Ca 0.65 0.25 0.00 0.00 -0.96 0.00 0.00 56.93 56.87 3mfw s PHE 15 Cb -0.03 -0.06 0.00 0.00 -0.34 0.00 0.00 43.02 42.60 3mfw s PHE 15 CO 0.04 -0.08 0.22 -1.13 -1.46 0.00 0.00 175.22 172.81 3mfw n SER 16 N 3.57 0.45 0.00 6.13 3.41 -1.26 -1.07 113.62 124.84 3mfw n SER 16 Ca -0.19 -0.82 0.10 0.00 -0.26 0.00 0.00 58.87 57.70 3mfw n SER 16 Cb 0.56 0.16 0.52 0.00 -0.26 0.00 0.00 64.21 65.19 3mfw n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3mfw n LYS 17 N -0.16 0.27 0.00 4.33 4.76 -1.26 -2.04 118.16 124.06 3mfw n LYS 17 Ca 0.00 0.09 0.10 0.00 -2.87 0.00 0.00 58.31 55.63 3mfw n LYS 17 Cb 0.07 -1.50 0.53 0.00 -1.84 0.00 0.00 35.03 32.29 3mfw n LYS 17 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mfw n GLY 18 N 0.54 -0.79 3.68 0.72 0.00 -1.26 -4.74 105.19 103.34 3mfw n GLY 18 Ca 0.09 -0.10 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 3mfw n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3mfw s GLN 19 N -2.33 1.67 0.30 1.61 1.03 -0.87 -0.82 119.66 120.26 3mfw s GLN 19 Ca 0.23 -1.19 0.16 0.00 0.04 0.00 0.00 55.36 54.59 3mfw s GLN 19 Cb 0.13 0.52 0.21 0.00 0.03 0.00 0.00 33.01 33.91 3mfw s GLN 19 CO 0.26 -0.73 1.51 -1.35 -2.54 0.00 0.00 175.29 172.45 3mfw h PRO 20 N 2.15 0.00 -5.79 9.60 0.11 -1.89 -3.45 132.00 132.73 3mfw h PRO 20 Ca -0.24 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.27 3mfw h PRO 20 Cb 1.25 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.26 3mfw h PRO 20 CO 0.32 0.49 0.41 1.03 -0.21 0.00 0.00 178.00 180.04 3mfw s ARG 21 N -3.10 3.98 0.56 1.05 0.52 -1.26 -4.98 118.95 115.71 3mfw s ARG 21 Ca 0.03 0.62 0.23 0.00 -0.52 0.00 0.00 55.73 56.09 3mfw s ARG 21 Cb 0.08 -3.72 1.54 0.00 0.52 0.00 0.00 34.95 33.37 3mfw s ARG 21 CO 0.73 -0.67 2.18 0.78 0.02 0.00 0.00 175.30 178.34 3mfw h GLY 22 N 9.46 0.00 1.85 -3.53 0.00 -1.88 -3.33 103.07 105.64 3mfw h GLY 22 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3mfw h GLY 22 CO 0.89 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.04 3mfw n GLY 23 N -1.44 -1.02 0.30 4.60 0.00 -1.26 -3.04 105.19 103.33 3mfw n GLY 23 Ca -0.02 -0.07 0.20 0.00 0.00 0.00 0.00 46.02 46.13 3mfw n GLY 23 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3mfw h VAL 24 N 0.00 0.00 0.00 1.61 3.04 -1.78 0.41 116.25 119.54 3mfw h VAL 24 Ca 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 3mfw h VAL 24 Cb 0.25 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.54 3mfw h VAL 24 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.57 176.23 3mfw h GLU 25 N 0.00 0.00 -0.00 4.17 5.08 -1.73 -0.18 114.58 121.92 3mfw h GLU 25 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mfw h GLU 25 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3mfw h GLU 25 CO 0.00 0.00 -0.13 0.39 -1.00 0.00 0.00 179.01 178.27 3mfw n GLU 26 N -2.90 0.22 -0.14 2.33 -0.58 0.14 -4.34 120.64 115.36 3mfw n GLU 26 Ca -0.02 -0.05 -0.04 0.00 -0.42 0.00 0.00 57.16 56.63 3mfw n GLU 26 Cb 0.12 -1.50 0.05 0.00 -0.57 0.00 0.00 31.44 29.54 3mfw n GLU 26 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 3mfw h GLY 27 N 4.99 0.56 0.62 0.62 0.00 -1.55 -0.29 103.07 108.02 3mfw h GLY 27 Ca 0.00 -0.04 0.08 0.00 0.00 0.00 0.00 47.33 47.37 3mfw h GLY 27 CO 0.00 -0.04 0.55 -2.55 0.00 0.00 0.00 176.54 174.50 3mfw h PRO 28 N 0.25 0.93 -0.14 4.80 0.11 -1.75 -1.14 132.00 135.06 3mfw h PRO 28 Ca 0.22 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 3mfw h PRO 28 Cb 0.27 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 3mfw h PRO 28 CO -0.28 0.61 0.04 1.15 -0.21 0.00 0.00 178.00 179.32 3mfw h THR 29 N 0.96 1.19 -0.24 -1.15 2.02 -1.61 -1.92 112.91 112.16 3mfw h THR 29 Ca 0.41 -0.58 -0.19 0.00 0.77 0.00 0.00 66.41 66.82 3mfw h THR 29 Cb 0.29 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 3mfw h THR 29 CO -0.21 0.18 -0.60 0.58 0.37 0.00 0.00 175.52 175.83 3mfw h VAL 30 N 0.04 1.28 -0.47 3.16 2.07 -0.85 0.07 116.25 121.55 3mfw h VAL 30 Ca 0.04 -1.80 -0.00 0.00 0.82 0.00 0.00 66.70 65.76 3mfw h VAL 30 Cb 0.24 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 3mfw h VAL 30 CO -0.00 0.58 0.30 -0.07 0.02 0.00 0.00 177.57 178.39 3mfw h LEU 31 N 0.60 0.56 -0.74 2.57 3.38 -1.20 -2.18 115.31 118.29 3mfw h LEU 31 Ca -0.00 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 3mfw h LEU 31 Cb 1.20 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 3mfw h LEU 31 CO 0.13 0.44 0.28 0.03 0.09 0.00 0.00 178.44 179.41 3mfw h ARG 32 N 0.63 1.12 0.00 1.13 3.08 -1.26 -2.07 114.38 117.02 3mfw h ARG 32 Ca 0.17 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3mfw h ARG 32 Cb -0.03 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.84 3mfw h ARG 32 CO -0.03 0.93 0.00 -0.22 -1.07 0.00 0.00 179.97 179.58 3mfw h LYS 33 N 1.08 0.00 -0.26 0.04 3.64 -0.61 -0.92 116.57 119.54 3mfw h LYS 33 Ca 0.25 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 3mfw h LYS 33 Cb 0.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3mfw h LYS 33 CO -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.16 3mfw n ALA 34 N -1.86 2.48 -1.37 5.00 0.00 -0.79 -4.87 120.51 119.10 3mfw n ALA 34 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.89 3mfw n ALA 34 Cb 0.16 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3mfw n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mfw n GLY 35 N 1.07 0.79 0.33 0.00 0.00 -0.35 -4.98 105.19 102.04 3mfw n GLY 35 Ca 0.13 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3mfw n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3mfw h LEU 36 N 0.00 0.87 -0.21 0.99 5.85 -1.62 -1.34 115.31 119.86 3mfw h LEU 36 Ca 0.00 0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.53 3mfw h LEU 36 Cb 0.65 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.51 3mfw h LEU 36 CO 0.00 0.57 -0.65 -0.07 -0.34 0.00 0.00 178.44 177.95 3mfw h LEU 37 N 1.01 0.94 -0.82 2.25 4.07 -1.87 -1.20 115.31 119.69 3mfw h LEU 37 Ca 0.37 -0.59 -0.09 0.00 0.08 0.00 0.00 57.88 57.66 3mfw h LEU 37 Cb 0.14 -0.27 -0.02 0.00 1.08 0.00 0.00 40.66 41.59 3mfw h LEU 37 CO -0.16 1.36 -0.12 -0.33 -1.08 0.00 0.00 178.44 178.10 3mfw h GLU 38 N 0.56 0.75 -0.28 1.13 3.07 -1.90 -1.19 114.58 116.72 3mfw h GLU 38 Ca -0.02 -0.25 -0.06 0.00 -0.50 0.00 0.00 59.36 58.53 3mfw h GLU 38 Cb 1.27 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 29.10 3mfw h GLU 38 CO 0.14 0.84 -0.08 0.87 -1.40 0.00 0.00 179.01 179.38 3mfw h LYS 39 N 0.68 0.46 -0.47 2.33 1.57 -0.93 0.28 116.57 120.50 3mfw h LYS 39 Ca 0.11 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 3mfw h LYS 39 Cb 0.60 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 3mfw h LYS 39 CO 0.04 0.55 -0.18 -0.07 -0.57 0.00 0.00 179.45 179.22 3mfw h LEU 40 N 0.43 0.93 -1.07 2.94 3.38 -0.66 -2.58 115.31 118.68 3mfw h LEU 40 Ca 0.09 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.63 3mfw h LEU 40 Cb 0.41 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3mfw h LEU 40 CO 0.02 1.08 -0.42 0.11 0.09 0.00 0.00 178.44 179.32 3mfw h LYS 41 N 0.80 0.08 0.00 1.13 1.57 -0.49 -1.98 116.57 117.68 3mfw h LYS 41 Ca 0.12 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3mfw h LYS 41 Cb 0.72 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 3mfw h LYS 41 CO 0.06 0.49 -0.08 0.93 -0.57 0.00 0.00 179.45 180.28 3mfw h GLU 42 N 0.07 0.00 0.00 3.15 5.08 -0.06 -3.41 114.58 119.40 3mfw h GLU 42 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mfw h GLU 42 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 3mfw h GLU 42 CO 0.06 0.08 0.00 0.00 -1.00 0.00 0.00 179.01 178.15 3mfw n GLN 43 N -3.74 3.80 -1.24 2.33 10.64 -0.75 -4.93 117.38 123.49 3mfw n GLN 43 Ca -0.02 0.00 -0.30 0.00 -1.83 0.00 0.00 57.00 54.85 3mfw n GLN 43 Cb 0.18 0.00 -0.08 0.00 -0.86 0.00 0.00 30.24 29.48 3mfw n GLN 43 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 3mfw n GLU 44 N 0.00 3.15 -3.84 2.61 -0.00 -1.26 -4.91 120.64 116.39 3mfw n GLU 44 Ca 0.00 -1.85 -0.20 0.00 -0.00 0.00 0.00 57.16 55.10 3mfw n GLU 44 Cb 0.00 -2.51 -0.17 0.00 -0.00 0.00 0.00 31.44 28.76 3mfw n GLU 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3mfw s ASP 46 N 1.61 6.29 -0.31 0.00 -1.08 -1.25 -4.36 116.67 117.58 3mfw s ASP 46 Ca -0.01 -0.51 -0.06 0.00 -0.52 0.00 0.00 52.55 51.46 3mfw s ASP 46 Cb -0.13 -2.43 0.03 0.00 -1.46 0.00 0.00 42.92 38.93 3mfw s ASP 46 CO -0.03 -1.28 0.06 -0.69 0.52 0.00 0.00 175.17 173.75 3mfw s VAL 47 N 3.99 3.67 -0.15 1.11 1.01 -1.26 -0.43 120.40 128.33 3mfw s VAL 47 Ca 0.28 -0.96 -0.07 0.00 0.00 0.00 0.00 61.98 61.23 3mfw s VAL 47 Cb -0.13 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 3mfw s VAL 47 CO 0.17 -0.02 0.09 -0.54 0.00 0.00 0.00 175.10 174.80 3mfw s LYS 48 N 1.42 3.74 -0.27 2.72 -0.14 0.06 -4.99 119.74 122.28 3mfw s LYS 48 Ca -0.00 -0.26 -0.20 0.00 -1.36 0.00 0.00 55.97 54.16 3mfw s LYS 48 Cb -0.18 -3.20 -0.02 0.00 -1.68 0.00 0.00 37.83 32.75 3mfw s LYS 48 CO 0.01 0.49 0.59 0.34 -0.76 0.00 0.00 175.35 176.03 3mfw s ASP 49 N -0.22 6.52 -0.08 2.83 -1.08 -1.26 -0.22 116.67 123.15 3mfw s ASP 49 Ca 0.09 0.60 0.08 0.00 -0.52 0.00 0.00 52.55 52.80 3mfw s ASP 49 Cb -0.12 -2.32 0.37 0.00 -1.46 0.00 0.00 42.92 39.39 3mfw s ASP 49 CO 0.01 -0.36 1.14 -1.22 0.52 0.00 0.00 175.17 175.25 3mfw n TYR 50 N 5.69 0.85 -2.46 -5.34 4.02 0.23 -4.91 117.16 115.23 3mfw n TYR 50 Ca -0.02 -0.31 0.03 0.00 -0.01 0.00 0.00 57.90 57.59 3mfw n TYR 50 Cb 0.49 -0.22 -0.01 0.00 -0.02 0.00 0.00 39.34 39.59 3mfw n TYR 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3mfw n GLY 51 N 0.51 -1.93 3.70 2.72 0.00 -1.26 -4.80 105.19 104.13 3mfw n GLY 51 Ca 0.13 -1.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.45 3mfw n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3mfw s ASP 52 N -3.86 6.13 0.23 1.61 1.01 -1.26 -1.11 116.67 119.42 3mfw s ASP 52 Ca 0.00 0.18 -0.31 0.00 0.71 0.00 0.00 52.55 53.13 3mfw s ASP 52 Cb 0.00 -2.08 -0.14 0.00 1.01 0.00 0.00 42.92 41.71 3mfw s ASP 52 CO 0.00 0.15 1.40 0.18 0.21 0.00 0.00 175.17 177.11 3mfw n LEU 53 N 3.75 3.01 -4.52 1.23 4.77 -0.26 -4.92 117.00 120.07 3mfw n LEU 53 Ca -0.16 1.14 -0.43 0.00 -0.03 0.00 0.00 56.01 56.53 3mfw n LEU 53 Cb 0.52 -1.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.16 3mfw n LEU 53 CO 0.36 -0.52 0.81 -2.16 -1.33 0.00 0.00 177.39 174.55 3mfw s PRO 54 N -0.33 3.31 -0.56 3.23 0.04 -1.26 -4.59 135.00 134.84 3mfw s PRO 54 Ca 0.69 -0.28 -0.18 0.00 0.04 0.00 0.00 61.00 61.27 3mfw s PRO 54 Cb -0.66 -4.08 0.10 0.00 0.04 0.00 0.00 34.50 29.90 3mfw s PRO 54 CO 0.49 -1.59 0.63 -0.06 0.04 0.00 0.00 177.00 176.51 3mfw s PHE 55 N 4.18 3.08 0.69 0.56 0.08 -1.26 -5.06 117.98 120.24 3mfw s PHE 55 Ca 0.31 -1.00 -0.15 0.00 0.12 0.00 0.00 56.93 56.21 3mfw s PHE 55 Cb -0.12 -3.86 0.02 0.00 -0.57 0.00 0.00 43.02 38.48 3mfw s PHE 55 CO 0.18 -1.17 1.16 0.00 -0.10 0.00 0.00 175.22 175.29 3mfw s ALA 56 N 2.35 2.31 0.84 5.36 0.00 -1.26 -4.98 121.76 126.37 3mfw s ALA 56 Ca 0.09 0.73 -0.10 0.00 0.00 0.00 0.00 51.96 52.68 3mfw s ALA 56 Cb -0.25 -3.40 0.10 0.00 0.00 0.00 0.00 23.12 19.57 3mfw s ALA 56 CO 0.06 -1.55 1.11 0.34 0.00 0.00 0.00 175.76 175.72 3mfw s ASP 57 N -2.26 3.81 -0.36 0.00 2.15 -1.26 -5.01 116.67 113.74 3mfw s ASP 57 Ca 0.71 1.93 0.00 0.00 0.43 0.00 0.00 52.55 55.62 3mfw s ASP 57 Cb -0.25 -2.51 0.12 0.00 -0.30 0.00 0.00 42.92 39.97 3mfw s ASP 57 CO 0.42 -2.49 0.16 -0.63 -0.17 0.00 0.00 175.17 172.46 3mfw s ILE 58 N -2.81 0.89 0.03 4.11 1.01 -1.26 -5.02 121.20 118.15 3mfw s ILE 58 Ca 0.63 -1.80 -0.25 0.00 0.00 0.00 0.00 60.65 59.24 3mfw s ILE 58 Cb -0.19 -1.65 -0.17 0.00 0.01 0.00 0.00 42.46 40.45 3mfw s ILE 58 CO 0.57 -0.80 1.47 -0.65 0.00 0.00 0.00 174.94 175.53 3mfw h PRO 59 N 7.49 -0.14 -3.01 2.79 0.11 -2.05 -3.20 132.00 133.99 3mfw h PRO 59 Ca -0.07 0.01 -0.70 0.00 0.11 0.00 0.00 66.00 65.35 3mfw h PRO 59 Cb 0.98 0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 3mfw h PRO 59 CO 0.44 0.10 3.22 0.09 -0.21 0.00 0.00 178.00 181.64 3mfw n ASN 60 N -5.05 7.81 -3.67 -2.05 3.02 -1.26 -4.73 115.26 109.34 3mfw n ASN 60 Ca -0.08 -2.81 -0.36 0.00 -0.03 0.00 0.00 54.58 51.29 3mfw n ASN 60 Cb 0.17 -1.50 -0.02 0.00 -0.61 0.00 0.00 39.78 37.82 3mfw n ASN 60 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3mfw n ASP 61 N 3.27 5.45 -4.77 6.41 -0.08 -1.21 -5.03 116.55 120.60 3mfw n ASP 61 Ca 0.68 -3.48 -0.38 0.00 -1.51 0.00 0.00 54.79 50.10 3mfw n ASP 61 Cb 0.26 -0.99 0.00 0.00 2.34 0.00 0.00 41.12 42.73 3mfw n ASP 61 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 3mfw s SER 62 N -2.14 6.05 0.47 1.67 0.01 -1.26 -4.32 113.70 114.18 3mfw s SER 62 Ca 0.37 2.46 -0.24 0.00 1.31 0.00 0.00 55.95 59.84 3mfw s SER 62 Cb 0.12 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.65 3mfw s SER 62 CO 0.02 -1.01 1.34 -0.81 0.41 0.00 0.00 173.24 173.19 3mfw n PRO 63 N -0.44 1.96 -3.09 12.44 -0.04 -1.26 -4.57 135.00 140.00 3mfw n PRO 63 Ca 0.07 0.70 -0.43 0.00 -0.04 0.00 0.00 63.50 63.80 3mfw n PRO 63 Cb 0.47 -2.51 -0.06 0.00 -0.04 0.00 0.00 33.50 31.35 3mfw n PRO 63 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3mfw s PHE 64 N -1.23 2.99 0.00 0.54 5.36 -0.85 -4.93 117.98 119.86 3mfw s PHE 64 Ca 0.64 -0.42 0.00 0.00 -0.96 0.00 0.00 56.93 56.19 3mfw s PHE 64 Cb -0.46 -3.65 0.00 0.00 -0.34 0.00 0.00 43.02 38.57 3mfw s PHE 64 CO 0.55 -1.10 0.00 0.94 -1.46 0.00 0.00 175.22 174.15 3mfw n GLN 65 N 6.45 0.00 0.00 10.12 7.27 -1.26 -0.85 117.38 139.11 3mfw n GLN 65 Ca -0.05 0.00 0.11 0.00 0.07 0.00 0.00 57.00 57.13 3mfw n GLN 65 Cb 0.46 0.00 0.03 0.00 2.41 0.00 0.00 30.24 33.14 3mfw n GLN 65 CO 0.00 0.00 0.00 1.51 0.07 0.00 0.00 177.06 178.64 3mfw n ILE 66 N 0.00 0.02 -2.03 1.69 3.06 -1.26 -4.91 119.36 115.93 3mfw n ILE 66 Ca 0.00 -0.04 -0.43 0.00 -2.50 0.00 0.00 62.75 59.78 3mfw n ILE 66 Cb 0.00 0.61 -0.03 0.00 0.54 0.00 0.00 39.64 40.77 3mfw n ILE 66 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 3mfw s VAL 67 N -3.04 3.59 0.21 9.51 1.01 -0.03 -4.38 120.40 127.28 3mfw s VAL 67 Ca 0.08 0.69 -0.04 0.00 0.00 0.00 0.00 61.98 62.72 3mfw s VAL 67 Cb 0.16 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.96 3mfw s VAL 67 CO 0.80 -0.16 0.44 -0.54 0.00 0.00 0.00 175.10 175.64 3mfw s LYS 68 N 4.45 3.60 -1.42 2.72 1.02 0.14 -2.01 119.74 128.23 3mfw s LYS 68 Ca 0.74 -0.14 -0.02 0.00 0.02 0.00 0.00 55.97 56.57 3mfw s LYS 68 Cb -0.30 -2.78 0.02 0.00 -0.52 0.00 0.00 37.83 34.25 3mfw s LYS 68 CO 0.30 0.36 0.52 0.09 -0.92 0.00 0.00 175.35 175.71 3mfw n ASN 69 N -0.49 -0.94 -0.11 2.83 3.02 -1.26 -4.57 115.26 113.74 3mfw n ASN 69 Ca -0.03 -0.96 -0.09 0.00 -0.03 0.00 0.00 54.58 53.47 3mfw n ASN 69 Cb 0.53 -3.24 0.07 0.00 -0.61 0.00 0.00 39.78 36.53 3mfw n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3mfw h PRO 70 N -1.83 0.83 -0.21 3.52 0.13 -1.81 -1.90 132.00 130.74 3mfw h PRO 70 Ca -0.62 -0.34 -0.11 0.00 -0.87 0.00 0.00 66.00 64.06 3mfw h PRO 70 Cb 1.37 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 3mfw h PRO 70 CO 0.63 0.97 -0.35 0.00 -0.23 0.00 0.00 178.00 179.01 3mfw h ARG 71 N 0.73 0.44 -0.19 0.86 3.08 -1.88 0.14 114.38 117.56 3mfw h ARG 71 Ca 0.10 -0.20 -0.14 0.00 0.07 0.00 0.00 59.98 59.81 3mfw h ARG 71 Cb 0.74 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.79 3mfw h ARG 71 CO 0.06 0.74 -0.42 0.77 -1.07 0.00 0.00 179.97 180.05 3mfw h SER 72 N 0.38 0.70 -0.37 7.04 0.02 -1.82 -0.68 113.55 118.82 3mfw h SER 72 Ca 0.04 -0.56 -0.04 0.00 -0.84 0.00 0.00 61.79 60.39 3mfw h SER 72 Cb 0.80 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 3mfw h SER 72 CO 0.06 1.13 0.07 0.58 -1.14 0.00 0.00 176.83 177.54 3mfw h VAL 73 N 0.30 1.23 -1.00 2.27 2.07 -1.17 -0.58 116.25 119.38 3mfw h VAL 73 Ca 0.00 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.72 3mfw h VAL 73 Cb 1.03 1.05 -0.05 0.00 -1.52 0.00 0.00 31.29 31.79 3mfw h VAL 73 CO 0.09 0.28 0.66 1.23 0.02 0.00 0.00 177.57 179.85 3mfw h GLY 74 N 0.46 1.42 1.54 2.17 0.00 -0.71 -1.73 103.07 106.21 3mfw h GLY 74 Ca 0.12 -0.52 -0.22 0.00 0.00 0.00 0.00 47.33 46.70 3mfw h GLY 74 CO 0.00 0.50 -0.93 1.70 0.00 0.00 0.00 176.54 177.82 3mfw h LYS 75 N 1.34 0.42 -0.89 4.80 1.63 -0.89 -0.19 116.57 122.79 3mfw h LYS 75 Ca 0.37 -0.44 -0.01 0.00 -0.85 0.00 0.00 60.65 59.72 3mfw h LYS 75 Cb -0.13 0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.58 3mfw h LYS 75 CO -0.09 1.10 0.50 0.00 -3.45 0.00 0.00 179.45 177.52 3mfw h ALA 76 N 0.74 1.13 -0.12 5.00 0.00 -0.95 -0.12 119.26 124.94 3mfw h ALA 76 Ca -0.08 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.50 3mfw h ALA 76 Cb 1.56 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3mfw h ALA 76 CO 0.16 0.62 -0.77 0.77 0.00 0.00 0.00 179.25 180.03 3mfw h SER 77 N 1.23 0.76 -0.42 0.00 0.02 -1.27 -1.50 113.55 112.37 3mfw h SER 77 Ca 0.31 -0.50 0.06 0.00 -0.84 0.00 0.00 61.79 60.82 3mfw h SER 77 Cb -0.00 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.26 3mfw h SER 77 CO -0.05 1.28 0.11 -0.08 -1.14 0.00 0.00 176.83 176.95 3mfw h GLU 78 N 0.43 0.25 -0.29 3.45 4.81 -0.62 0.22 114.58 122.84 3mfw h GLU 78 Ca -0.05 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3mfw h GLU 78 Cb 1.38 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.69 3mfw h GLU 78 CO 0.15 0.17 0.18 1.96 -0.73 0.00 0.00 179.01 180.73 3mfw h GLN 79 N 0.26 0.39 -0.76 1.92 4.20 -0.98 -2.61 115.11 117.53 3mfw h GLN 79 Ca 0.20 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.82 3mfw h GLN 79 Cb 0.22 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 3mfw h GLN 79 CO -0.24 0.29 0.26 1.25 -0.67 0.00 0.00 178.83 179.72 3mfw h LEU 80 N 0.37 1.08 -0.78 1.46 5.85 -1.05 -2.52 115.31 119.72 3mfw h LEU 80 Ca 0.10 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.67 3mfw h LEU 80 Cb 0.00 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.70 3mfw h LEU 80 CO -0.02 0.99 0.49 0.00 -0.34 0.00 0.00 178.44 179.56 3mfw h ALA 81 N 1.13 1.04 -0.79 1.25 0.00 -0.32 0.95 119.26 122.53 3mfw h ALA 81 Ca 0.25 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3mfw h ALA 81 Cb 0.28 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3mfw h ALA 81 CO -0.01 0.26 0.33 0.78 0.00 0.00 0.00 179.25 180.61 3mfw h GLY 82 N 0.92 1.26 1.36 0.00 0.00 -1.10 -0.88 103.07 104.63 3mfw h GLY 82 Ca 0.32 -0.67 -0.14 0.00 0.00 0.00 0.00 47.33 46.84 3mfw h GLY 82 CO -0.14 0.64 -0.36 1.70 0.00 0.00 0.00 176.54 178.38 3mfw h LYS 83 N 1.14 0.71 -0.48 4.80 1.63 -1.01 -1.20 116.57 122.17 3mfw h LYS 83 Ca 0.27 -0.35 -0.13 0.00 -0.85 0.00 0.00 60.65 59.59 3mfw h LYS 83 Cb 0.20 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 3mfw h LYS 83 CO -0.02 0.96 -0.21 0.28 -3.45 0.00 0.00 179.45 177.00 3mfw h VAL 84 N 0.59 1.27 -0.20 2.00 2.07 -0.59 -0.92 116.25 120.47 3mfw h VAL 84 Ca 0.06 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 3mfw h VAL 84 Cb 0.89 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 3mfw h VAL 84 CO 0.08 0.47 -0.13 0.00 0.02 0.00 0.00 177.57 178.01 3mfw h ALA 85 N 0.86 1.41 0.34 1.67 0.00 -0.88 0.31 119.26 122.97 3mfw h ALA 85 Ca 0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3mfw h ALA 85 Cb 0.79 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3mfw h ALA 85 CO 0.07 0.41 -0.16 1.49 0.00 0.00 0.00 179.25 181.05 3mfw h GLU 86 N 0.30 -0.44 -0.48 0.00 4.81 -0.92 0.69 114.58 118.55 3mfw h GLU 86 Ca 0.06 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.37 3mfw h GLU 86 Cb 0.43 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.86 3mfw h GLU 86 CO 0.02 -0.25 0.21 0.28 -0.73 0.00 0.00 179.01 178.55 3mfw h VAL 87 N -0.53 0.91 -0.76 0.32 2.07 -0.78 -1.37 116.25 116.10 3mfw h VAL 87 Ca -0.05 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3mfw h VAL 87 Cb 0.40 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 3mfw h VAL 87 CO 0.08 0.08 0.40 0.11 0.02 0.00 0.00 177.57 178.25 3mfw h LYS 88 N 0.41 1.07 -0.42 1.57 1.79 -0.15 -2.06 116.57 118.78 3mfw h LYS 88 Ca 0.22 -0.14 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 3mfw h LYS 88 Cb 0.17 -0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 30.60 3mfw h LYS 88 CO -0.19 0.81 0.28 0.87 -1.08 0.00 0.00 179.45 180.14 3mfw h LYS 89 N 1.05 0.52 0.00 3.15 1.57 -0.05 -1.53 116.57 121.28 3mfw h LYS 89 Ca 0.26 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3mfw h LYS 89 Cb 0.06 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3mfw h LYS 89 CO -0.04 0.35 0.00 0.09 -0.57 0.00 0.00 179.45 179.28 3mfw n ASN 90 N -4.48 0.00 -0.56 0.86 3.02 -0.60 -4.86 115.26 108.65 3mfw n ASN 90 Ca 0.04 -1.50 -0.06 0.00 -0.03 0.00 0.00 54.58 53.03 3mfw n ASN 90 Cb 0.08 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.24 3mfw n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3mfw n GLY 91 N 0.30 0.38 3.50 7.41 0.00 -0.58 -5.03 105.19 111.18 3mfw n GLY 91 Ca 0.01 -0.71 -0.27 0.00 0.00 0.00 0.00 46.02 45.05 3mfw n GLY 91 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mfw s ARG 92 N -3.63 1.80 -0.12 1.61 0.52 -1.12 -4.67 118.95 113.35 3mfw s ARG 92 Ca 0.00 -1.37 -0.30 0.00 -0.52 0.00 0.00 55.73 53.54 3mfw s ARG 92 Cb 0.00 -2.02 -0.01 0.00 0.52 0.00 0.00 34.95 33.44 3mfw s ARG 92 CO 0.00 0.42 1.06 0.42 0.02 0.00 0.00 175.30 177.22 3mfw s ILE 93 N -1.65 4.65 -0.04 1.52 1.01 0.47 -4.27 121.20 122.89 3mfw s ILE 93 Ca 0.23 1.94 -0.30 0.00 0.00 0.00 0.00 60.65 62.52 3mfw s ILE 93 Cb -0.09 -4.25 -0.02 0.00 0.01 0.00 0.00 42.46 38.11 3mfw s ILE 93 CO 0.12 -0.03 1.03 -0.94 0.00 0.00 0.00 174.94 175.13 3mfw s SER 94 N 1.21 7.26 -0.39 3.58 1.04 -1.09 -0.09 113.70 125.22 3mfw s SER 94 Ca 0.49 1.65 -0.04 0.00 0.48 0.00 0.00 55.95 58.54 3mfw s SER 94 Cb -0.19 -2.56 0.09 0.00 0.10 0.00 0.00 66.02 63.46 3mfw s SER 94 CO 0.17 -0.39 0.17 -0.22 0.98 0.00 0.00 173.24 173.95 3mfw s LEU 95 N 1.56 4.95 -0.22 2.42 0.20 -0.04 -0.01 118.68 127.53 3mfw s LEU 95 Ca 0.51 -1.78 -0.15 0.00 0.69 0.00 0.00 54.13 53.41 3mfw s LEU 95 Cb -0.21 -1.83 -0.04 0.00 -0.43 0.00 0.00 46.19 43.68 3mfw s LEU 95 CO 0.23 -0.48 0.35 -0.69 -0.29 0.00 0.00 176.35 175.47 3mfw s VAL 96 N 1.21 5.22 -0.36 1.68 1.01 0.10 -0.54 120.40 128.74 3mfw s VAL 96 Ca 0.05 0.57 -0.13 0.00 0.00 0.00 0.00 61.98 62.47 3mfw s VAL 96 Cb -0.22 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 3mfw s VAL 96 CO -0.02 0.25 0.25 -0.76 0.00 0.00 0.00 175.10 174.81 3mfw s LEU 97 N 1.42 4.65 0.75 3.92 1.43 0.32 -0.97 118.68 130.21 3mfw s LEU 97 Ca 0.16 -0.59 -0.06 0.00 -1.03 0.00 0.00 54.13 52.61 3mfw s LEU 97 Cb -0.15 -2.13 0.11 0.00 0.03 0.00 0.00 46.19 44.06 3mfw s LEU 97 CO 0.08 -0.30 1.05 -0.83 0.23 0.00 0.00 176.35 176.59 3mfw s GLY 98 N 1.69 1.74 0.00 -3.19 0.00 -0.47 -0.37 107.32 106.73 3mfw s GLY 98 Ca 0.05 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.50 3mfw s GLY 98 CO 0.10 -0.75 0.00 0.61 0.00 0.00 0.00 173.10 173.06 3mfw n GLY 99 N -3.03 -1.08 3.93 0.20 0.00 -0.14 -3.50 105.19 101.57 3mfw n GLY 99 Ca 0.12 -1.45 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 3mfw n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3mfw s ASP 100 N -1.98 5.19 0.00 1.61 1.47 -0.23 -1.57 116.67 121.16 3mfw s ASP 100 Ca 0.00 0.52 0.19 0.00 1.18 0.00 0.00 52.55 54.44 3mfw s ASP 100 Cb 0.00 -1.34 0.98 0.00 -0.34 0.00 0.00 42.92 42.23 3mfw s ASP 100 CO 0.00 -1.32 1.58 1.57 0.68 0.00 0.00 175.17 177.68 3mfw n HIS 101 N -2.72 0.00 0.29 2.11 -0.00 -1.26 -2.49 115.22 111.15 3mfw n HIS 101 Ca 0.06 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.94 3mfw n HIS 101 Cb 0.59 -0.25 0.91 0.00 -0.00 0.00 0.00 29.99 31.25 3mfw n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 3mfw h SER 102 N 0.00 0.00 0.00 0.26 4.64 -1.79 -1.57 113.55 115.10 3mfw h SER 102 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mfw h SER 102 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3mfw h SER 102 CO 0.00 0.00 0.20 -0.07 -0.87 0.00 0.00 176.83 176.09 3mfw h LEU 103 N 0.00 0.00 -2.30 5.97 3.38 -1.86 -0.46 115.31 120.04 3mfw h LEU 103 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3mfw h LEU 103 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3mfw h LEU 103 CO -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 178.44 178.51 3mfw h ALA 104 N 1.60 1.62 -0.00 1.53 0.00 -1.53 -0.74 119.26 121.74 3mfw h ALA 104 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3mfw h ALA 104 Cb 0.40 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 3mfw h ALA 104 CO 0.00 0.02 -0.27 0.82 0.00 0.00 0.00 179.25 179.82 3mfw h ILE 105 N 0.00 0.39 -0.50 0.00 2.04 -1.30 -0.80 117.51 117.34 3mfw h ILE 105 Ca -0.00 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 3mfw h ILE 105 Cb 0.04 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 3mfw h ILE 105 CO 0.00 0.00 0.08 1.23 0.00 0.00 0.00 178.15 179.46 3mfw h GLY 106 N -0.41 0.89 0.63 5.37 0.00 -1.50 -1.57 103.07 106.47 3mfw h GLY 106 Ca 0.06 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 3mfw h GLY 106 CO -0.24 0.55 -0.34 0.23 0.00 0.00 0.00 176.54 176.74 3mfw h SER 107 N 0.70 -0.93 -0.30 0.19 0.87 -1.00 -0.18 113.55 112.91 3mfw h SER 107 Ca 0.15 0.08 -0.14 0.00 -1.23 0.00 0.00 61.79 60.66 3mfw h SER 107 Cb 0.40 0.31 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 3mfw h SER 107 CO 0.01 -0.48 -0.31 0.40 -0.53 0.00 0.00 176.83 175.92 3mfw h ILE 108 N -0.71 1.28 -0.37 2.23 2.04 -1.23 -2.11 117.51 118.64 3mfw h ILE 108 Ca -0.02 -1.47 -0.03 0.00 1.00 0.00 0.00 64.86 64.34 3mfw h ILE 108 Cb 0.64 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3mfw h ILE 108 CO -0.07 0.49 0.11 0.28 0.00 0.00 0.00 178.15 178.96 3mfw h SER 109 N 0.69 0.54 -0.70 1.72 0.02 -1.03 0.16 113.55 114.95 3mfw h SER 109 Ca 0.07 -0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.75 3mfw h SER 109 Cb 0.86 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 3mfw h SER 109 CO 0.08 0.61 0.21 1.23 -1.14 0.00 0.00 176.83 177.81 3mfw h GLY 110 N 0.44 1.18 0.99 -3.77 0.00 -1.02 -1.96 103.07 98.94 3mfw h GLY 110 Ca 0.12 -0.71 0.01 0.00 0.00 0.00 0.00 47.33 46.74 3mfw h GLY 110 CO -0.00 0.66 0.35 0.84 0.00 0.00 0.00 176.54 178.39 3mfw h HIS 111 N 1.04 0.65 0.00 5.60 6.17 -1.07 -2.75 115.15 124.79 3mfw h HIS 111 Ca 0.22 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.32 3mfw h HIS 111 Cb 0.32 -0.22 0.00 0.00 2.52 0.00 0.00 27.41 30.03 3mfw h HIS 111 CO 0.03 0.41 0.00 0.00 0.71 0.00 0.00 177.93 179.07 3mfw h ALA 112 N 1.20 1.00 -0.56 5.26 0.00 0.03 -0.26 119.26 125.94 3mfw h ALA 112 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.14 3mfw h ALA 112 Cb -0.07 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3mfw h ALA 112 CO -0.05 0.00 0.32 0.00 0.00 0.00 0.00 179.25 179.52 3mfw h ARG 113 N 0.00 0.61 0.00 0.00 3.08 -1.07 -1.14 114.38 115.86 3mfw h ARG 113 Ca 0.00 -0.04 -0.18 0.00 0.07 0.00 0.00 59.98 59.83 3mfw h ARG 113 Cb 0.46 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 3mfw h ARG 113 CO 0.00 0.40 -1.18 0.28 -1.07 0.00 0.00 179.97 178.40 3mfw h VAL 114 N 0.63 0.86 -2.19 2.04 2.07 -1.44 -3.42 116.25 114.80 3mfw h VAL 114 Ca 0.23 -2.43 -0.58 0.00 0.82 0.00 0.00 66.70 64.74 3mfw h VAL 114 Cb 0.06 2.34 -0.39 0.00 -1.52 0.00 0.00 31.29 31.79 3mfw h VAL 114 CO -0.12 0.49 -1.01 1.41 0.02 0.00 0.00 177.57 178.36 3mfw n HIS 115 N -3.08 -0.25 0.33 1.57 8.25 -0.16 -4.96 115.22 116.91 3mfw n HIS 115 Ca -0.07 -3.52 0.09 0.00 -0.26 0.00 0.00 57.72 53.96 3mfw n HIS 115 Cb 0.87 -0.13 0.39 0.00 1.12 0.00 0.00 29.99 32.25 3mfw n HIS 115 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3mfw n PRO 116 N 1.95 0.11 -0.48 -0.41 -0.04 -0.45 -2.12 135.00 133.57 3mfw n PRO 116 Ca 0.25 0.43 0.05 0.00 -0.04 0.00 0.00 63.50 64.19 3mfw n PRO 116 Cb 0.50 -1.74 0.24 0.00 -0.04 0.00 0.00 33.50 32.46 3mfw n PRO 116 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3mfw n ASP 117 N -1.94 3.56 -4.77 3.54 5.75 -1.26 -4.98 116.55 116.45 3mfw n ASP 117 Ca 0.02 -2.43 -0.33 0.00 -0.01 0.00 0.00 54.79 52.03 3mfw n ASP 117 Cb 0.15 -0.54 0.04 0.00 -1.03 0.00 0.00 41.12 39.74 3mfw n ASP 117 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 3mfw s LEU 118 N -1.53 3.43 0.12 -2.12 0.05 -0.90 -4.38 118.68 113.35 3mfw s LEU 118 Ca 0.33 2.03 0.08 0.00 0.05 0.00 0.00 54.13 56.62 3mfw s LEU 118 Cb 0.23 -4.56 -0.04 0.00 -2.05 0.00 0.00 46.19 39.78 3mfw s LEU 118 CO 0.12 -1.59 -0.15 -0.83 -0.55 0.00 0.00 176.35 173.35 3mfw s GLY 119 N -2.47 1.73 -0.11 -3.48 0.00 0.17 -4.96 107.32 98.21 3mfw s GLY 119 Ca 0.68 -1.33 0.02 0.00 0.00 0.00 0.00 44.72 44.09 3mfw s GLY 119 CO 0.40 -1.31 -0.18 0.14 0.00 0.00 0.00 173.10 172.15 3mfw s VAL 120 N -1.19 2.59 -0.18 1.40 1.01 0.77 -0.68 120.40 124.12 3mfw s VAL 120 Ca 0.19 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 3mfw s VAL 120 Cb -0.11 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 3mfw s VAL 120 CO 0.11 0.54 -0.06 -0.63 0.00 0.00 0.00 175.10 175.07 3mfw s ILE 121 N 0.27 3.43 -0.29 2.22 1.01 -0.28 0.15 121.20 127.71 3mfw s ILE 121 Ca -0.13 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.03 3mfw s ILE 121 Cb -0.16 -2.52 0.06 0.00 0.01 0.00 0.00 42.46 39.84 3mfw s ILE 121 CO 0.07 0.46 -0.04 0.86 0.00 0.00 0.00 174.94 176.29 3mfw s TRP 122 N 0.96 3.31 -0.27 3.97 -0.11 0.43 -0.83 118.94 126.41 3mfw s TRP 122 Ca -0.00 -2.16 -0.08 0.00 1.22 0.00 0.00 56.10 55.07 3mfw s TRP 122 Cb -0.15 -2.13 -0.03 0.00 -1.50 0.00 0.00 33.47 29.67 3mfw s TRP 122 CO 0.00 -0.85 0.10 0.08 -4.62 0.00 0.00 176.95 171.66 3mfw s VAL 123 N 1.16 4.49 -0.25 5.86 1.01 -0.29 -1.00 120.40 131.39 3mfw s VAL 123 Ca -0.05 -0.19 -0.28 0.00 0.00 0.00 0.00 61.98 61.45 3mfw s VAL 123 Cb -0.20 -3.15 0.16 0.00 0.00 0.00 0.00 36.38 33.19 3mfw s VAL 123 CO -0.03 0.27 1.22 -0.62 0.00 0.00 0.00 175.10 175.93 3mfw s ASP 124 N 1.63 -0.19 0.28 3.32 -1.08 -0.74 -1.05 116.67 118.84 3mfw s ASP 124 Ca 0.06 0.26 0.26 0.00 -0.52 0.00 0.00 52.55 52.61 3mfw s ASP 124 Cb -0.16 0.23 0.87 0.00 -1.46 0.00 0.00 42.92 42.40 3mfw s ASP 124 CO 0.05 -0.14 1.76 0.00 0.52 0.00 0.00 175.17 177.35 3mfw h ALA 125 N 2.65 1.00 -3.52 3.66 0.00 -1.73 -2.69 119.26 118.63 3mfw h ALA 125 Ca -0.17 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.08 3mfw h ALA 125 Cb 1.18 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.81 3mfw h ALA 125 CO 0.23 0.00 -0.74 -1.01 0.00 0.00 0.00 179.25 177.73 3mfw s HIS 126 N -3.24 2.71 -0.23 0.00 3.76 -1.26 -0.62 115.29 116.41 3mfw s HIS 126 Ca 0.07 -0.17 0.18 0.00 -0.15 0.00 0.00 55.06 54.98 3mfw s HIS 126 Cb 0.10 -1.41 0.18 0.00 1.11 0.00 0.00 32.58 32.57 3mfw s HIS 126 CO 0.53 0.43 1.51 1.79 -0.85 0.00 0.00 174.74 178.15 3mfw h THR 127 N 3.23 0.59 -5.63 1.30 1.35 -1.89 -3.48 112.91 108.39 3mfw h THR 127 Ca -0.49 -1.81 -0.43 0.00 -0.55 0.00 0.00 66.41 63.14 3mfw h THR 127 Cb 1.17 2.27 0.01 0.00 -1.73 0.00 0.00 68.15 69.87 3mfw h THR 127 CO 0.52 0.33 -0.67 0.47 -0.25 0.00 0.00 175.52 175.92 3mfw n ASP 128 N -3.19 -5.19 -0.10 5.36 8.00 -1.26 -4.72 116.55 115.45 3mfw n ASP 128 Ca 0.03 -0.54 0.05 0.00 0.71 0.00 0.00 54.79 55.03 3mfw n ASP 128 Cb 0.66 -4.17 0.07 0.00 -0.02 0.00 0.00 41.12 37.66 3mfw n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3mfw n ILE 129 N -4.56 1.20 -1.75 0.53 3.06 -1.05 -1.06 119.36 115.74 3mfw n ILE 129 Ca -0.01 -1.38 -0.38 0.00 -2.50 0.00 0.00 62.75 58.48 3mfw n ILE 129 Cb 0.56 0.20 0.06 0.00 0.54 0.00 0.00 39.64 40.99 3mfw n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 3mfw s ASN 130 N -1.79 4.85 0.47 9.51 0.01 -0.61 -4.44 114.94 122.93 3mfw s ASN 130 Ca 0.15 2.69 0.02 0.00 -0.71 0.00 0.00 52.86 55.01 3mfw s ASN 130 Cb 0.13 -2.63 0.01 0.00 0.41 0.00 0.00 41.25 39.17 3mfw s ASN 130 CO 0.01 -1.85 0.68 0.42 -1.51 0.00 0.00 177.10 174.86 3mfw s THR 131 N -1.35 3.51 0.53 1.60 -4.23 -1.26 -4.18 115.64 110.26 3mfw s THR 131 Ca 0.78 -0.63 0.30 0.00 -1.18 0.00 0.00 61.69 60.97 3mfw s THR 131 Cb -0.39 -3.29 0.30 0.00 1.34 0.00 0.00 72.50 70.46 3mfw s THR 131 CO 0.43 -0.19 1.91 -0.65 -0.54 0.00 0.00 174.62 175.58 3mfw h PRO 132 N 0.35 0.00 0.00 3.99 0.11 -1.93 -0.89 132.00 133.63 3mfw h PRO 132 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3mfw h PRO 132 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3mfw h PRO 132 CO 0.54 0.00 -1.14 1.28 -0.21 0.00 0.00 178.00 178.47 3mfw n LEU 133 N -2.78 0.73 -0.01 2.35 4.77 -1.26 -4.42 117.00 116.38 3mfw n LEU 133 Ca -0.02 -0.39 0.11 0.00 -0.03 0.00 0.00 56.01 55.67 3mfw n LEU 133 Cb 0.30 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.23 3mfw n LEU 133 CO 0.13 0.18 -0.66 0.35 -1.33 0.00 0.00 177.39 176.07 3mfw n THR 134 N -1.62 0.00 -1.72 -5.08 -2.24 -0.43 -4.96 114.28 98.22 3mfw n THR 134 Ca 0.02 -0.42 -0.43 0.00 -2.27 0.00 0.00 64.05 60.96 3mfw n THR 134 Cb 0.35 0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 3mfw n THR 134 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 3mfw n THR 135 N -2.13 1.17 -0.00 4.28 5.66 -0.67 -4.88 114.28 117.70 3mfw n THR 135 Ca -0.03 -0.29 0.08 0.00 -3.05 0.00 0.00 64.05 60.76 3mfw n THR 135 Cb 0.52 -1.80 -0.14 0.00 -1.55 0.00 0.00 70.33 67.37 3mfw n THR 135 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3mfw n THR 136 N 1.78 0.35 -0.06 1.09 -2.24 -1.26 -4.52 114.28 109.42 3mfw n THR 136 Ca 0.08 -0.57 -0.05 0.00 -2.27 0.00 0.00 64.05 61.25 3mfw n THR 136 Cb 0.35 -0.16 -0.15 0.00 -2.10 0.00 0.00 70.33 68.28 3mfw n THR 136 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3mfw n SER 137 N -2.43 0.23 0.00 3.42 3.41 -1.26 -4.97 113.62 112.02 3mfw n SER 137 Ca -0.07 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3mfw n SER 137 Cb 0.66 0.92 0.00 0.00 -0.26 0.00 0.00 64.21 65.53 3mfw n SER 137 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3mfw n GLY 138 N 1.59 0.83 3.68 5.00 0.00 -1.26 -4.86 105.19 110.17 3mfw n GLY 138 Ca -0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 3mfw n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mfw s ASN 139 N -2.69 6.75 0.13 1.61 0.01 -1.26 -0.68 114.94 118.81 3mfw s ASN 139 Ca 0.00 0.91 0.19 0.00 -0.71 0.00 0.00 52.86 53.25 3mfw s ASN 139 Cb 0.00 -2.36 0.79 0.00 0.41 0.00 0.00 41.25 40.09 3mfw s ASN 139 CO 0.00 -0.23 1.58 0.18 -1.51 0.00 0.00 177.10 177.12 3mfw n LEU 140 N 4.70 0.33 0.01 0.60 4.77 -0.75 -1.72 117.00 124.95 3mfw n LEU 140 Ca -0.02 0.58 0.10 0.00 -0.03 0.00 0.00 56.01 56.64 3mfw n LEU 140 Cb 0.50 -0.54 0.42 0.00 -2.33 0.00 0.00 43.42 41.47 3mfw n LEU 140 CO 0.45 -0.41 0.81 0.00 -1.33 0.00 0.00 177.39 176.90 3mfw n HIS 141 N -1.87 0.08 0.82 -1.77 1.44 -0.00 -1.73 115.22 112.19 3mfw n HIS 141 Ca 0.03 0.03 0.11 0.00 -2.01 0.00 0.00 57.72 55.88 3mfw n HIS 141 Cb 0.19 -0.54 0.29 0.00 0.12 0.00 0.00 29.99 30.04 3mfw n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3mfw n GLY 142 N 0.49 0.96 0.00 -1.39 0.00 -0.70 -4.38 105.19 100.17 3mfw n GLY 142 Ca 0.05 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3mfw n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3mfw n GLN 143 N 0.91 -0.86 -0.18 1.61 6.02 -0.71 -1.57 117.38 122.61 3mfw n GLN 143 Ca 0.17 -0.48 -0.02 0.00 -0.01 0.00 0.00 57.00 56.66 3mfw n GLN 143 Cb 0.47 -0.98 0.19 0.00 1.02 0.00 0.00 30.24 30.94 3mfw n GLN 143 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3mfw h PRO 144 N 0.00 0.93 0.00 -1.09 0.13 -1.49 -1.91 132.00 128.57 3mfw h PRO 144 Ca 0.00 -0.15 -0.05 0.00 -0.87 0.00 0.00 66.00 64.94 3mfw h PRO 144 Cb 0.01 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 30.97 3mfw h PRO 144 CO 0.00 0.76 -0.23 0.28 -0.23 0.00 0.00 178.00 178.58 3mfw h VAL 145 N 0.92 0.88 -0.01 1.56 2.07 -1.38 -2.54 116.25 117.76 3mfw h VAL 145 Ca 0.22 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.74 3mfw h VAL 145 Cb 0.17 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.43 3mfw h VAL 145 CO -0.02 0.22 -0.60 0.77 0.02 0.00 0.00 177.57 177.96 3mfw h SER 146 N 0.00 0.05 0.85 0.57 4.64 -1.50 -2.20 113.55 115.95 3mfw h SER 146 Ca -0.00 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.26 3mfw h SER 146 Cb 0.49 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3mfw h SER 146 CO 0.03 0.64 -0.15 -0.26 -0.87 0.00 0.00 176.83 176.21 3mfw h PHE 147 N 0.03 0.00 0.00 4.77 -1.00 -1.49 -3.24 116.94 116.01 3mfw h PHE 147 Ca -0.01 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.59 3mfw h PHE 147 Cb 1.07 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.60 3mfw h PHE 147 CO 0.00 0.15 -1.56 1.28 -1.61 0.00 0.00 178.31 176.57 3mfw n LEU 148 N -3.35 0.73 -4.71 1.54 4.77 -0.88 -4.11 117.00 111.00 3mfw n LEU 148 Ca -0.00 0.33 -0.41 0.00 -0.03 0.00 0.00 56.01 55.90 3mfw n LEU 148 Cb 0.37 0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.53 3mfw n LEU 148 CO 0.31 0.19 0.50 -0.76 -1.33 0.00 0.00 177.39 176.30 3mfw s LEU 149 N -5.71 4.32 0.27 2.23 1.43 -0.91 -1.06 118.68 119.25 3mfw s LEU 149 Ca -0.04 1.33 -0.03 0.00 -1.03 0.00 0.00 54.13 54.36 3mfw s LEU 149 Cb 0.09 -3.25 0.38 0.00 0.03 0.00 0.00 46.19 43.44 3mfw s LEU 149 CO 0.82 -0.18 1.92 0.11 0.23 0.00 0.00 176.35 179.25 3mfw h LYS 150 N 6.82 1.18 0.00 1.70 1.57 -1.17 -2.34 116.57 124.33 3mfw h LYS 150 Ca -0.40 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3mfw h LYS 150 Cb 1.20 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 33.24 3mfw h LYS 150 CO 0.76 0.78 0.00 0.39 -0.57 0.00 0.00 179.45 180.81 3mfw n GLU 151 N -4.43 0.01 0.00 3.15 4.71 -1.26 -1.98 120.64 120.84 3mfw n GLU 151 Ca 0.13 0.24 0.08 0.00 -0.01 0.00 0.00 57.16 57.60 3mfw n GLU 151 Cb 0.09 -1.50 -0.07 0.00 -1.01 0.00 0.00 31.44 28.95 3mfw n GLU 151 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3mfw n LEU 152 N -1.49 0.93 -4.68 -4.62 4.32 -0.89 -4.88 117.00 105.69 3mfw n LEU 152 Ca 0.04 -0.55 -0.42 0.00 -0.02 0.00 0.00 56.01 55.05 3mfw n LEU 152 Cb 0.17 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.94 3mfw n LEU 152 CO 0.13 0.21 1.46 -1.59 -1.22 0.00 0.00 177.39 176.39 3mfw s LYS 153 N -2.39 4.16 0.00 3.23 -2.85 -0.83 0.73 119.74 121.78 3mfw s LYS 153 Ca 0.08 2.48 0.00 0.00 -1.00 0.00 0.00 55.97 57.53 3mfw s LYS 153 Cb 0.12 -3.82 0.00 0.00 -2.06 0.00 0.00 37.83 32.07 3mfw s LYS 153 CO 0.60 -0.85 0.00 0.41 0.10 0.00 0.00 175.35 175.61 3mfw n GLY 154 N 4.26 1.20 0.71 0.59 0.00 -1.26 -4.81 105.19 105.88 3mfw n GLY 154 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 3mfw n GLY 154 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3mfw n LYS 155 N -0.05 1.74 -3.43 1.61 3.00 0.22 -4.87 118.16 116.38 3mfw n LYS 155 Ca 0.00 -1.48 -0.41 0.00 -0.00 0.00 0.00 58.31 56.42 3mfw n LYS 155 Cb 0.00 -1.39 -0.10 0.00 0.00 0.00 0.00 35.03 33.54 3mfw n LYS 155 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3mfw s ILE 156 N -1.87 5.20 0.91 3.15 -1.09 -1.04 -4.77 121.20 121.69 3mfw s ILE 156 Ca 0.22 -0.09 -0.12 0.00 -2.23 0.00 0.00 60.65 58.43 3mfw s ILE 156 Cb 0.17 -3.82 0.14 0.00 -1.58 0.00 0.00 42.46 37.37 3mfw s ILE 156 CO 0.33 -0.11 1.11 -2.16 -1.23 0.00 0.00 174.94 172.88 3mfw s PRO 157 N 1.94 1.12 -0.61 2.79 0.04 -1.26 -4.90 135.00 134.12 3mfw s PRO 157 Ca 0.10 0.46 -0.27 0.00 0.04 0.00 0.00 61.00 61.33 3mfw s PRO 157 Cb -0.17 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.56 3mfw s PRO 157 CO 0.11 -2.25 1.44 -0.51 0.04 0.00 0.00 177.00 175.84 3mfw s ASP 158 N -3.80 6.02 -0.15 6.66 1.01 -1.26 -4.97 116.67 120.19 3mfw s ASP 158 Ca 0.64 0.11 -0.11 0.00 0.71 0.00 0.00 52.55 53.90 3mfw s ASP 158 Cb -0.16 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.18 3mfw s ASP 158 CO 0.55 -1.83 0.20 -0.69 0.21 0.00 0.00 175.17 173.61 3mfw s VAL 159 N 6.37 5.37 0.14 -1.27 1.01 -1.26 -5.04 120.40 125.73 3mfw s VAL 159 Ca 0.50 0.35 -0.34 0.00 0.00 0.00 0.00 61.98 62.49 3mfw s VAL 159 Cb -0.10 -3.52 -0.14 0.00 0.00 0.00 0.00 36.38 32.61 3mfw s VAL 159 CO 0.22 0.48 1.54 -2.65 0.00 0.00 0.00 175.10 174.69 3mfw n PRO 160 N 2.98 1.95 0.00 2.72 -0.02 -1.26 -1.26 135.00 140.11 3mfw n PRO 160 Ca -0.16 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3mfw n PRO 160 Cb 0.53 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 3mfw n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mfw n GLY 161 N 3.27 1.96 0.14 -1.23 0.00 -1.26 -3.39 105.19 104.67 3mfw n GLY 161 Ca 0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 3mfw n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mfw n PHE 162 N -1.75 0.08 0.32 1.61 3.01 -0.39 -4.12 117.46 116.23 3mfw n PHE 162 Ca 0.00 -0.93 0.21 0.00 1.01 0.00 0.00 57.45 57.74 3mfw n PHE 162 Cb 0.00 -0.15 1.06 0.00 -0.01 0.00 0.00 39.48 40.38 3mfw n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3mfw h SER 163 N 0.17 0.00 0.78 4.37 4.64 -1.92 -1.07 113.55 120.52 3mfw h SER 163 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mfw h SER 163 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3mfw h SER 163 CO 0.02 0.00 0.00 -2.67 -0.87 0.00 0.00 176.83 173.31 3mfw n TRP 164 N -3.12 0.00 -2.85 4.77 4.27 -1.26 -4.84 117.44 114.40 3mfw n TRP 164 Ca -0.02 0.00 -0.40 0.00 -3.89 0.00 0.00 57.50 53.19 3mfw n TRP 164 Cb 0.14 -0.42 -0.05 0.00 -1.36 0.00 0.00 31.31 29.62 3mfw n TRP 164 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 3mfw s VAL 165 N -2.85 4.62 -0.10 -1.67 1.01 -0.41 -5.03 120.40 115.97 3mfw s VAL 165 Ca 0.18 1.85 0.01 0.00 0.00 0.00 0.00 61.98 64.02 3mfw s VAL 165 Cb 0.18 -4.22 0.02 0.00 0.00 0.00 0.00 36.38 32.36 3mfw s VAL 165 CO 0.46 0.34 -0.12 -0.89 0.00 0.00 0.00 175.10 174.89 3mfw s THR 166 N -0.01 1.28 0.01 3.92 2.01 -1.26 -5.09 115.64 116.49 3mfw s THR 166 Ca 0.43 -0.50 -0.35 0.00 0.31 0.00 0.00 61.69 61.58 3mfw s THR 166 Cb -0.22 -1.21 -0.13 0.00 0.01 0.00 0.00 72.50 70.95 3mfw s THR 166 CO 0.26 0.40 1.72 -2.65 -0.69 0.00 0.00 174.62 173.67 3mfw n PRO 167 N 4.36 2.05 -0.00 4.92 -0.02 -1.26 -4.87 135.00 140.18 3mfw n PRO 167 Ca -0.18 0.75 0.02 0.00 -2.02 0.00 0.00 63.50 62.07 3mfw n PRO 167 Cb 0.51 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.42 3mfw n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3mfw s ILE 169 N -1.65 1.10 0.37 0.00 -0.00 -0.70 -4.96 121.20 115.36 3mfw s ILE 169 Ca 0.01 -1.38 -0.08 0.00 -0.00 0.00 0.00 60.65 59.20 3mfw s ILE 169 Cb 0.04 -1.14 -0.06 0.00 -0.00 0.00 0.00 42.46 41.30 3mfw s ILE 169 CO 0.21 -0.29 0.69 -0.44 -0.00 0.00 0.00 174.94 175.12 3mfw s SER 170 N -1.90 6.47 0.49 4.36 0.01 -1.26 -0.71 113.70 121.17 3mfw s SER 170 Ca -0.00 0.97 0.24 0.00 1.31 0.00 0.00 55.95 58.46 3mfw s SER 170 Cb -0.09 -2.25 1.29 0.00 0.21 0.00 0.00 66.02 65.18 3mfw s SER 170 CO 0.02 -0.34 1.93 0.00 0.41 0.00 0.00 173.24 175.25 3mfw h ALA 171 N 1.32 2.47 0.00 1.44 0.00 -1.96 0.76 119.26 123.30 3mfw h ALA 171 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3mfw h ALA 171 Cb 1.19 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3mfw h ALA 171 CO 0.64 -0.68 0.00 0.36 0.00 0.00 0.00 179.25 179.57 3mfw n LYS 172 N -4.39 0.25 -0.29 0.00 2.85 -1.26 -3.69 118.16 111.63 3mfw n LYS 172 Ca 0.15 0.11 0.08 0.00 -1.05 0.00 0.00 58.31 57.60 3mfw n LYS 172 Cb 0.71 -1.50 0.16 0.00 -0.65 0.00 0.00 35.03 33.74 3mfw n LYS 172 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3mfw n ASP 173 N -1.30 2.03 -4.06 -5.58 8.00 0.26 -4.97 116.55 110.94 3mfw n ASP 173 Ca 0.09 -3.32 -0.18 0.00 0.71 0.00 0.00 54.79 52.09 3mfw n ASP 173 Cb 0.15 -0.45 -0.14 0.00 -0.02 0.00 0.00 41.12 40.66 3mfw n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3mfw s ILE 174 N -2.86 0.77 -0.09 0.53 2.07 -1.24 -0.16 121.20 120.22 3mfw s ILE 174 Ca 0.33 -0.65 0.03 0.00 -1.41 0.00 0.00 60.65 58.95 3mfw s ILE 174 Cb 0.30 -0.69 0.01 0.00 0.13 0.00 0.00 42.46 42.21 3mfw s ILE 174 CO -0.01 0.05 -0.17 -0.69 -1.91 0.00 0.00 174.94 172.21 3mfw s VAL 175 N -0.56 1.56 0.06 4.00 1.01 0.12 -3.92 120.40 122.67 3mfw s VAL 175 Ca 0.01 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.11 3mfw s VAL 175 Cb -0.06 -1.39 -0.06 0.00 0.00 0.00 0.00 36.38 34.87 3mfw s VAL 175 CO 0.00 0.45 0.50 -0.31 0.00 0.00 0.00 175.10 175.74 3mfw s TYR 176 N 0.65 3.73 -0.05 5.22 2.02 -0.84 -0.43 117.35 127.65 3mfw s TYR 176 Ca -0.14 1.11 0.01 0.00 -0.37 0.00 0.00 57.07 57.68 3mfw s TYR 176 Cb -0.16 -2.38 0.02 0.00 -0.40 0.00 0.00 41.96 39.04 3mfw s TYR 176 CO 0.04 0.57 -0.06 0.42 -1.57 0.00 0.00 175.55 174.96 3mfw s ILE 177 N -1.18 0.64 0.00 2.71 1.01 -0.17 -0.46 121.20 123.76 3mfw s ILE 177 Ca 0.29 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.77 3mfw s ILE 177 Cb -0.17 -0.66 0.00 0.00 0.01 0.00 0.00 42.46 41.64 3mfw s ILE 177 CO 0.17 0.25 0.00 0.61 0.00 0.00 0.00 174.94 175.97 3mfw n GLY 178 N 4.10 0.91 3.67 6.18 0.00 0.15 -1.79 105.19 118.41 3mfw n GLY 178 Ca -0.23 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.34 3mfw n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mfw n LEU 179 N 0.00 3.13 0.00 0.99 4.77 -1.02 -4.18 117.00 120.69 3mfw n LEU 179 Ca 0.00 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 3mfw n LEU 179 Cb 0.00 -1.43 0.00 0.00 -2.33 0.00 0.00 43.42 39.66 3mfw n LEU 179 CO 0.00 -0.46 0.03 -2.11 -1.33 0.00 0.00 177.39 173.52 3mfw n ARG 180 N 2.13 0.00 -3.32 3.23 1.85 0.21 -1.06 116.66 119.70 3mfw n ARG 180 Ca 0.12 -0.06 -0.24 0.00 -1.00 0.00 0.00 57.85 56.67 3mfw n ARG 180 Cb 0.31 -0.08 -0.09 0.00 -1.05 0.00 0.00 32.46 31.56 3mfw n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 3mfw n ASP 181 N 0.00 -0.82 -4.44 2.89 2.03 -0.44 -5.05 116.55 110.72 3mfw n ASP 181 Ca 0.00 -2.43 -0.33 0.00 0.52 0.00 0.00 54.79 52.54 3mfw n ASP 181 Cb 0.44 -0.30 -0.13 0.00 -0.72 0.00 0.00 41.12 40.41 3mfw n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3mfw s VAL 182 N 0.14 3.55 0.79 5.18 1.01 -1.26 -4.49 120.40 125.31 3mfw s VAL 182 Ca 0.33 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.72 3mfw s VAL 182 Cb 0.04 -2.53 0.07 0.00 0.00 0.00 0.00 36.38 33.95 3mfw s VAL 182 CO -0.18 0.50 1.09 -1.81 0.00 0.00 0.00 175.10 174.70 3mfw s ASP 183 N 0.39 4.37 0.17 3.32 1.01 -1.26 -4.81 116.67 119.87 3mfw s ASP 183 Ca -0.06 1.78 -0.14 0.00 0.71 0.00 0.00 52.55 54.84 3mfw s ASP 183 Cb -0.15 -2.48 0.07 0.00 1.01 0.00 0.00 42.92 41.37 3mfw s ASP 183 CO 0.04 -2.11 1.83 -0.65 0.21 0.00 0.00 175.17 174.49 3mfw h PRO 184 N -1.18 0.65 -0.72 8.23 0.11 -1.99 0.71 132.00 137.80 3mfw h PRO 184 Ca -0.44 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 65.70 3mfw h PRO 184 Cb 1.24 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.14 3mfw h PRO 184 CO 0.52 0.43 0.39 0.78 -0.21 0.00 0.00 178.00 179.91 3mfw h GLY 185 N 0.67 1.08 1.14 -0.55 0.00 -1.93 -0.77 103.07 102.70 3mfw h GLY 185 Ca 0.19 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.18 3mfw h GLY 185 CO -0.06 0.13 0.11 0.83 0.00 0.00 0.00 176.54 177.55 3mfw h GLU 186 N 0.69 1.05 -0.42 4.80 5.08 -1.68 -1.39 114.58 122.71 3mfw h GLU 186 Ca 0.34 -0.27 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 3mfw h GLU 186 Cb 0.27 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3mfw h GLU 186 CO -0.22 0.96 -0.21 1.25 -1.00 0.00 0.00 179.01 179.80 3mfw h HIS 187 N 0.99 0.94 -0.49 4.33 2.76 -0.08 0.07 115.15 123.67 3mfw h HIS 187 Ca 0.20 -0.21 -0.03 0.00 -2.20 0.00 0.00 60.37 58.13 3mfw h HIS 187 Cb 0.42 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.13 3mfw h HIS 187 CO 0.03 0.96 0.19 -0.92 -1.30 0.00 0.00 177.93 176.89 3mfw h TYR 188 N 0.72 0.75 0.02 5.26 3.20 -0.67 -1.60 116.97 124.66 3mfw h TYR 188 Ca 0.10 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 3mfw h TYR 188 Cb 0.73 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.78 3mfw h TYR 188 CO 0.04 0.64 -0.01 0.82 -1.64 0.00 0.00 178.16 178.00 3mfw h ILE 189 N 0.65 1.07 -0.49 1.81 2.04 -0.99 0.61 117.51 122.22 3mfw h ILE 189 Ca 0.16 -0.30 0.09 0.00 1.00 0.00 0.00 64.86 65.82 3mfw h ILE 189 Cb 0.21 1.27 -0.10 0.00 -0.74 0.00 0.00 36.82 37.46 3mfw h ILE 189 CO -0.01 0.08 -0.30 -0.07 0.00 0.00 0.00 178.15 177.85 3mfw h LEU 190 N -0.16 -1.01 -0.13 1.44 3.38 -0.75 -0.49 115.31 117.59 3mfw h LEU 190 Ca -0.00 0.20 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 3mfw h LEU 190 Cb 0.15 0.50 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3mfw h LEU 190 CO 0.01 -0.29 -0.36 0.11 0.09 0.00 0.00 178.44 177.99 3mfw h LYS 191 N -0.18 0.48 -0.54 1.13 1.79 -1.25 -1.61 116.57 116.40 3mfw h LYS 191 Ca 0.21 -0.34 -0.03 0.00 -2.18 0.00 0.00 60.65 58.31 3mfw h LYS 191 Cb 0.52 0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 31.21 3mfw h LYS 191 CO -0.59 0.96 0.20 1.15 -1.08 0.00 0.00 179.45 180.09 3mfw h THR 192 N 0.08 1.22 0.00 -0.16 2.02 -0.64 -2.49 112.91 112.94 3mfw h THR 192 Ca -0.01 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.46 3mfw h THR 192 Cb 0.98 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 3mfw h THR 192 CO 0.08 0.27 -0.02 0.18 0.37 0.00 0.00 175.52 176.40 3mfw n LEU 193 N -4.50 0.40 -1.28 2.58 4.77 -0.21 -4.93 117.00 113.82 3mfw n LEU 193 Ca 0.02 0.52 -0.09 0.00 -0.03 0.00 0.00 56.01 56.44 3mfw n LEU 193 Cb 0.17 -0.41 0.01 0.00 -2.33 0.00 0.00 43.42 40.87 3mfw n LEU 193 CO 0.39 -0.08 -0.02 0.61 -1.33 0.00 0.00 177.39 176.96 3mfw n GLY 194 N 1.41 0.17 3.73 -0.72 0.00 -0.69 -4.84 105.19 104.25 3mfw n GLY 194 Ca 0.06 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 3mfw n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mfw s ILE 195 N -2.72 3.92 0.10 -0.61 1.01 -0.69 -4.86 121.20 117.34 3mfw s ILE 195 Ca 0.10 1.52 -0.31 0.00 0.00 0.00 0.00 60.65 61.96 3mfw s ILE 195 Cb -0.04 -3.97 -0.08 0.00 0.01 0.00 0.00 42.46 38.38 3mfw s ILE 195 CO 0.13 0.19 1.44 -0.75 0.00 0.00 0.00 174.94 175.95 3mfw s LYS 196 N 0.28 4.29 0.00 2.79 2.47 -1.25 -4.85 119.74 123.47 3mfw s LYS 196 Ca 0.54 2.12 -0.10 0.00 -1.56 0.00 0.00 55.97 56.97 3mfw s LYS 196 Cb -0.30 -3.33 0.01 0.00 -1.46 0.00 0.00 37.83 32.75 3mfw s LYS 196 CO 0.33 -0.51 0.19 1.52 0.16 0.00 0.00 175.35 177.04 3mfw s TYR 197 N 1.48 -0.01 -0.46 4.03 -0.85 -1.26 -1.98 117.35 118.29 3mfw s TYR 197 Ca 0.66 -0.05 0.04 0.00 -0.52 0.00 0.00 57.07 57.19 3mfw s TYR 197 Cb -0.37 -0.01 0.12 0.00 0.38 0.00 0.00 41.96 42.08 3mfw s TYR 197 CO 0.30 -0.33 0.20 -0.06 -1.52 0.00 0.00 175.55 174.14 3mfw s PHE 198 N -1.53 3.10 1.08 -3.49 0.40 0.40 -4.95 117.98 113.00 3mfw s PHE 198 Ca -0.13 -2.99 -0.15 0.00 -0.60 0.00 0.00 56.93 53.06 3mfw s PHE 198 Cb -0.06 -2.68 0.23 0.00 0.51 0.00 0.00 43.02 41.02 3mfw s PHE 198 CO 0.02 -0.80 1.09 -1.54 0.70 0.00 0.00 175.22 174.69 3mfw s SER 199 N 0.13 1.90 0.49 1.36 1.04 -1.26 -0.68 113.70 116.69 3mfw s SER 199 Ca 0.15 1.00 0.20 0.00 0.48 0.00 0.00 55.95 57.78 3mfw s SER 199 Cb -0.24 -1.53 1.25 0.00 0.10 0.00 0.00 66.02 65.59 3mfw s SER 199 CO -0.03 -3.56 2.02 0.24 0.98 0.00 0.00 173.24 172.89 3mfw h MET 200 N -2.19 0.14 -0.46 4.02 2.86 -1.28 0.17 114.93 118.20 3mfw h MET 200 Ca -0.52 -0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.19 3mfw h MET 200 Cb 1.32 -0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.89 3mfw h MET 200 CO 0.50 0.09 0.08 1.15 1.06 0.00 0.00 176.91 179.79 3mfw h THR 201 N 0.14 0.73 -0.18 2.22 2.02 -1.91 0.27 112.91 116.21 3mfw h THR 201 Ca 0.22 -0.07 -0.15 0.00 0.77 0.00 0.00 66.41 67.18 3mfw h THR 201 Cb 0.67 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 3mfw h THR 201 CO -0.03 0.04 -0.50 -0.33 0.37 0.00 0.00 175.52 175.06 3mfw h GLU 202 N 0.21 0.50 -0.64 6.66 3.07 -1.34 -0.26 114.58 122.78 3mfw h GLU 202 Ca 0.23 -0.30 -0.03 0.00 -0.50 0.00 0.00 59.36 58.77 3mfw h GLU 202 Cb 0.30 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 3mfw h GLU 202 CO -0.31 0.89 0.30 0.28 -1.40 0.00 0.00 179.01 178.77 3mfw h VAL 203 N 0.40 1.22 -0.71 3.13 2.07 -0.74 0.26 116.25 121.88 3mfw h VAL 203 Ca 0.02 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 3mfw h VAL 203 Cb 1.02 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3mfw h VAL 203 CO 0.09 0.26 0.42 0.44 0.02 0.00 0.00 177.57 178.81 3mfw h ASP 204 N 0.89 0.85 0.05 0.57 3.32 -0.27 0.23 116.42 122.05 3mfw h ASP 204 Ca 0.22 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 3mfw h ASP 204 Cb 0.13 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3mfw h ASP 204 CO -0.03 0.67 -0.02 -0.09 -1.72 0.00 0.00 179.24 178.05 3mfw h ARG 205 N 0.96 -0.06 0.00 3.56 2.43 -0.57 -3.34 114.38 117.36 3mfw h ARG 205 Ca 0.25 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.33 3mfw h ARG 205 Cb -0.02 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3mfw h ARG 205 CO -0.05 0.22 -1.21 -0.07 -1.51 0.00 0.00 179.97 177.35 3mfw h LEU 206 N -0.34 0.00 -0.06 3.80 3.38 -0.51 -3.51 115.31 118.07 3mfw h LEU 206 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3mfw h LEU 206 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3mfw h LEU 206 CO 0.01 0.32 -0.07 0.61 0.09 0.00 0.00 178.44 179.40 3mfw n GLY 207 N 1.30 -2.92 0.28 0.83 0.00 0.06 -4.11 105.19 100.63 3mfw n GLY 207 Ca -0.05 -1.25 0.14 0.00 0.00 0.00 0.00 46.02 44.86 3mfw n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3mfw h ILE 208 N 0.03 0.51 -0.11 -0.61 6.09 -1.93 -1.62 117.51 119.87 3mfw h ILE 208 Ca 0.00 -0.38 -0.02 0.00 -1.37 0.00 0.00 64.86 63.09 3mfw h ILE 208 Cb 0.06 1.25 -0.00 0.00 0.47 0.00 0.00 36.82 38.60 3mfw h ILE 208 CO 0.00 0.08 -0.01 1.23 -3.07 0.00 0.00 178.15 176.38 3mfw h GLY 209 N 0.64 0.21 2.00 8.18 0.00 -1.95 -0.79 103.07 111.36 3mfw h GLY 209 Ca -0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.07 3mfw h GLY 209 CO 0.01 0.15 -0.47 1.70 0.00 0.00 0.00 176.54 177.93 3mfw h LYS 210 N -0.10 0.00 -0.77 4.80 1.63 -1.63 -1.65 116.57 118.85 3mfw h LYS 210 Ca 0.03 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 59.90 3mfw h LYS 210 Cb 0.39 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.96 3mfw h LYS 210 CO 0.01 0.47 0.44 0.28 -3.45 0.00 0.00 179.45 177.20 3mfw h VAL 211 N 0.00 0.96 -0.08 2.00 2.07 -0.97 -0.05 116.25 120.19 3mfw h VAL 211 Ca -0.00 -0.27 -0.17 0.00 0.82 0.00 0.00 66.70 67.08 3mfw h VAL 211 Cb 0.86 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 3mfw h VAL 211 CO 0.06 0.14 -0.68 0.24 0.02 0.00 0.00 177.57 177.35 3mfw h MET 212 N 0.79 0.34 -0.35 1.57 2.86 -0.73 0.11 114.93 119.52 3mfw h MET 212 Ca 0.35 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3mfw h MET 212 Cb 0.24 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 3mfw h MET 212 CO -0.20 0.89 0.15 1.49 1.06 0.00 0.00 176.91 180.30 3mfw h GLU 213 N 0.24 0.51 -0.27 1.72 4.81 -0.92 -0.34 114.58 120.33 3mfw h GLU 213 Ca -0.02 -0.09 -0.19 0.00 -0.13 0.00 0.00 59.36 58.93 3mfw h GLU 213 Cb 1.23 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.53 3mfw h GLU 213 CO 0.11 0.49 -0.58 0.93 -0.73 0.00 0.00 179.01 179.23 3mfw h GLU 214 N 0.41 0.87 -0.49 1.92 5.08 -0.91 -0.92 114.58 120.53 3mfw h GLU 214 Ca 0.12 -0.57 0.04 0.00 -1.00 0.00 0.00 59.36 57.95 3mfw h GLU 214 Cb 0.16 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 3mfw h GLU 214 CO -0.01 1.20 0.26 1.15 -1.00 0.00 0.00 179.01 180.60 3mfw h THR 215 N 0.66 0.97 0.03 1.13 2.02 -0.66 0.38 112.91 117.44 3mfw h THR 215 Ca 0.01 -0.17 -0.22 0.00 0.77 0.00 0.00 66.41 66.80 3mfw h THR 215 Cb 1.19 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 3mfw h THR 215 CO 0.13 0.09 -0.97 -0.07 0.37 0.00 0.00 175.52 175.07 3mfw h LEU 216 N 0.50 0.26 -0.68 2.58 3.38 -0.98 -0.75 115.31 119.64 3mfw h LEU 216 Ca 0.21 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 3mfw h LEU 216 Cb 0.11 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3mfw h LEU 216 CO -0.14 1.08 -0.14 -1.28 0.09 0.00 0.00 178.44 178.05 3mfw h SER 217 N 0.09 0.88 -0.56 -0.43 0.87 -1.04 0.14 113.55 113.49 3mfw h SER 217 Ca -0.06 -0.29 -0.02 0.00 -1.23 0.00 0.00 61.79 60.19 3mfw h SER 217 Cb 1.64 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 63.33 3mfw h SER 217 CO 0.15 1.02 0.27 0.22 -0.53 0.00 0.00 176.83 177.96 3mfw h TYR 218 N 0.78 0.82 0.00 2.24 3.20 -0.67 0.22 116.97 123.55 3mfw h TYR 218 Ca 0.12 -0.04 -0.22 0.00 3.14 0.00 0.00 58.73 61.73 3mfw h TYR 218 Cb 0.67 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.65 3mfw h TYR 218 CO 0.04 0.63 -1.13 -0.07 -1.64 0.00 0.00 178.16 175.99 3mfw h LEU 219 N 0.76 0.00 -0.43 2.82 3.38 -0.96 -3.39 115.31 117.49 3mfw h LEU 219 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3mfw h LEU 219 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3mfw h LEU 219 CO -0.02 0.98 -0.24 0.18 0.09 0.00 0.00 178.44 179.43 3mfw n LEU 220 N -3.28 0.79 0.00 1.67 4.77 0.48 -4.75 117.00 116.68 3mfw n LEU 220 Ca -0.03 -0.66 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 3mfw n LEU 220 Cb 0.96 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 3mfw n LEU 220 CO 0.46 0.17 0.48 0.61 -1.33 0.00 0.00 177.39 177.79 3mfw n GLY 221 N 0.95 -3.03 0.39 -0.72 0.00 0.06 -3.16 105.19 99.69 3mfw n GLY 221 Ca 0.03 0.48 -0.14 0.00 0.00 0.00 0.00 46.02 46.39 3mfw n GLY 221 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3mfw h ARG 222 N 0.00 -0.60 -3.80 1.61 2.43 -1.85 -3.44 114.38 108.72 3mfw h ARG 222 Ca 0.00 0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 3mfw h ARG 222 Cb 0.00 0.14 -0.14 0.00 -0.42 0.00 0.00 29.97 29.55 3mfw h ARG 222 CO 0.00 -0.40 -0.34 -1.59 -1.51 0.00 0.00 179.97 176.13 3mfw s LYS 223 N -5.94 0.93 -0.37 0.20 0.00 -1.19 -5.12 119.74 108.25 3mfw s LYS 223 Ca -0.16 -1.00 -0.29 0.00 0.00 0.00 0.00 55.97 54.52 3mfw s LYS 223 Cb 0.08 0.36 0.01 0.00 0.00 0.00 0.00 37.83 38.28 3mfw s LYS 223 CO 0.64 -0.31 1.21 0.15 0.00 0.00 0.00 175.35 177.03 3mfw s LYS 224 N -3.88 3.85 0.27 1.78 3.01 -1.25 -4.38 119.74 119.14 3mfw s LYS 224 Ca 0.08 0.96 0.02 0.00 -1.01 0.00 0.00 55.97 56.03 3mfw s LYS 224 Cb 0.04 -3.87 -0.05 0.00 -1.01 0.00 0.00 37.83 32.94 3mfw s LYS 224 CO -0.08 -1.20 0.06 -0.98 0.51 0.00 0.00 175.35 173.66 3mfw s ARG 225 N 4.22 1.44 0.55 1.68 1.04 -1.26 -5.12 118.95 121.49 3mfw s ARG 225 Ca 0.52 -1.77 -0.18 0.00 -1.04 0.00 0.00 55.73 53.25 3mfw s ARG 225 Cb -0.12 -0.48 -0.06 0.00 -2.04 0.00 0.00 34.95 32.25 3mfw s ARG 225 CO 0.25 -0.22 1.08 -2.14 -0.04 0.00 0.00 175.30 174.23 3mfw s PRO 226 N -3.96 3.44 -0.06 3.89 0.02 -1.26 -4.79 135.00 132.28 3mfw s PRO 226 Ca 0.35 1.41 0.02 0.00 0.02 0.00 0.00 61.00 62.80 3mfw s PRO 226 Cb 0.08 -2.04 -0.03 0.00 0.02 0.00 0.00 34.50 32.53 3mfw s PRO 226 CO 0.13 -0.74 -0.10 0.42 -0.33 0.00 0.00 177.00 176.37 3mfw s ILE 227 N -2.05 3.40 -0.29 2.83 1.01 0.01 -0.65 121.20 125.46 3mfw s ILE 227 Ca 0.68 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 60.69 3mfw s ILE 227 Cb -0.19 -2.37 0.01 0.00 0.01 0.00 0.00 42.46 39.92 3mfw s ILE 227 CO 0.28 0.59 0.05 -2.28 0.00 0.00 0.00 174.94 173.58 3mfw s HIS 228 N -0.70 3.13 -0.33 3.97 5.65 0.14 0.42 115.29 127.57 3mfw s HIS 228 Ca 0.11 -1.10 -0.12 0.00 0.25 0.00 0.00 55.06 54.20 3mfw s HIS 228 Cb -0.11 -2.21 -0.01 0.00 -1.18 0.00 0.00 32.58 29.06 3mfw s HIS 228 CO 0.01 -0.61 0.21 -1.17 -0.65 0.00 0.00 174.74 172.53 3mfw s LEU 229 N 1.46 4.37 -0.46 8.88 2.96 -0.13 -1.13 118.68 134.63 3mfw s LEU 229 Ca 0.02 -0.46 -0.13 0.00 -0.22 0.00 0.00 54.13 53.33 3mfw s LEU 229 Cb -0.17 -2.09 0.08 0.00 0.50 0.00 0.00 46.19 44.52 3mfw s LEU 229 CO 0.01 -0.22 0.37 -0.55 -1.32 0.00 0.00 176.35 174.64 3mfw s SER 230 N 1.68 5.98 -0.38 3.68 0.15 -0.01 -0.37 113.70 124.43 3mfw s SER 230 Ca 0.05 -1.47 -0.11 0.00 0.70 0.00 0.00 55.95 55.13 3mfw s SER 230 Cb -0.17 -2.12 0.04 0.00 -1.71 0.00 0.00 66.02 62.05 3mfw s SER 230 CO 0.09 -0.64 0.22 0.12 1.20 0.00 0.00 173.24 174.22 3mfw s PHE 231 N 1.56 3.26 -0.21 3.44 2.19 0.43 -1.14 117.98 127.50 3mfw s PHE 231 Ca 0.04 -1.05 -0.23 0.00 0.33 0.00 0.00 56.93 56.02 3mfw s PHE 231 Cb -0.25 -2.51 -0.02 0.00 -1.31 0.00 0.00 43.02 38.93 3mfw s PHE 231 CO 0.04 -0.68 0.74 0.34 1.83 0.00 0.00 175.22 177.49 3mfw s ASP 232 N 1.64 6.77 0.39 6.13 -1.08 -0.22 -0.65 116.67 129.66 3mfw s ASP 232 Ca 0.02 0.95 0.28 0.00 -0.52 0.00 0.00 52.55 53.28 3mfw s ASP 232 Cb -0.20 -2.40 1.35 0.00 -1.46 0.00 0.00 42.92 40.21 3mfw s ASP 232 CO 0.06 -0.39 1.83 -0.37 0.52 0.00 0.00 175.17 176.82 3mfw h VAL 233 N 5.30 0.00 0.00 1.11 -1.51 -1.65 0.13 116.25 119.63 3mfw h VAL 233 Ca -0.28 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 3mfw h VAL 233 Cb 1.12 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.12 3mfw h VAL 233 CO 0.82 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.26 3mfw n ASP 234 N -2.49 0.00 0.20 4.19 3.85 -1.26 -1.87 116.55 119.17 3mfw n ASP 234 Ca -0.00 -0.41 0.07 0.00 -0.71 0.00 0.00 54.79 53.73 3mfw n ASP 234 Cb 0.13 -0.10 0.36 0.00 -1.35 0.00 0.00 41.12 40.16 3mfw n ASP 234 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3mfw h GLY 235 N 3.20 0.00 -2.14 6.12 0.00 -0.99 -3.33 103.07 105.93 3mfw h GLY 235 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 3mfw h GLY 235 CO 0.00 0.00 0.24 1.08 0.00 0.00 0.00 176.54 177.86 3mfw s LEU 236 N -6.91 3.74 0.41 3.11 1.43 -0.78 -2.06 118.68 117.62 3mfw s LEU 236 Ca 0.01 1.34 -0.26 0.00 -1.03 0.00 0.00 54.13 54.18 3mfw s LEU 236 Cb 0.10 -4.24 -0.10 0.00 0.03 0.00 0.00 46.19 41.98 3mfw s LEU 236 CO 0.67 -0.48 1.39 -0.67 0.23 0.00 0.00 176.35 177.49 3mfw n ASP 237 N -1.40 3.20 0.20 2.29 -0.08 0.08 -4.66 116.55 116.18 3mfw n ASP 237 Ca 0.04 1.15 0.12 0.00 -1.51 0.00 0.00 54.79 54.59 3mfw n ASP 237 Cb 0.54 -1.57 0.63 0.00 2.34 0.00 0.00 41.12 43.05 3mfw n ASP 237 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3mfw h PRO 238 N 2.43 0.00 0.00 -0.67 0.11 -1.83 0.25 132.00 132.29 3mfw h PRO 238 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3mfw h PRO 238 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3mfw h PRO 238 CO 0.62 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.07 3mfw h SER 239 N 0.00 0.00 0.00 -2.05 4.64 -1.96 -2.77 113.55 111.41 3mfw h SER 239 Ca 0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 3mfw h SER 239 Cb 0.23 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.27 3mfw h SER 239 CO 0.00 0.00 -2.09 0.49 -0.87 0.00 0.00 176.83 174.36 3mfw n PHE 240 N -2.35 0.00 -3.16 4.77 3.72 0.02 -4.84 117.46 115.61 3mfw n PHE 240 Ca 0.02 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.18 3mfw n PHE 240 Cb 0.23 -0.74 -0.05 0.00 -0.94 0.00 0.00 39.48 37.98 3mfw n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3mfw n THR 241 N -3.05 1.31 0.18 4.37 -2.24 -0.83 -3.87 114.28 110.16 3mfw n THR 241 Ca -0.34 -4.94 0.06 0.00 -2.27 0.00 0.00 64.05 56.56 3mfw n THR 241 Cb 0.86 -1.33 0.52 0.00 -2.10 0.00 0.00 70.33 68.28 3mfw n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3mfw h PRO 242 N 3.43 0.14 -4.10 -0.78 0.13 -1.75 -3.37 132.00 125.70 3mfw h PRO 242 Ca 0.13 -0.02 -0.72 0.00 -0.87 0.00 0.00 66.00 64.52 3mfw h PRO 242 Cb 0.74 -0.03 -0.08 0.00 0.13 0.00 0.00 31.00 31.76 3mfw h PRO 242 CO 0.67 0.18 2.63 0.00 -0.23 0.00 0.00 178.00 181.24 3mfw n ALA 243 N -2.51 5.19 -2.89 -0.56 0.00 -1.26 -4.80 120.51 113.68 3mfw n ALA 243 Ca -0.01 -4.02 -0.10 0.00 0.00 0.00 0.00 53.44 49.31 3mfw n ALA 243 Cb 0.16 -3.36 -0.05 0.00 0.00 0.00 0.00 19.45 16.19 3mfw n ALA 243 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3mfw s THR 244 N 2.42 0.08 0.19 0.00 -1.32 -1.26 -0.44 115.64 115.31 3mfw s THR 244 Ca 0.45 -0.81 -0.11 0.00 -1.21 0.00 0.00 61.69 60.02 3mfw s THR 244 Cb 0.11 -1.30 0.10 0.00 -1.51 0.00 0.00 72.50 69.90 3mfw s THR 244 CO -0.04 -0.38 1.77 1.23 -2.21 0.00 0.00 174.62 174.99 3mfw h GLY 245 N 2.46 1.02 -6.60 6.08 0.00 -1.89 -3.38 103.07 100.76 3mfw h GLY 245 Ca -0.33 -0.51 -0.60 0.00 0.00 0.00 0.00 47.33 45.89 3mfw h GLY 245 CO 0.48 0.48 -0.86 -0.51 0.00 0.00 0.00 176.54 176.14 3mfw s THR 246 N -5.69 0.83 0.34 4.70 -4.23 -1.26 -5.11 115.64 105.23 3mfw s THR 246 Ca -0.13 -2.72 -0.27 0.00 -1.18 0.00 0.00 61.69 57.39 3mfw s THR 246 Cb 0.14 -1.58 -0.09 0.00 1.34 0.00 0.00 72.50 72.31 3mfw s THR 246 CO 0.80 -1.11 1.14 -2.16 -0.54 0.00 0.00 174.62 172.74 3mfw s PRO 247 N 0.05 4.35 -0.07 3.99 0.04 -1.26 -4.93 135.00 137.17 3mfw s PRO 247 Ca 0.27 1.82 -0.00 0.00 0.04 0.00 0.00 61.00 63.13 3mfw s PRO 247 Cb -0.06 -2.91 0.02 0.00 0.04 0.00 0.00 34.50 31.59 3mfw s PRO 247 CO -0.13 -0.05 -0.04 0.08 0.04 0.00 0.00 177.00 176.90 3mfw s VAL 248 N -1.32 0.58 0.89 -0.36 1.01 -1.26 -5.05 120.40 114.89 3mfw s VAL 248 Ca 0.51 -0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.31 3mfw s VAL 248 Cb -0.31 -0.65 0.13 0.00 0.00 0.00 0.00 36.38 35.55 3mfw s VAL 248 CO 0.40 0.27 1.11 0.68 0.00 0.00 0.00 175.10 177.56 3mfw s VAL 249 N 1.43 2.52 -0.19 2.92 -7.23 -1.26 -4.14 120.40 114.45 3mfw s VAL 249 Ca -0.03 0.17 -0.01 0.00 -1.81 0.00 0.00 61.98 60.31 3mfw s VAL 249 Cb -0.13 -2.39 0.00 0.00 0.56 0.00 0.00 36.38 34.42 3mfw s VAL 249 CO -0.03 -0.22 0.07 0.61 -0.31 0.00 0.00 175.10 175.22 3mfw n GLY 250 N -0.33 0.52 2.74 2.32 0.00 -1.26 -5.01 105.19 104.17 3mfw n GLY 250 Ca 0.10 -0.68 -0.16 0.00 0.00 0.00 0.00 46.02 45.28 3mfw n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mfw n GLY 251 N -0.84 0.75 3.76 -0.02 0.00 -1.26 -4.96 105.19 102.62 3mfw n GLY 251 Ca -0.01 -2.02 -0.40 0.00 0.00 0.00 0.00 46.02 43.59 3mfw n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mfw s LEU 252 N 0.00 4.05 0.81 0.99 1.43 -0.87 -4.30 118.68 120.79 3mfw s LEU 252 Ca 0.47 2.91 -0.12 0.00 -1.03 0.00 0.00 54.13 56.35 3mfw s LEU 252 Cb -0.03 -4.01 0.08 0.00 0.03 0.00 0.00 46.19 42.27 3mfw s LEU 252 CO 0.31 -1.28 1.17 0.42 0.23 0.00 0.00 176.35 177.20 3mfw s THR 253 N -1.22 2.06 0.17 5.49 -4.23 -1.26 -0.74 115.64 115.90 3mfw s THR 253 Ca 0.63 0.02 -0.15 0.00 -1.18 0.00 0.00 61.69 61.02 3mfw s THR 253 Cb -0.43 -3.00 0.05 0.00 1.34 0.00 0.00 72.50 70.45 3mfw s THR 253 CO 0.55 -0.02 1.82 0.22 -0.54 0.00 0.00 174.62 176.65 3mfw h TYR 254 N -1.07 0.59 -0.62 3.99 3.20 -1.95 -0.17 116.97 120.94 3mfw h TYR 254 Ca -0.46 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.46 3mfw h TYR 254 Cb 1.33 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 39.36 3mfw h TYR 254 CO 0.32 0.36 0.37 0.00 -1.64 0.00 0.00 178.16 177.57 3mfw h ARG 255 N 0.63 0.70 -0.81 1.82 3.08 -1.99 -0.80 114.38 117.01 3mfw h ARG 255 Ca 0.18 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.16 3mfw h ARG 255 Cb -0.05 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 3mfw h ARG 255 CO -0.05 0.46 0.40 0.93 -1.07 0.00 0.00 179.97 180.64 3mfw h GLU 256 N 0.72 1.16 -0.39 0.04 5.08 -1.82 0.89 114.58 120.27 3mfw h GLU 256 Ca 0.26 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3mfw h GLU 256 Cb 0.06 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 3mfw h GLU 256 CO -0.12 0.89 0.25 0.78 -1.00 0.00 0.00 179.01 179.80 3mfw h GLY 257 N 1.18 0.55 1.67 -3.84 0.00 -0.51 -1.09 103.07 101.03 3mfw h GLY 257 Ca 0.28 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.31 3mfw h GLY 257 CO -0.04 0.21 -0.24 1.41 0.00 0.00 0.00 176.54 177.88 3mfw h LEU 258 N 0.52 0.38 -0.27 3.11 3.38 -0.78 -2.83 115.31 118.82 3mfw h LEU 258 Ca 0.14 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3mfw h LEU 258 Cb -0.04 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3mfw h LEU 258 CO -0.03 0.63 -0.00 0.22 0.09 0.00 0.00 178.44 179.35 3mfw h TYR 259 N 0.34 0.52 -0.51 1.13 3.20 -0.26 0.14 116.97 121.53 3mfw h TYR 259 Ca 0.05 -0.09 0.09 0.00 3.14 0.00 0.00 58.73 61.93 3mfw h TYR 259 Cb 0.62 -0.13 -0.08 0.00 1.54 0.00 0.00 36.73 38.68 3mfw h TYR 259 CO 0.02 0.63 0.07 0.82 -1.64 0.00 0.00 178.16 178.06 3mfw h ILE 260 N 0.25 0.67 0.08 1.81 2.04 -1.18 -1.11 117.51 120.08 3mfw h ILE 260 Ca 0.08 -0.07 -0.25 0.00 1.00 0.00 0.00 64.86 65.62 3mfw h ILE 260 Cb 0.43 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 3mfw h ILE 260 CO 0.01 0.04 -1.12 0.71 0.00 0.00 0.00 178.15 177.79 3mfw h THR 261 N 0.20 1.51 -0.79 -0.27 1.35 -1.25 -1.90 112.91 111.77 3mfw h THR 261 Ca 0.26 -2.96 0.04 0.00 -0.55 0.00 0.00 66.41 63.20 3mfw h THR 261 Cb 0.37 2.80 -0.05 0.00 -1.73 0.00 0.00 68.15 69.53 3mfw h THR 261 CO -0.36 0.86 0.49 -0.33 -0.25 0.00 0.00 175.52 175.93 3mfw h GLU 262 N 0.09 0.91 -0.24 4.72 5.08 -0.57 -0.38 114.58 124.18 3mfw h GLU 262 Ca -0.10 -0.05 -0.16 0.00 -1.00 0.00 0.00 59.36 58.04 3mfw h GLU 262 Cb 1.83 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.87 3mfw h GLU 262 CO 0.18 0.60 -0.52 0.93 -1.00 0.00 0.00 179.01 179.20 3mfw h GLU 263 N 0.93 0.69 -0.40 2.33 4.39 -1.07 -2.31 114.58 119.14 3mfw h GLU 263 Ca 0.33 -0.42 -0.12 0.00 0.34 0.00 0.00 59.36 59.49 3mfw h GLU 263 Cb 0.08 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3mfw h GLU 263 CO -0.14 1.03 -0.22 0.82 -1.16 0.00 0.00 179.01 179.34 3mfw h ILE 264 N 0.53 1.28 -0.70 3.13 2.04 -1.16 -2.78 117.51 119.86 3mfw h ILE 264 Ca 0.02 -1.37 0.14 0.00 1.00 0.00 0.00 64.86 64.65 3mfw h ILE 264 Cb 1.08 1.30 -0.10 0.00 -0.74 0.00 0.00 36.82 38.36 3mfw h ILE 264 CO 0.11 0.46 0.20 0.22 0.00 0.00 0.00 178.15 179.14 3mfw h TYR 265 N 0.67 0.33 0.00 1.37 3.20 -0.91 -1.94 116.97 119.69 3mfw h TYR 265 Ca 0.09 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.99 3mfw h TYR 265 Cb 0.79 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.02 3mfw h TYR 265 CO 0.06 -0.02 0.00 1.63 -1.64 0.00 0.00 178.16 178.19 3mfw n LYS 266 N -5.09 0.18 0.22 1.82 5.02 -0.88 -1.64 118.16 117.78 3mfw n LYS 266 Ca 0.13 0.40 0.09 0.00 -2.02 0.00 0.00 58.31 56.90 3mfw n LYS 266 Cb 0.40 -1.83 0.47 0.00 -0.02 0.00 0.00 35.03 34.05 3mfw n LYS 266 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 3mfw h THR 267 N 0.00 0.68 0.00 -0.18 1.35 -1.25 -3.46 112.91 110.05 3mfw h THR 267 Ca 0.00 -1.13 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 3mfw h THR 267 Cb 0.36 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 3mfw h THR 267 CO 0.00 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 176.13 3mfw n GLY 268 N -0.02 0.73 0.72 5.82 0.00 -0.65 -4.88 105.19 106.91 3mfw n GLY 268 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.08 3mfw n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mfw n LEU 269 N 0.00 2.95 -4.73 0.99 4.77 -1.26 -4.98 117.00 114.73 3mfw n LEU 269 Ca 0.00 -1.85 -0.42 0.00 -0.03 0.00 0.00 56.01 53.71 3mfw n LEU 269 Cb 0.02 -0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 3mfw n LEU 269 CO 0.00 0.72 1.28 -0.22 -1.33 0.00 0.00 177.39 177.84 3mfw s LEU 270 N -1.01 4.36 0.00 2.23 2.96 -1.26 -0.81 118.68 125.14 3mfw s LEU 270 Ca 0.26 2.84 0.00 0.00 -0.22 0.00 0.00 54.13 57.00 3mfw s LEU 270 Cb 0.14 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 43.21 3mfw s LEU 270 CO 0.18 -0.90 0.00 -0.24 -1.32 0.00 0.00 176.35 174.07 3mfw n SER 271 N 3.21 3.87 -3.71 3.68 2.88 0.17 -4.80 113.62 118.92 3mfw n SER 271 Ca 0.12 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.54 3mfw n SER 271 Cb 0.37 0.44 -0.07 0.00 -0.75 0.00 0.00 64.21 64.20 3mfw n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3mfw s GLY 272 N -2.40 -0.20 -0.02 0.46 0.00 -0.87 -2.68 107.32 101.61 3mfw s GLY 272 Ca 0.00 0.20 -0.00 0.00 0.00 0.00 0.00 44.72 44.92 3mfw s GLY 272 CO 0.00 -0.04 0.03 -2.27 0.00 0.00 0.00 173.10 170.82 3mfw s LEU 273 N -1.94 1.20 -0.15 0.66 2.96 0.98 -0.95 118.68 121.44 3mfw s LEU 273 Ca -0.06 0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 53.86 3mfw s LEU 273 Cb -0.01 -0.04 -0.03 0.00 0.50 0.00 0.00 46.19 46.61 3mfw s LEU 273 CO -0.02 -0.11 -0.03 -1.81 -1.32 0.00 0.00 176.35 173.06 3mfw s ASP 274 N 0.91 4.90 -0.39 3.68 1.01 0.50 0.03 116.67 127.32 3mfw s ASP 274 Ca -0.08 -0.09 -0.01 0.00 0.71 0.00 0.00 52.55 53.09 3mfw s ASP 274 Cb -0.11 -1.76 0.11 0.00 1.01 0.00 0.00 42.92 42.17 3mfw s ASP 274 CO -0.03 0.19 0.15 -0.63 0.21 0.00 0.00 175.17 175.07 3mfw s ILE 275 N 0.24 2.96 0.26 0.77 -1.09 -0.14 -0.43 121.20 123.77 3mfw s ILE 275 Ca -0.02 -2.15 0.11 0.00 -2.23 0.00 0.00 60.65 56.36 3mfw s ILE 275 Cb -0.14 -3.07 -0.05 0.00 -1.58 0.00 0.00 42.46 37.63 3mfw s ILE 275 CO 0.03 -0.66 -0.11 -0.04 -1.23 0.00 0.00 174.94 172.93 3mfw s MET 276 N 1.06 1.97 -0.62 2.79 -1.94 0.18 -1.37 119.30 121.38 3mfw s MET 276 Ca 0.09 -1.57 0.00 0.00 -1.71 0.00 0.00 55.69 52.50 3mfw s MET 276 Cb -0.22 -1.97 0.00 0.00 2.01 0.00 0.00 34.83 34.65 3mfw s MET 276 CO -0.05 0.35 0.00 0.39 -0.01 0.00 0.00 175.02 175.70 3mfw n GLU 277 N -0.67 -0.74 -2.18 2.03 -0.58 -0.61 -1.80 120.64 116.09 3mfw n GLU 277 Ca -0.06 0.60 -0.42 0.00 -0.42 0.00 0.00 57.16 56.86 3mfw n GLU 277 Cb 0.59 -4.41 -0.03 0.00 -0.57 0.00 0.00 31.44 27.02 3mfw n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3mfw s VAL 278 N -2.05 3.65 -0.38 2.62 1.01 -1.26 -4.28 120.40 119.72 3mfw s VAL 278 Ca 0.00 1.02 0.01 0.00 0.00 0.00 0.00 61.98 63.00 3mfw s VAL 278 Cb 0.00 -3.65 0.12 0.00 0.00 0.00 0.00 36.38 32.85 3mfw s VAL 278 CO 0.00 -0.01 0.17 0.21 0.00 0.00 0.00 175.10 175.47 3mfw s ASN 279 N 2.05 3.82 0.25 3.32 3.84 0.41 -4.16 114.94 124.47 3mfw s ASN 279 Ca 0.65 -2.16 -0.05 0.00 0.21 0.00 0.00 52.86 51.51 3mfw s ASN 279 Cb -0.32 -0.95 0.32 0.00 -0.55 0.00 0.00 41.25 39.75 3mfw s ASN 279 CO 0.27 -0.34 1.87 -0.65 -2.79 0.00 0.00 177.10 175.47 3mfw h PRO 280 N 7.36 1.06 0.00 0.43 0.11 -1.77 -1.37 132.00 137.82 3mfw h PRO 280 Ca -0.06 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.99 3mfw h PRO 280 Cb 0.97 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.84 3mfw h PRO 280 CO 0.47 0.70 0.00 -1.13 -0.21 0.00 0.00 178.00 177.83 3mfw n SER 281 N -4.55 0.00 -0.98 -2.05 3.41 -1.26 -1.08 113.62 107.12 3mfw n SER 281 Ca 0.12 0.44 0.12 0.00 -0.26 0.00 0.00 58.87 59.29 3mfw n SER 281 Cb 0.13 -0.45 0.20 0.00 -0.26 0.00 0.00 64.21 63.83 3mfw n SER 281 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3mfw n LEU 282 N -1.45 2.98 -4.78 1.04 4.77 -0.52 -4.99 117.00 114.06 3mfw n LEU 282 Ca 0.01 -1.14 -0.33 0.00 -0.03 0.00 0.00 56.01 54.52 3mfw n LEU 282 Cb 0.03 -0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.04 3mfw n LEU 282 CO 0.02 0.57 0.74 -0.83 -1.33 0.00 0.00 177.39 176.56 3mfw s GLY 283 N -1.77 2.25 0.08 -0.72 0.00 -0.24 -4.70 107.32 102.22 3mfw s GLY 283 Ca 0.33 0.57 0.04 0.00 0.00 0.00 0.00 44.72 45.66 3mfw s GLY 283 CO 0.31 0.91 1.12 0.50 0.00 0.00 0.00 173.10 175.94 3mfw h LYS 284 N 0.40 0.09 -5.50 2.90 1.57 -1.93 -3.46 116.57 110.63 3mfw h LYS 284 Ca -0.47 -0.15 -0.43 0.00 -1.87 0.00 0.00 60.65 57.73 3mfw h LYS 284 Cb 1.24 0.05 -0.17 0.00 0.08 0.00 0.00 32.23 33.44 3mfw h LYS 284 CO 0.56 1.00 -0.75 0.95 -0.57 0.00 0.00 179.45 180.63 3mfw s THR 285 N -2.67 1.50 0.58 -0.16 -4.23 -1.26 -5.03 115.64 104.36 3mfw s THR 285 Ca -0.02 -1.93 0.27 0.00 -1.18 0.00 0.00 61.69 58.83 3mfw s THR 285 Cb 0.09 -1.76 0.34 0.00 1.34 0.00 0.00 72.50 72.51 3mfw s THR 285 CO 0.84 -0.49 2.21 -0.65 -0.54 0.00 0.00 174.62 175.98 3mfw h PRO 286 N 3.12 0.00 -0.17 3.99 0.11 -1.99 -0.65 132.00 136.41 3mfw h PRO 286 Ca -0.39 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.61 3mfw h PRO 286 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 3mfw h PRO 286 CO 0.55 0.00 -0.35 1.49 -0.21 0.00 0.00 178.00 179.49 3mfw h GLU 287 N 0.00 0.36 0.00 1.05 4.22 -1.99 -2.23 114.58 115.99 3mfw h GLU 287 Ca 0.02 -0.16 -0.06 0.00 0.08 0.00 0.00 59.36 59.25 3mfw h GLU 287 Cb 0.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 3mfw h GLU 287 CO -0.00 0.66 -0.28 0.93 -2.18 0.00 0.00 179.01 178.14 3mfw h GLU 288 N 0.31 0.00 0.10 1.92 5.08 -1.52 0.46 114.58 120.94 3mfw h GLU 288 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3mfw h GLU 288 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3mfw h GLU 288 CO 0.06 0.28 -0.05 0.28 -1.00 0.00 0.00 179.01 178.58 3mfw h VAL 289 N 0.00 1.12 -0.12 3.13 2.07 -1.34 -1.47 116.25 119.64 3mfw h VAL 289 Ca -0.00 -1.04 -0.07 0.00 0.82 0.00 0.00 66.70 66.41 3mfw h VAL 289 Cb 0.51 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 3mfw h VAL 289 CO 0.04 0.24 -0.23 0.71 0.02 0.00 0.00 177.57 178.35 3mfw h THR 290 N -0.64 1.22 -0.29 2.57 1.35 -1.14 -0.01 112.91 115.96 3mfw h THR 290 Ca -0.01 -1.02 -0.00 0.00 -0.55 0.00 0.00 66.41 64.83 3mfw h THR 290 Cb 0.51 1.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 3mfw h THR 290 CO 0.02 0.31 0.18 -0.09 -0.25 0.00 0.00 175.52 175.69 3mfw h ARG 291 N 0.18 0.40 -0.03 4.72 2.43 -0.92 0.22 114.38 121.38 3mfw h ARG 291 Ca 0.03 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3mfw h ARG 291 Cb 0.51 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3mfw h ARG 291 CO 0.04 0.30 -0.00 1.15 -1.51 0.00 0.00 179.97 179.95 3mfw h THR 292 N 0.38 1.26 -0.04 0.20 2.02 -0.58 -1.49 112.91 114.66 3mfw h THR 292 Ca 0.11 -0.78 0.01 0.00 0.77 0.00 0.00 66.41 66.51 3mfw h THR 292 Cb 0.01 1.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 3mfw h THR 292 CO -0.02 0.21 -0.00 0.58 0.37 0.00 0.00 175.52 176.66 3mfw h VAL 293 N -0.27 0.97 -1.00 3.16 2.07 -0.95 -1.50 116.25 118.72 3mfw h VAL 293 Ca 0.01 -0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 3mfw h VAL 293 Cb 0.34 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 3mfw h VAL 293 CO 0.00 0.00 0.66 0.78 0.02 0.00 0.00 177.57 179.03 3mfw h ASN 294 N 0.01 1.09 -0.37 0.57 2.35 -0.56 0.83 115.58 119.50 3mfw h ASN 294 Ca 0.02 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.67 3mfw h ASN 294 Cb 0.02 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 3mfw h ASN 294 CO -0.04 0.74 -0.14 0.74 -1.65 0.00 0.00 177.43 177.08 3mfw h THR 295 N 1.26 1.28 -0.97 2.81 2.02 -1.03 -1.00 112.91 117.29 3mfw h THR 295 Ca 0.40 -1.25 0.08 0.00 0.77 0.00 0.00 66.41 66.42 3mfw h THR 295 Cb 0.02 1.30 -0.07 0.00 -1.74 0.00 0.00 68.15 67.66 3mfw h THR 295 CO -0.13 0.41 0.62 0.00 0.37 0.00 0.00 175.52 176.80 3mfw h ALA 296 N 0.81 1.49 -0.32 6.16 0.00 -0.66 -0.29 119.26 126.45 3mfw h ALA 296 Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 3mfw h ALA 296 Cb 0.68 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3mfw h ALA 296 CO 0.05 0.34 -0.25 0.28 0.00 0.00 0.00 179.25 179.66 3mfw h VAL 297 N 1.06 1.29 -0.86 0.00 2.07 -0.65 -1.80 116.25 117.36 3mfw h VAL 297 Ca 0.44 -1.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 3mfw h VAL 297 Cb 0.29 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.52 3mfw h VAL 297 CO -0.19 0.46 0.43 0.00 0.02 0.00 0.00 177.57 178.29 3mfw h ALA 298 N 0.74 1.13 -0.59 1.67 0.00 -0.64 0.16 119.26 121.72 3mfw h ALA 298 Ca 0.06 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.82 3mfw h ALA 298 Cb 0.82 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3mfw h ALA 298 CO 0.07 0.67 0.39 0.82 0.00 0.00 0.00 179.25 181.20 3mfw h ILE 299 N 1.23 1.15 -0.17 0.00 1.08 -0.96 -1.91 117.51 117.91 3mfw h ILE 299 Ca 0.30 -0.27 -0.01 0.00 -0.39 0.00 0.00 64.86 64.48 3mfw h ILE 299 Cb 0.09 0.28 -0.01 0.00 -3.07 0.00 0.00 36.82 34.11 3mfw h ILE 299 CO -0.04 0.15 0.05 0.74 -0.69 0.00 0.00 178.15 178.36 3mfw h THR 300 N 0.80 1.19 -0.80 -0.27 2.02 -0.83 -2.67 112.91 112.36 3mfw h THR 300 Ca 0.22 -0.60 0.05 0.00 0.77 0.00 0.00 66.41 66.85 3mfw h THR 300 Cb -0.09 1.26 -0.06 0.00 -1.74 0.00 0.00 68.15 67.53 3mfw h THR 300 CO -0.05 0.18 0.49 -0.07 0.37 0.00 0.00 175.52 176.45 3mfw h LEU 301 N 0.10 0.78 -1.35 2.58 3.38 -0.52 -1.41 115.31 118.88 3mfw h LEU 301 Ca 0.06 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3mfw h LEU 301 Cb 0.24 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3mfw h LEU 301 CO -0.00 0.51 0.20 0.00 0.09 0.00 0.00 178.44 179.25 3mfw h ALA 302 N 1.37 1.50 0.00 1.53 0.00 -1.27 -1.58 119.26 120.80 3mfw h ALA 302 Ca 0.34 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3mfw h ALA 302 Cb 0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3mfw h ALA 302 CO -0.15 0.40 -0.00 0.00 0.00 0.00 0.00 179.25 179.49 3mfw n PHE 304 N -3.56 0.64 0.00 0.00 3.72 -0.66 -4.51 117.46 113.10 3mfw n PHE 304 Ca -0.03 -1.05 0.00 0.00 -0.05 0.00 0.00 57.45 56.32 3mfw n PHE 304 Cb 0.08 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.33 3mfw n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mfw n GLY 305 N -0.91 0.77 3.69 1.37 0.00 -0.79 -4.58 105.19 104.73 3mfw n GLY 305 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3mfw n GLY 305 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3mfw s LEU 306 N 0.00 4.39 -0.06 0.99 0.20 -0.84 -4.96 118.68 118.40 3mfw s LEU 306 Ca 0.00 2.67 0.05 0.00 0.69 0.00 0.00 54.13 57.55 3mfw s LEU 306 Cb 0.00 -3.56 -0.01 0.00 -0.43 0.00 0.00 46.19 42.19 3mfw s LEU 306 CO 0.00 -0.97 -0.23 0.00 -0.29 0.00 0.00 176.35 174.86 3mfw s ALA 307 N 2.75 2.03 0.50 5.97 0.00 -1.26 -4.18 121.76 127.57 3mfw s ALA 307 Ca 0.79 -0.95 0.15 0.00 0.00 0.00 0.00 51.96 51.95 3mfw s ALA 307 Cb -0.44 -0.67 1.20 0.00 0.00 0.00 0.00 23.12 23.21 3mfw s ALA 307 CO 0.35 0.36 2.11 0.00 0.00 0.00 0.00 175.76 178.58 3mfw h ARG 308 N 6.26 0.02 0.00 0.00 3.08 -1.98 -1.02 114.38 120.74 3mfw h ARG 308 Ca -0.29 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.76 3mfw h ARG 308 Cb 1.19 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 3mfw h ARG 308 CO 0.47 0.05 0.00 -0.85 -1.07 0.00 0.00 179.97 178.57 3mfw n GLU 309 N -4.49 0.08 0.00 0.04 0.28 -1.26 -4.99 120.64 110.30 3mfw n GLU 309 Ca -0.03 0.29 0.00 0.00 -0.16 0.00 0.00 57.16 57.27 3mfw n GLU 309 Cb 0.12 -1.64 0.00 0.00 1.43 0.00 0.00 31.44 31.35 3mfw n GLU 309 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3mfw n GLY 310 N 0.14 1.85 3.09 -1.84 0.00 -0.39 -5.11 105.19 102.93 3mfw n GLY 310 Ca 0.03 -2.11 -0.12 0.00 0.00 0.00 0.00 46.02 43.83 3mfw n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3mfw s ASN 311 N 0.00 -0.10 0.06 1.61 -0.87 -1.26 -4.53 114.94 109.85 3mfw s ASN 311 Ca 0.00 0.11 -0.07 0.00 -1.57 0.00 0.00 52.86 51.32 3mfw s ASN 311 Cb 0.00 0.30 -0.01 0.00 -0.02 0.00 0.00 41.25 41.52 3mfw s ASN 311 CO 0.00 -0.21 0.14 -1.38 -2.57 0.00 0.00 177.10 173.08 3mfw s HIS 312 N -0.61 0.18 0.54 2.20 -3.43 -1.26 -5.13 115.29 107.78 3mfw s HIS 312 Ca -0.07 -0.54 -0.03 0.00 -0.80 0.00 0.00 55.06 53.62 3mfw s HIS 312 Cb -0.04 -0.11 0.01 0.00 -1.43 0.00 0.00 32.58 31.01 3mfw s HIS 312 CO 0.01 -0.46 0.81 0.15 -2.00 0.00 0.00 174.74 173.26 3mfw s LYS 313 N -3.25 2.89 -1.13 -0.38 -0.14 -1.26 -4.96 119.74 111.51 3mfw s LYS 313 Ca 0.00 -0.28 -0.22 0.00 -1.36 0.00 0.00 55.97 54.12 3mfw s LYS 313 Cb 0.02 -2.39 -0.09 0.00 -1.68 0.00 0.00 37.83 33.70 3mfw s LYS 313 CO -0.08 -0.58 1.92 -2.30 -0.76 0.00 0.00 175.35 173.55 3mfw n PRO 314 N -2.40 1.72 -3.81 -1.68 -0.02 -1.26 -4.84 135.00 122.71 3mfw n PRO 314 Ca 0.04 -2.43 -0.11 0.00 -2.02 0.00 0.00 63.50 58.97 3mfw n PRO 314 Cb 0.58 -3.57 -0.08 0.00 -0.02 0.00 0.00 33.50 30.40 3mfw n PRO 314 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3mfw s ILE 315 N 9.43 0.09 -0.08 4.25 1.10 -1.26 -5.11 121.20 129.63 3mfw s ILE 315 Ca 0.65 -0.75 -0.30 0.00 -0.51 0.00 0.00 60.65 59.75 3mfw s ILE 315 Cb 0.02 -0.81 -0.04 0.00 0.15 0.00 0.00 42.46 41.79 3mfw s ILE 315 CO 0.13 -0.41 1.35 -0.62 -2.11 0.00 0.00 174.94 173.27 3mfw s ASP 316 N -1.87 6.90 0.22 4.50 3.68 -1.26 -4.87 116.67 123.97 3mfw s ASP 316 Ca -0.08 1.93 0.20 0.00 2.13 0.00 0.00 52.55 56.73 3mfw s ASP 316 Cb -0.02 -2.55 0.04 0.00 -1.45 0.00 0.00 42.92 38.94 3mfw s ASP 316 CO -0.02 -0.73 1.15 1.88 0.13 0.00 0.00 175.17 177.57 3mfw h TYR 317 N 8.13 0.00 -0.02 -5.34 0.05 -1.99 -3.54 116.97 114.26 3mfw h TYR 317 Ca -0.33 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.45 3mfw h TYR 317 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 3mfw h TYR 317 CO 0.78 0.19 0.00 1.28 -1.05 0.00 0.00 178.16 179.37