#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fug s LYS 2 N 0.00 0.32 0.05 0.00 -2.85 -1.26 -4.42 119.74 111.57 1fug s LYS 2 Ca 0.00 -0.12 -0.01 0.00 -1.00 0.00 0.00 55.97 54.83 1fug s LYS 2 Cb 0.00 0.14 -0.03 0.00 -2.06 0.00 0.00 37.83 35.88 1fug s LYS 2 CO 0.00 -0.14 -0.02 -1.01 0.10 0.00 0.00 175.35 174.28 1fug s HIS 3 N -2.43 0.45 0.22 1.78 3.76 0.79 -4.96 115.29 114.91 1fug s HIS 3 Ca 0.10 -0.94 0.06 0.00 -0.15 0.00 0.00 55.06 54.12 1fug s HIS 3 Cb -0.01 -0.34 -0.03 0.00 1.11 0.00 0.00 32.58 33.31 1fug s HIS 3 CO -0.05 -0.35 0.24 -0.51 -0.85 0.00 0.00 174.74 173.22 1fug s LEU 4 N -2.65 4.03 0.00 0.89 1.02 -1.26 0.93 118.68 121.63 1fug s LEU 4 Ca 0.03 -0.08 0.02 0.00 0.02 0.00 0.00 54.13 54.11 1fug s LEU 4 Cb 0.05 -2.58 -0.01 0.00 0.02 0.00 0.00 46.19 43.67 1fug s LEU 4 CO -0.08 -0.02 0.06 0.49 0.02 0.00 0.00 176.35 176.82 1fug n PHE 5 N -1.03 0.26 -3.57 0.29 3.72 -0.38 -4.94 117.46 111.81 1fug n PHE 5 Ca -0.08 -1.51 -0.14 0.00 -0.05 0.00 0.00 57.45 55.67 1fug n PHE 5 Cb 0.57 -0.06 -0.05 0.00 -0.94 0.00 0.00 39.48 38.99 1fug n PHE 5 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1fug s THR 6 N -2.33 0.03 -0.15 4.37 2.01 -1.26 -4.16 115.64 114.15 1fug s THR 6 Ca 0.08 -0.24 -0.06 0.00 0.31 0.00 0.00 61.69 61.79 1fug s THR 6 Cb 0.00 -0.98 0.07 0.00 0.01 0.00 0.00 72.50 71.60 1fug s THR 6 CO 0.06 -0.13 0.31 -0.44 -0.69 0.00 0.00 174.62 173.73 1fug s SER 7 N -2.02 0.05 0.97 3.53 0.01 -1.08 -4.09 113.70 111.07 1fug s SER 7 Ca -0.05 0.70 -0.14 0.00 1.31 0.00 0.00 55.95 57.78 1fug s SER 7 Cb -0.01 0.81 0.20 0.00 0.21 0.00 0.00 66.02 67.23 1fug s SER 7 CO -0.02 -0.22 1.17 -1.84 0.41 0.00 0.00 173.24 172.74 1fug n GLU 8 N 5.10 -1.07 -3.78 12.44 0.28 -1.26 -2.03 120.64 130.33 1fug n GLU 8 Ca -0.11 -1.91 -0.04 0.00 -0.16 0.00 0.00 57.16 54.94 1fug n GLU 8 Cb 0.51 -1.18 -0.01 0.00 1.43 0.00 0.00 31.44 32.19 1fug n GLU 8 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1fug s SER 9 N -5.33 -0.16 0.02 -1.84 0.15 -0.25 -4.71 113.70 101.58 1fug s SER 9 Ca 0.67 -0.47 -0.02 0.00 0.70 0.00 0.00 55.95 56.83 1fug s SER 9 Cb -0.02 0.52 -0.01 0.00 -1.71 0.00 0.00 66.02 64.80 1fug s SER 9 CO 0.47 -0.97 0.03 0.68 1.20 0.00 0.00 173.24 174.64 1fug s VAL 10 N -3.23 0.11 0.00 4.45 -7.23 -1.25 -1.43 120.40 111.82 1fug s VAL 10 Ca 0.13 -0.92 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 1fug s VAL 10 Cb -0.02 -0.43 0.00 0.00 0.56 0.00 0.00 36.38 36.49 1fug s VAL 10 CO 0.03 -0.51 0.00 -1.54 -0.31 0.00 0.00 175.10 172.78 1fug n SER 11 N 1.40 0.00 0.00 4.85 3.41 0.61 -4.90 113.62 118.99 1fug n SER 11 Ca -0.23 -0.76 0.10 0.00 -0.26 0.00 0.00 58.87 57.72 1fug n SER 11 Cb 0.56 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 65.03 1fug n SER 11 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1fug n GLU 12 N -0.76 0.38 0.01 4.33 0.28 -1.26 -2.65 120.64 120.98 1fug n GLU 12 Ca 0.00 0.07 -0.09 0.00 -0.16 0.00 0.00 57.16 56.98 1fug n GLU 12 Cb 0.00 -1.50 -0.13 0.00 1.43 0.00 0.00 31.44 31.24 1fug n GLU 12 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1fug h GLY 13 N 3.21 0.04 -3.95 -1.84 0.00 -1.90 -3.37 103.07 95.25 1fug h GLY 13 Ca 0.00 -0.10 -0.51 0.00 0.00 0.00 0.00 47.33 46.72 1fug h GLY 13 CO 0.00 0.09 0.55 -1.58 0.00 0.00 0.00 176.54 175.59 1fug s HIS 14 N -2.64 3.40 0.18 5.60 5.65 -1.08 -4.50 115.29 121.90 1fug s HIS 14 Ca -0.04 1.53 -0.24 0.00 0.25 0.00 0.00 55.06 56.55 1fug s HIS 14 Cb 0.08 -3.44 0.06 0.00 -1.18 0.00 0.00 32.58 28.11 1fug s HIS 14 CO 0.82 -1.12 1.57 -1.35 -0.65 0.00 0.00 174.74 174.01 1fug h PRO 15 N 4.23 -0.19 -0.73 2.88 0.11 -1.85 0.36 132.00 136.81 1fug h PRO 15 Ca -0.46 0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.76 1fug h PRO 15 Cb 1.22 0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.29 1fug h PRO 15 CO 0.69 -0.12 0.36 -0.44 -0.21 0.00 0.00 178.00 178.28 1fug h ASP 16 N -0.19 0.45 -0.44 -2.05 3.32 -1.84 1.19 116.42 116.87 1fug h ASP 16 Ca 0.20 0.07 -0.11 0.00 0.02 0.00 0.00 57.03 57.20 1fug h ASP 16 Cb 0.56 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1fug h ASP 16 CO -0.72 0.25 -0.14 0.11 -1.72 0.00 0.00 179.24 177.02 1fug h LYS 17 N 0.59 0.92 -0.80 3.56 1.79 -0.65 -1.71 116.57 120.27 1fug h LYS 17 Ca 0.36 -0.34 0.02 0.00 -2.18 0.00 0.00 60.65 58.51 1fug h LYS 17 Cb 0.41 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.96 1fug h LYS 17 CO -0.29 0.99 0.53 0.97 -1.08 0.00 0.00 179.45 180.58 1fug h ILE 18 N 0.81 1.18 0.39 1.86 -0.00 0.32 0.74 117.51 122.82 1fug h ILE 18 Ca 0.12 -0.36 -0.02 0.00 -0.00 0.00 0.00 64.86 64.60 1fug h ILE 18 Cb 0.68 0.04 0.00 0.00 -0.00 0.00 0.00 36.82 37.54 1fug h ILE 18 CO 0.05 0.19 -0.19 0.00 -0.00 0.00 0.00 178.15 178.21 1fug h ALA 19 N 1.51 -0.52 -0.84 0.18 0.00 -1.07 -1.96 119.26 116.56 1fug h ALA 19 Ca 0.30 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 55.19 1fug h ALA 19 Cb -0.08 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 1fug h ALA 19 CO -0.07 -0.71 0.43 0.22 0.00 0.00 0.00 179.25 179.12 1fug h ASP 20 N -0.70 0.54 0.62 0.00 1.82 -0.30 -0.52 116.42 117.88 1fug h ASP 20 Ca -0.05 0.08 -0.03 0.00 -0.39 0.00 0.00 57.03 56.65 1fug h ASP 20 Cb 0.49 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.50 1fug h ASP 20 CO 0.09 0.24 -0.41 1.56 -1.61 0.00 0.00 179.24 179.11 1fug h GLN 21 N 0.64 -0.93 -0.92 0.28 1.08 -0.54 -0.58 115.11 114.14 1fug h GLN 21 Ca 0.45 0.06 0.27 0.00 -1.45 0.00 0.00 58.65 57.98 1fug h GLN 21 Cb 0.60 0.21 -0.15 0.00 -0.05 0.00 0.00 27.48 28.09 1fug h GLN 21 CO -0.34 -0.62 0.29 0.82 -0.95 0.00 0.00 178.83 178.03 1fug h ILE 22 N -0.97 0.25 -0.20 2.54 2.04 -0.38 0.21 117.51 121.01 1fug h ILE 22 Ca -0.08 -0.06 -0.17 0.00 1.00 0.00 0.00 64.86 65.54 1fug h ILE 22 Cb 0.79 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 1fug h ILE 22 CO 0.06 0.03 -0.58 0.28 0.00 0.00 0.00 178.15 177.95 1fug h SER 23 N 0.19 0.70 -0.63 1.72 0.02 -0.06 0.22 113.55 115.72 1fug h SER 23 Ca 0.61 -0.39 -0.09 0.00 -0.84 0.00 0.00 61.79 61.08 1fug h SER 23 Cb 1.31 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.62 1fug h SER 23 CO -0.69 1.13 0.02 0.44 -1.14 0.00 0.00 176.83 176.59 1fug h ASP 24 N 0.47 1.07 -0.93 3.07 3.32 0.04 -0.31 116.42 123.15 1fug h ASP 24 Ca 0.00 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1fug h ASP 24 Cb 1.15 -0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.36 1fug h ASP 24 CO 0.11 1.10 0.60 0.00 -1.72 0.00 0.00 179.24 179.33 1fug h ALA 25 N 1.01 1.19 -0.16 3.45 0.00 0.10 0.26 119.26 125.10 1fug h ALA 25 Ca 0.18 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 1fug h ALA 25 Cb 0.54 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1fug h ALA 25 CO 0.03 0.61 -0.58 -0.24 0.00 0.00 0.00 179.25 179.06 1fug h VAL 26 N 1.27 1.33 -0.34 0.00 3.04 -0.47 0.01 116.25 121.10 1fug h VAL 26 Ca 0.34 -1.86 0.04 0.00 -1.01 0.00 0.00 66.70 64.22 1fug h VAL 26 Cb -0.11 1.83 -0.04 0.00 -2.01 0.00 0.00 31.29 30.96 1fug h VAL 26 CO -0.07 0.57 0.09 0.25 -1.01 0.00 0.00 177.57 177.40 1fug h LEU 27 N 0.40 0.06 0.52 3.16 7.12 0.71 -0.03 115.31 127.25 1fug h LEU 27 Ca 0.00 0.05 -0.03 0.00 0.13 0.00 0.00 57.88 58.03 1fug h LEU 27 Cb 1.13 0.05 0.01 0.00 -0.53 0.00 0.00 40.66 41.32 1fug h LEU 27 CO 0.11 0.07 -0.25 -0.78 -0.13 0.00 0.00 178.44 177.46 1fug h ASP 28 N 0.22 -0.59 0.84 1.25 3.58 -0.43 -0.49 116.42 120.80 1fug h ASP 28 Ca 0.16 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.60 1fug h ASP 28 Cb 0.15 0.15 -0.00 0.00 1.72 0.00 0.00 39.33 41.36 1fug h ASP 28 CO -0.18 -0.39 -0.03 0.00 -2.88 0.00 0.00 179.24 175.75 1fug h ALA 29 N -0.27 1.02 -0.19 -0.78 0.00 -0.48 0.65 119.26 119.21 1fug h ALA 29 Ca -0.07 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 1fug h ALA 29 Cb 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1fug h ALA 29 CO 0.12 0.04 -0.47 0.82 0.00 0.00 0.00 179.25 179.75 1fug h ILE 30 N 0.00 1.32 -0.08 0.00 2.04 -0.34 -3.28 117.51 117.17 1fug h ILE 30 Ca -0.00 -1.71 -0.04 0.00 1.00 0.00 0.00 64.86 64.11 1fug h ILE 30 Cb 0.46 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 1fug h ILE 30 CO 0.00 0.53 -0.15 -0.07 0.00 0.00 0.00 178.15 178.47 1fug h LEU 31 N 0.35 0.11 -1.16 1.44 -0.00 0.19 -3.06 115.31 113.19 1fug h LEU 31 Ca -0.00 -0.02 0.14 0.00 -0.00 0.00 0.00 57.88 58.00 1fug h LEU 31 Cb 1.09 -0.03 -0.08 0.00 -0.00 0.00 0.00 40.66 41.64 1fug h LEU 31 CO 0.10 0.27 0.60 -0.33 -0.00 0.00 0.00 178.44 179.09 1fug h GLU 32 N 0.11 0.78 0.00 1.13 4.39 -1.54 -0.86 114.58 118.59 1fug h GLU 32 Ca 0.02 -0.05 -0.21 0.00 0.34 0.00 0.00 59.36 59.46 1fug h GLU 32 Cb 0.33 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1fug h GLU 32 CO 0.02 0.52 -1.15 1.96 -1.16 0.00 0.00 179.01 179.20 1fug h GLN 33 N 0.80 0.00 -2.62 2.33 4.20 -1.71 -3.47 115.11 114.65 1fug h GLN 33 Ca 0.49 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.17 1fug h GLN 33 Cb 0.68 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.31 1fug h GLN 33 CO -0.25 0.75 0.23 0.16 -0.67 0.00 0.00 178.83 179.05 1fug s ASP 34 N -6.44 -0.58 0.05 1.46 1.47 -0.33 -4.86 116.67 107.44 1fug s ASP 34 Ca -0.00 0.23 0.13 0.00 1.18 0.00 0.00 52.55 54.09 1fug s ASP 34 Cb 0.09 0.56 -0.16 0.00 -0.34 0.00 0.00 42.92 43.07 1fug s ASP 34 CO 0.81 -0.82 0.90 1.55 0.68 0.00 0.00 175.17 178.29 1fug h PRO 35 N 2.32 0.00 0.00 2.11 0.13 -1.85 -3.33 132.00 131.38 1fug h PRO 35 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1fug h PRO 35 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1fug h PRO 35 CO 0.38 0.50 0.00 1.63 -0.23 0.00 0.00 178.00 180.28 1fug n LYS 36 N -3.06 0.88 -1.99 0.86 5.02 -1.26 -4.85 118.16 113.76 1fug n LYS 36 Ca -0.10 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.78 1fug n LYS 36 Cb 0.93 -1.37 -0.03 0.00 -0.02 0.00 0.00 35.03 34.54 1fug n LYS 36 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fug s ALA 37 N -2.00 3.68 0.30 7.82 0.00 -1.26 -5.02 121.76 125.28 1fug s ALA 37 Ca 0.31 1.33 -0.28 0.00 0.00 0.00 0.00 51.96 53.32 1fug s ALA 37 Cb 0.14 -3.58 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 1fug s ALA 37 CO 0.24 -0.75 1.05 1.03 0.00 0.00 0.00 175.76 177.33 1fug s ARG 38 N 0.22 4.60 -0.28 0.00 3.00 -1.26 -4.88 118.95 120.34 1fug s ARG 38 Ca 0.63 1.66 -0.08 0.00 0.00 0.00 0.00 55.73 57.93 1fug s ARG 38 Cb -0.42 -3.07 0.13 0.00 0.00 0.00 0.00 34.95 31.59 1fug s ARG 38 CO 0.39 0.22 0.60 0.54 0.00 0.00 0.00 175.30 177.05 1fug s VAL 39 N -1.28 -0.94 -0.07 3.52 0.11 -1.26 -1.05 120.40 119.43 1fug s VAL 39 Ca 0.46 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.57 1fug s VAL 39 Cb -0.28 -0.94 0.01 0.00 -1.53 0.00 0.00 36.38 33.63 1fug s VAL 39 CO 0.36 0.01 -0.14 0.00 -3.33 0.00 0.00 175.10 171.99 1fug s ALA 40 N 2.84 1.41 0.45 1.54 0.00 -0.52 -1.62 121.76 125.86 1fug s ALA 40 Ca -0.02 -0.52 0.05 0.00 0.00 0.00 0.00 51.96 51.46 1fug s ALA 40 Cb -0.12 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 1fug s ALA 40 CO -0.18 0.16 0.01 0.00 0.00 0.00 0.00 175.76 175.75 1fug s GLU 42 N -3.78 0.24 0.33 0.00 0.41 0.91 -4.75 118.70 112.05 1fug s GLU 42 Ca 0.23 0.74 0.05 0.00 -0.41 0.00 0.00 54.97 55.58 1fug s GLU 42 Cb 0.07 -0.00 -0.01 0.00 -1.78 0.00 0.00 34.13 32.40 1fug s GLU 42 CO 0.12 -0.22 0.47 0.95 -0.49 0.00 0.00 175.26 176.10 1fug s THR 43 N 1.91 4.42 -0.01 3.63 -4.23 -1.26 -2.28 115.64 117.82 1fug s THR 43 Ca -0.04 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.59 1fug s THR 43 Cb -0.11 -3.56 -0.00 0.00 1.34 0.00 0.00 72.50 70.17 1fug s THR 43 CO -0.10 -0.25 -0.07 -0.47 -0.54 0.00 0.00 174.62 173.20 1fug s TYR 44 N -2.19 0.63 0.02 3.99 6.14 -0.70 -1.23 117.35 124.01 1fug s TYR 44 Ca 0.42 -0.12 0.01 0.00 0.64 0.00 0.00 57.07 58.02 1fug s TYR 44 Cb -0.09 -0.42 -0.02 0.00 0.42 0.00 0.00 41.96 41.85 1fug s TYR 44 CO 0.32 -0.03 -0.04 0.14 0.64 0.00 0.00 175.55 176.58 1fug s VAL 45 N -0.06 0.23 -0.24 3.14 -7.23 -1.26 -0.85 120.40 114.13 1fug s VAL 45 Ca 0.01 -0.74 -0.32 0.00 -1.81 0.00 0.00 61.98 59.13 1fug s VAL 45 Cb -0.04 -0.32 0.16 0.00 0.56 0.00 0.00 36.38 36.75 1fug s VAL 45 CO -0.00 -0.33 1.26 -1.59 -0.31 0.00 0.00 175.10 174.13 1fug s LYS 46 N -1.13 0.21 0.00 4.82 -2.85 0.01 0.51 119.74 121.32 1fug s LYS 46 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 55.97 54.87 1fug s LYS 46 Cb -0.08 0.10 0.00 0.00 -2.06 0.00 0.00 37.83 35.79 1fug s LYS 46 CO -0.00 -0.08 0.00 0.25 0.10 0.00 0.00 175.35 175.62 1fug n THR 47 N 0.35 0.00 -0.31 3.79 -2.24 -0.26 0.62 114.28 116.23 1fug n THR 47 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1fug n THR 47 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1fug n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fug n GLY 48 N 0.00 0.69 2.98 3.38 0.00 -1.26 -4.75 105.19 106.23 1fug n GLY 48 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1fug n GLY 48 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1fug s MET 49 N -0.52 0.50 -0.09 1.61 0.23 0.20 -0.37 119.30 120.86 1fug s MET 49 Ca 0.00 -0.23 0.02 0.00 -1.03 0.00 0.00 55.69 54.45 1fug s MET 49 Cb 0.00 -0.48 0.01 0.00 -1.53 0.00 0.00 34.83 32.83 1fug s MET 49 CO 0.00 0.13 -0.15 0.08 -2.03 0.00 0.00 175.02 173.05 1fug s VAL 50 N -0.16 1.39 -0.17 5.16 1.01 0.27 -0.81 120.40 127.10 1fug s VAL 50 Ca 0.02 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 1fug s VAL 50 Cb -0.02 -1.27 -0.00 0.00 0.00 0.00 0.00 36.38 35.09 1fug s VAL 50 CO -0.00 0.42 -0.14 -1.48 0.00 0.00 0.00 175.10 173.89 1fug s LEU 51 N 0.80 2.52 -0.66 3.92 2.34 -0.03 0.36 118.68 127.93 1fug s LEU 51 Ca -0.11 -0.47 -0.15 0.00 0.06 0.00 0.00 54.13 53.46 1fug s LEU 51 Cb -0.16 -1.58 0.17 0.00 -0.56 0.00 0.00 46.19 44.06 1fug s LEU 51 CO 0.02 0.07 0.61 -0.69 -1.06 0.00 0.00 176.35 175.29 1fug s VAL 52 N 0.93 5.35 0.01 1.48 1.01 0.66 -1.71 120.40 128.13 1fug s VAL 52 Ca -0.03 -1.92 0.01 0.00 0.00 0.00 0.00 61.98 60.04 1fug s VAL 52 Cb -0.15 -4.38 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 1fug s VAL 52 CO -0.02 -0.93 0.06 -0.83 0.00 0.00 0.00 175.10 173.37 1fug s GLY 53 N 2.96 1.97 0.00 4.51 0.00 -0.97 -1.88 107.32 113.92 1fug s GLY 53 Ca 0.09 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1fug s GLY 53 CO -0.02 -0.80 0.00 0.61 0.00 0.00 0.00 173.10 172.89 1fug n GLY 54 N 1.17 -1.25 3.06 0.20 0.00 0.12 -0.06 105.19 108.42 1fug n GLY 54 Ca -0.13 -0.91 -0.27 0.00 0.00 0.00 0.00 46.02 44.71 1fug n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fug s GLU 55 N -0.85 2.02 -0.03 1.61 8.01 -0.06 -0.98 118.70 128.42 1fug s GLU 55 Ca 0.00 -0.52 0.05 0.00 0.01 0.00 0.00 54.97 54.52 1fug s GLU 55 Cb 0.00 -1.64 -0.01 0.00 -4.31 0.00 0.00 34.13 28.17 1fug s GLU 55 CO 0.00 0.03 -0.19 0.42 0.01 0.00 0.00 175.26 175.54 1fug s ILE 56 N 0.68 1.54 -0.19 -1.63 -1.09 -0.69 -1.44 121.20 118.39 1fug s ILE 56 Ca -0.14 -0.80 -0.06 0.00 -2.23 0.00 0.00 60.65 57.42 1fug s ILE 56 Cb -0.16 -1.30 -0.03 0.00 -1.58 0.00 0.00 42.46 39.38 1fug s ILE 56 CO 0.04 0.44 0.03 0.42 -1.23 0.00 0.00 174.94 174.64 1fug s THR 57 N -0.19 4.44 -0.15 2.92 -4.23 -0.21 -2.15 115.64 116.06 1fug s THR 57 Ca 0.01 -0.15 -0.34 0.00 -1.18 0.00 0.00 61.69 60.02 1fug s THR 57 Cb -0.10 -3.00 0.13 0.00 1.34 0.00 0.00 72.50 70.87 1fug s THR 57 CO 0.01 0.45 1.18 0.28 -0.54 0.00 0.00 174.62 176.00 1fug s THR 58 N 0.60 0.00 -0.65 3.99 -1.32 -1.24 -3.98 115.64 113.03 1fug s THR 58 Ca 0.01 -0.03 0.24 0.00 -1.21 0.00 0.00 61.69 60.71 1fug s THR 58 Cb -0.13 -1.10 0.08 0.00 -1.51 0.00 0.00 72.50 69.84 1fug s THR 58 CO 0.02 0.00 1.39 -1.20 -2.21 0.00 0.00 174.62 172.61 1fug n SER 59 N -0.15 0.72 -4.74 8.08 7.64 -1.26 -4.86 113.62 119.06 1fug n SER 59 Ca -0.01 0.19 -0.37 0.00 1.01 0.00 0.00 58.87 59.69 1fug n SER 59 Cb 0.59 0.01 0.06 0.00 -1.01 0.00 0.00 64.21 63.86 1fug n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fug s ALA 60 N -3.16 2.42 -0.15 -0.43 0.00 -1.26 -5.00 121.76 114.18 1fug s ALA 60 Ca 0.07 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.23 1fug s ALA 60 Cb 0.13 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 19.73 1fug s ALA 60 CO 0.70 -1.51 -0.21 -1.58 0.00 0.00 0.00 175.76 173.17 1fug s TRP 61 N -1.43 2.70 -0.06 0.00 0.52 -1.26 -5.11 118.94 114.30 1fug s TRP 61 Ca 0.81 -1.35 0.02 0.00 0.02 0.00 0.00 56.10 55.61 1fug s TRP 61 Cb -0.36 -1.84 0.01 0.00 -1.15 0.00 0.00 33.47 30.12 1fug s TRP 61 CO 0.38 -0.63 -0.12 0.08 0.02 0.00 0.00 176.95 176.68 1fug s VAL 62 N 0.90 1.13 -0.73 4.03 1.01 -1.26 -5.03 120.40 120.45 1fug s VAL 62 Ca -0.05 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.23 1fug s VAL 62 Cb -0.15 -1.03 0.08 0.00 0.00 0.00 0.00 36.38 35.28 1fug s VAL 62 CO -0.03 0.35 1.01 1.51 0.00 0.00 0.00 175.10 177.94 1fug s ASP 63 N 0.61 6.29 0.47 3.32 -4.77 -1.26 -4.87 116.67 116.46 1fug s ASP 63 Ca -0.13 -1.26 0.32 0.00 -3.30 0.00 0.00 52.55 48.17 1fug s ASP 63 Cb -0.15 -2.42 1.42 0.00 -1.09 0.00 0.00 42.92 40.68 1fug s ASP 63 CO 0.04 -1.35 1.70 0.16 0.70 0.00 0.00 175.17 176.41 1fug h ILE 64 N 5.97 0.28 -0.71 2.11 -2.65 -1.98 0.29 117.51 120.80 1fug h ILE 64 Ca -0.17 -0.04 -0.06 0.00 1.03 0.00 0.00 64.86 65.62 1fug h ILE 64 Cb 1.06 0.14 -0.03 0.00 -2.05 0.00 0.00 36.82 35.93 1fug h ILE 64 CO 1.17 0.02 0.20 -0.08 0.03 0.00 0.00 178.15 179.50 1fug h GLU 65 N 0.13 1.12 -0.10 0.16 4.81 -1.96 0.55 114.58 119.29 1fug h GLU 65 Ca 0.72 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 59.67 1fug h GLU 65 Cb 2.40 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 31.62 1fug h GLU 65 CO -0.23 0.97 -0.06 1.49 -0.73 0.00 0.00 179.01 180.45 1fug h GLU 66 N 1.07 0.22 -0.36 1.92 4.81 -0.86 -3.02 114.58 118.36 1fug h GLU 66 Ca 0.23 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1fug h GLU 66 Cb 0.33 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1fug h GLU 66 CO -0.00 0.58 0.05 0.82 -0.73 0.00 0.00 179.01 179.73 1fug h ILE 67 N -0.15 1.24 -0.81 2.32 1.08 0.49 0.91 117.51 122.59 1fug h ILE 67 Ca 0.02 -0.86 0.16 0.00 -0.39 0.00 0.00 64.86 63.80 1fug h ILE 67 Cb 0.52 1.11 -0.10 0.00 -3.07 0.00 0.00 36.82 35.28 1fug h ILE 67 CO 0.02 0.29 0.33 0.74 -0.69 0.00 0.00 178.15 178.84 1fug h THR 68 N 0.43 0.61 0.25 -0.27 2.02 -0.74 -2.48 112.91 112.72 1fug h THR 68 Ca 0.11 -0.15 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 1fug h THR 68 Cb 0.37 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1fug h THR 68 CO 0.01 0.08 -0.12 -0.09 0.37 0.00 0.00 175.52 175.77 1fug h ARG 69 N 0.45 -0.32 0.00 6.66 9.65 0.96 -1.51 114.38 130.27 1fug h ARG 69 Ca 0.46 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 59.36 1fug h ARG 69 Cb 0.75 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.40 1fug h ARG 69 CO -0.44 -0.21 0.00 0.27 2.80 0.00 0.00 179.97 182.39 1fug n ASN 70 N -3.77 0.00 -0.04 -3.80 6.94 -0.72 -1.05 115.26 112.83 1fug n ASN 70 Ca -0.04 0.17 -0.14 0.00 -0.02 0.00 0.00 54.58 54.55 1fug n ASN 70 Cb 0.13 -0.35 -0.09 0.00 -2.36 0.00 0.00 39.78 37.11 1fug n ASN 70 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 1fug h THR 71 N 0.00 1.40 0.00 5.53 2.02 -1.21 -0.68 112.91 119.98 1fug h THR 71 Ca 0.00 -1.58 -0.02 0.00 0.77 0.00 0.00 66.41 65.58 1fug h THR 71 Cb 0.22 2.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.82 1fug h THR 71 CO 0.00 0.45 -0.11 0.58 0.37 0.00 0.00 175.52 176.81 1fug h VAL 72 N -0.14 0.49 -0.14 3.16 2.07 -0.02 0.75 116.25 122.43 1fug h VAL 72 Ca -0.00 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1fug h VAL 72 Cb 0.85 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1fug h VAL 72 CO 0.05 0.11 0.08 -0.09 0.02 0.00 0.00 177.57 177.75 1fug h ARG 73 N 0.00 0.17 0.00 1.57 9.65 -1.19 -1.99 114.38 122.59 1fug h ARG 73 Ca -0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1fug h ARG 73 Cb 0.36 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.90 1fug h ARG 73 CO 0.01 0.11 0.00 -1.91 2.80 0.00 0.00 179.97 180.99 1fug n GLU 74 N -5.00 0.54 -0.24 0.20 2.13 0.26 -0.55 120.64 117.98 1fug n GLU 74 Ca -0.04 0.03 0.12 0.00 0.66 0.00 0.00 57.16 57.93 1fug n GLU 74 Cb 0.03 -1.50 0.25 0.00 0.27 0.00 0.00 31.44 30.49 1fug n GLU 74 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1fug n ILE 75 N -1.10 0.63 -0.14 6.31 2.08 -0.75 -4.96 119.36 121.42 1fug n ILE 75 Ca 0.14 -0.80 0.00 0.00 0.56 0.00 0.00 62.75 62.65 1fug n ILE 75 Cb 0.10 0.82 0.00 0.00 -0.75 0.00 0.00 39.64 39.82 1fug n ILE 75 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1fug n GLY 76 N 1.54 1.34 3.56 7.39 0.00 0.29 -4.69 105.19 114.61 1fug n GLY 76 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1fug n GLY 76 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fug s TYR 77 N -2.66 1.85 0.00 1.61 2.02 -1.24 -4.81 117.35 114.13 1fug s TYR 77 Ca 0.00 0.62 0.00 0.00 -0.37 0.00 0.00 57.07 57.32 1fug s TYR 77 Cb 0.00 -4.21 0.00 0.00 -0.40 0.00 0.00 41.96 37.35 1fug s TYR 77 CO 0.00 -2.29 0.00 0.28 -1.57 0.00 0.00 175.55 171.97 1fug n VAL 78 N 7.07 0.00 -2.63 0.71 0.31 -1.26 -1.26 118.33 121.26 1fug n VAL 78 Ca 0.17 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 64.07 1fug n VAL 78 Cb 0.51 -0.67 -0.02 0.00 -0.91 0.00 0.00 33.84 32.75 1fug n VAL 78 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1fug s HIS 79 N -0.57 3.10 0.58 3.52 0.00 -1.26 -4.00 115.29 116.66 1fug s HIS 79 Ca 0.00 1.14 0.24 0.00 -3.00 0.00 0.00 55.06 53.43 1fug s HIS 79 Cb 0.00 -3.79 1.28 0.00 -4.00 0.00 0.00 32.58 26.07 1fug s HIS 79 CO 0.00 -0.84 1.71 0.77 -1.00 0.00 0.00 174.74 175.38 1fug h SER 80 N 8.24 0.00 0.00 7.38 0.02 -1.95 -1.33 113.55 125.90 1fug h SER 80 Ca -0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1fug h SER 80 Cb 1.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1fug h SER 80 CO 1.05 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 177.21 1fug n ASP 81 N -2.72 0.00 -0.79 3.07 9.92 -1.26 -0.34 116.55 124.43 1fug n ASP 81 Ca -0.02 -0.75 0.04 0.00 -0.53 0.00 0.00 54.79 53.54 1fug n ASP 81 Cb 0.46 0.00 0.15 0.00 -0.64 0.00 0.00 41.12 41.09 1fug n ASP 81 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 1fug n MET 82 N -0.91 2.11 0.00 -1.24 0.00 -0.50 -4.71 117.12 111.87 1fug n MET 82 Ca 0.12 -1.21 0.00 0.00 0.00 0.00 0.00 57.70 56.61 1fug n MET 82 Cb 0.06 -1.48 0.00 0.00 0.00 0.00 0.00 33.22 31.79 1fug n MET 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1fug n GLY 83 N 0.69 2.22 3.22 -5.12 0.00 0.54 -4.56 105.19 102.19 1fug n GLY 83 Ca 0.11 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.26 1fug n GLY 83 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1fug s PHE 84 N 0.00 -0.39 0.13 1.61 -0.12 -1.25 -4.77 117.98 113.19 1fug s PHE 84 Ca 0.00 0.94 -0.19 0.00 -0.05 0.00 0.00 56.93 57.62 1fug s PHE 84 Cb 0.00 0.13 -0.07 0.00 -0.63 0.00 0.00 43.02 42.45 1fug s PHE 84 CO 0.00 -0.20 0.62 0.34 -0.05 0.00 0.00 175.22 175.94 1fug s ASP 85 N 0.34 7.07 -0.41 1.98 2.15 -1.26 -4.57 116.67 121.97 1fug s ASP 85 Ca -0.01 1.32 -0.02 0.00 0.43 0.00 0.00 52.55 54.26 1fug s ASP 85 Cb -0.03 -2.38 0.19 0.00 -0.30 0.00 0.00 42.92 40.39 1fug s ASP 85 CO -0.01 0.19 2.29 0.00 -0.17 0.00 0.00 175.17 177.47 1fug n ALA 86 N 1.36 5.74 -0.02 3.66 0.00 -0.39 -3.45 120.51 127.41 1fug n ALA 86 Ca -0.07 -2.38 -0.04 0.00 0.00 0.00 0.00 53.44 50.95 1fug n ALA 86 Cb 0.51 -1.70 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 1fug n ALA 86 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1fug n ASN 87 N 0.39 1.09 0.07 0.00 4.13 -1.26 -4.73 115.26 114.95 1fug n ASN 87 Ca 0.40 0.03 0.11 0.00 1.68 0.00 0.00 54.58 56.80 1fug n ASN 87 Cb 0.57 -0.11 0.44 0.00 -1.54 0.00 0.00 39.78 39.14 1fug n ASN 87 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1fug n SER 88 N -3.05 0.40 -4.60 6.41 7.64 -1.25 -4.85 113.62 114.32 1fug n SER 88 Ca -0.08 0.58 -0.43 0.00 1.01 0.00 0.00 58.87 59.95 1fug n SER 88 Cb 0.56 -0.67 -0.03 0.00 -1.01 0.00 0.00 64.21 63.06 1fug n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fug s ALA 90 N 7.75 2.02 -0.08 0.00 0.00 0.50 -4.84 121.76 127.12 1fug s ALA 90 Ca 1.00 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 53.87 1fug s ALA 90 Cb -0.38 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.28 1fug s ALA 90 CO 0.37 -2.04 0.03 0.54 0.00 0.00 0.00 175.76 174.65 1fug s VAL 91 N -1.94 0.23 -0.17 0.00 0.11 -1.24 -0.57 120.40 116.83 1fug s VAL 91 Ca 0.76 0.11 0.01 0.00 -2.93 0.00 0.00 61.98 59.93 1fug s VAL 91 Cb -0.31 -0.49 0.01 0.00 -1.53 0.00 0.00 36.38 34.07 1fug s VAL 91 CO 0.47 0.15 -0.20 -0.76 -3.33 0.00 0.00 175.10 171.43 1fug s LEU 92 N 2.02 2.16 -0.15 2.54 1.43 0.16 -4.94 118.68 121.90 1fug s LEU 92 Ca 0.04 -0.62 -0.25 0.00 -1.03 0.00 0.00 54.13 52.27 1fug s LEU 92 Cb -0.13 -1.48 -0.02 0.00 0.03 0.00 0.00 46.19 44.59 1fug s LEU 92 CO -0.05 0.03 0.83 -0.44 0.23 0.00 0.00 176.35 176.95 1fug s SER 93 N 1.11 6.98 -0.39 2.29 0.01 -1.26 -0.24 113.70 122.20 1fug s SER 93 Ca 0.00 1.20 0.12 0.00 1.31 0.00 0.00 55.95 58.58 1fug s SER 93 Cb -0.14 -2.46 0.37 0.00 0.21 0.00 0.00 66.02 64.00 1fug s SER 93 CO -0.08 -0.36 0.81 0.00 0.41 0.00 0.00 173.24 174.02 1fug n ALA 94 N 5.02 2.71 -3.10 1.44 0.00 -0.79 -4.97 120.51 120.82 1fug n ALA 94 Ca 0.04 -3.55 -0.36 0.00 0.00 0.00 0.00 53.44 49.57 1fug n ALA 94 Cb 0.49 -0.89 -0.13 0.00 0.00 0.00 0.00 19.45 18.92 1fug n ALA 94 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1fug s ILE 95 N -2.93 4.15 -0.35 0.00 -4.36 -1.25 0.12 121.20 116.58 1fug s ILE 95 Ca 0.39 -0.23 -0.19 0.00 -0.26 0.00 0.00 60.65 60.36 1fug s ILE 95 Cb 0.36 -2.92 -0.00 0.00 1.25 0.00 0.00 42.46 41.15 1fug s ILE 95 CO -0.07 0.37 0.56 -0.83 0.24 0.00 0.00 174.94 175.22 1fug s GLY 96 N 1.41 1.79 -0.23 6.27 0.00 -0.15 -4.89 107.32 111.51 1fug s GLY 96 Ca 0.05 -0.95 -0.20 0.00 0.00 0.00 0.00 44.72 43.62 1fug s GLY 96 CO 0.02 1.36 0.60 1.25 0.00 0.00 0.00 173.10 176.33 1fug s LYS 97 N 2.52 4.14 -0.12 2.90 2.20 -1.26 -1.70 119.74 128.44 1fug s LYS 97 Ca 0.21 0.52 -0.02 0.00 -0.36 0.00 0.00 55.97 56.31 1fug s LYS 97 Cb -0.15 -3.62 -0.03 0.00 -1.51 0.00 0.00 37.83 32.52 1fug s LYS 97 CO 0.14 -0.32 -0.03 -1.14 -0.36 0.00 0.00 175.35 173.64 1fug s GLN 98 N 2.19 3.27 0.73 4.03 2.00 -0.92 -5.01 119.66 125.95 1fug s GLN 98 Ca 0.26 -0.49 -0.06 0.00 -2.00 0.00 0.00 55.36 53.07 1fug s GLN 98 Cb -0.16 -2.81 0.09 0.00 0.80 0.00 0.00 33.01 30.93 1fug s GLN 98 CO 0.09 0.47 1.03 -1.12 -0.50 0.00 0.00 175.29 175.26 1fug s SER 99 N -0.27 4.55 0.00 6.67 0.01 -1.26 -3.71 113.70 119.69 1fug s SER 99 Ca 0.05 0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.55 1fug s SER 99 Cb -0.13 -0.78 0.00 0.00 0.21 0.00 0.00 66.02 65.32 1fug s SER 99 CO 0.02 -1.75 0.01 -2.65 0.41 0.00 0.00 173.24 169.28 1fug n PRO 100 N -2.96 0.00 0.00 12.44 -0.02 -1.26 -4.25 135.00 138.95 1fug n PRO 100 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1fug n PRO 100 Cb 0.60 -1.01 0.00 0.00 -0.02 0.00 0.00 33.50 33.07 1fug n PRO 100 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1fug n ASP 101 N -0.38 0.34 -4.36 2.55 9.92 -1.26 -5.07 116.55 118.28 1fug n ASP 101 Ca 0.00 0.00 -0.46 0.00 -0.53 0.00 0.00 54.79 53.80 1fug n ASP 101 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 1fug n ASP 101 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1fug s ILE 102 N -1.43 5.22 0.32 0.53 2.07 -1.26 -5.01 121.20 121.64 1fug s ILE 102 Ca 0.00 -1.86 0.09 0.00 -1.41 0.00 0.00 60.65 57.46 1fug s ILE 102 Cb 0.00 -4.52 -0.04 0.00 0.13 0.00 0.00 42.46 38.03 1fug s ILE 102 CO 0.00 -1.13 0.08 0.21 -1.91 0.00 0.00 174.94 172.19 1fug s ASN 103 N 2.95 4.56 -0.44 4.50 3.84 -1.26 -4.94 114.94 124.15 1fug s ASN 103 Ca 0.18 -0.77 -0.21 0.00 0.21 0.00 0.00 52.86 52.27 1fug s ASN 103 Cb -0.15 -0.74 0.02 0.00 -0.55 0.00 0.00 41.25 39.84 1fug s ASN 103 CO -0.04 -0.20 0.66 -1.10 -2.79 0.00 0.00 177.10 173.63 1fug s GLN 104 N -3.77 3.31 0.00 0.43 1.11 -1.26 -4.69 119.66 114.78 1fug s GLN 104 Ca 0.35 -0.33 0.00 0.00 0.01 0.00 0.00 55.36 55.40 1fug s GLN 104 Cb -0.03 -3.94 0.00 0.00 -1.01 0.00 0.00 33.01 28.02 1fug s GLN 104 CO 0.21 -1.01 0.00 0.41 0.01 0.00 0.00 175.29 174.91 1fug n GLY 105 N 5.02 0.22 2.02 3.09 0.00 -1.26 -5.09 105.19 109.19 1fug n GLY 105 Ca -0.01 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1fug n GLY 105 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1fug n VAL 106 N 0.61 0.00 -1.47 1.61 0.24 -1.26 -5.16 118.33 112.90 1fug n VAL 106 Ca 0.00 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.89 1fug n VAL 106 Cb 0.00 -0.45 0.01 0.00 -1.47 0.00 0.00 33.84 31.94 1fug n VAL 106 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1fug n ASP 107 N -3.23 -0.68 0.00 -1.34 9.92 -1.26 -5.02 116.55 114.95 1fug n ASP 107 Ca 0.00 0.90 0.00 0.00 -0.53 0.00 0.00 54.79 55.16 1fug n ASP 107 Cb 0.00 -1.15 0.00 0.00 -0.64 0.00 0.00 41.12 39.33 1fug n ASP 107 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1fug n ARG 108 N 0.47 0.52 0.00 -1.24 1.85 -1.26 -4.81 116.66 112.19 1fug n ARG 108 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.96 1fug n ARG 108 Cb 0.40 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.81 1fug n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1fug n ALA 109 N -3.00 0.00 -0.00 2.89 0.00 -1.26 -4.84 120.51 114.29 1fug n ALA 109 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1fug n ALA 109 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1fug n ALA 109 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1fug n ASP 110 N 0.00 0.43 -4.27 0.00 2.03 -1.26 -5.02 116.55 108.45 1fug n ASP 110 Ca 0.00 0.06 -0.29 0.00 0.52 0.00 0.00 54.79 55.08 1fug n ASP 110 Cb 0.00 -0.30 0.20 0.00 -0.72 0.00 0.00 41.12 40.30 1fug n ASP 110 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1fug s PRO 111 N -1.40 -0.20 0.15 -0.67 0.05 -1.26 -4.94 135.00 126.73 1fug s PRO 111 Ca -0.04 0.14 -0.12 0.00 0.05 0.00 0.00 61.00 61.03 1fug s PRO 111 Cb 0.00 -1.70 0.01 0.00 0.05 0.00 0.00 34.50 32.87 1fug s PRO 111 CO 0.05 -3.07 1.59 -0.07 0.05 0.00 0.00 177.00 175.55 1fug h LEU 112 N -2.13 0.88 0.00 -3.56 3.38 -2.01 -3.20 115.31 108.67 1fug h LEU 112 Ca -0.49 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.16 1fug h LEU 112 Cb 1.31 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1fug h LEU 112 CO 0.47 0.99 0.00 1.21 0.09 0.00 0.00 178.44 181.19 1fug n GLU 113 N -4.30 0.00 -0.95 1.13 4.07 -1.26 -2.51 120.64 116.83 1fug n GLU 113 Ca 0.01 0.29 -0.00 0.00 -0.06 0.00 0.00 57.16 57.40 1fug n GLU 113 Cb 0.34 -1.50 0.34 0.00 -0.06 0.00 0.00 31.44 30.56 1fug n GLU 113 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1fug n GLN 114 N -1.50 4.09 -1.24 5.31 1.13 -1.21 -4.63 117.38 119.33 1fug n GLN 114 Ca 0.03 -3.12 -0.30 0.00 -1.94 0.00 0.00 57.00 51.67 1fug n GLN 114 Cb 0.14 -2.21 0.24 0.00 0.11 0.00 0.00 30.24 28.51 1fug n GLN 114 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1fug s GLY 115 N -1.03 1.63 0.05 1.08 0.00 -1.04 -4.55 107.32 103.45 1fug s GLY 115 Ca 0.54 -1.06 -0.05 0.00 0.00 0.00 0.00 44.72 44.15 1fug s GLY 115 CO 0.14 -0.17 0.10 0.00 0.00 0.00 0.00 173.10 173.17 1fug s ALA 116 N -3.19 -0.02 0.00 3.20 0.00 -1.26 -3.77 121.76 116.71 1fug s ALA 116 Ca 0.72 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1fug s ALA 116 Cb -0.08 0.29 0.00 0.00 0.00 0.00 0.00 23.12 23.33 1fug s ALA 116 CO 0.55 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.37 1fug n GLY 117 N 0.56 3.87 4.00 0.00 0.00 -1.26 -4.72 105.19 107.64 1fug n GLY 117 Ca -0.18 -1.87 -0.22 0.00 0.00 0.00 0.00 46.02 43.75 1fug n GLY 117 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fug s ASP 118 N 0.13 4.71 0.42 1.61 1.47 -1.26 -3.13 116.67 120.61 1fug s ASP 118 Ca 0.00 -0.39 0.08 0.00 1.18 0.00 0.00 52.55 53.41 1fug s ASP 118 Cb 0.00 -0.14 -0.02 0.00 -0.34 0.00 0.00 42.92 42.43 1fug s ASP 118 CO 0.00 -1.59 0.41 -1.58 0.68 0.00 0.00 175.17 173.09 1fug s GLN 119 N -4.95 2.59 0.00 2.11 -0.44 -1.26 -4.48 119.66 113.23 1fug s GLN 119 Ca 0.63 -1.48 0.00 0.00 -2.50 0.00 0.00 55.36 52.01 1fug s GLN 119 Cb -0.06 -2.45 0.00 0.00 -1.64 0.00 0.00 33.01 28.86 1fug s GLN 119 CO 0.42 -0.21 0.00 0.41 0.50 0.00 0.00 175.29 176.41 1fug n GLY 120 N -1.60 0.19 3.09 2.59 0.00 -1.23 -4.95 105.19 103.28 1fug n GLY 120 Ca 0.04 -1.53 -0.11 0.00 0.00 0.00 0.00 46.02 44.42 1fug n GLY 120 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1fug s LEU 121 N 0.00 1.58 -0.01 0.99 2.34 -1.26 -2.26 118.68 120.05 1fug s LEU 121 Ca 0.00 -0.15 -0.10 0.00 0.06 0.00 0.00 54.13 53.93 1fug s LEU 121 Cb 0.00 0.62 0.01 0.00 -0.56 0.00 0.00 46.19 46.26 1fug s LEU 121 CO 0.00 -0.32 0.22 -0.04 -1.06 0.00 0.00 176.35 175.14 1fug s MET 122 N -1.19 0.54 0.13 1.48 -1.94 0.99 -4.47 119.30 114.84 1fug s MET 122 Ca -0.13 -0.25 0.01 0.00 -1.71 0.00 0.00 55.69 53.61 1fug s MET 122 Cb -0.07 0.23 -0.04 0.00 2.01 0.00 0.00 34.83 36.96 1fug s MET 122 CO 0.01 -0.13 -0.00 -0.06 -0.01 0.00 0.00 175.02 174.83 1fug s PHE 123 N -1.21 0.97 -0.04 -0.03 0.40 -1.26 -0.34 117.98 116.46 1fug s PHE 123 Ca -0.13 -1.06 -0.14 0.00 -0.60 0.00 0.00 56.93 55.00 1fug s PHE 123 Cb -0.06 -0.57 0.02 0.00 0.51 0.00 0.00 43.02 42.93 1fug s PHE 123 CO 0.03 -0.30 0.31 0.20 0.70 0.00 0.00 175.22 176.15 1fug s GLY 124 N -3.08 -0.17 -0.03 4.36 0.00 -0.63 -4.79 107.32 102.98 1fug s GLY 124 Ca 0.20 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.39 1fug s GLY 124 CO -0.00 0.29 0.01 -0.47 0.00 0.00 0.00 173.10 172.93 1fug s TYR 125 N -0.92 0.21 0.42 1.90 5.04 -1.25 -1.73 117.35 121.02 1fug s TYR 125 Ca -0.10 0.06 0.07 0.00 -2.44 0.00 0.00 57.07 54.66 1fug s TYR 125 Cb -0.05 -0.37 -0.06 0.00 0.35 0.00 0.00 41.96 41.84 1fug s TYR 125 CO 0.03 -0.13 0.14 0.00 -1.34 0.00 0.00 175.55 174.25 1fug s ALA 126 N 1.15 3.51 -0.29 3.97 0.00 -0.84 -4.83 121.76 124.42 1fug s ALA 126 Ca -0.08 -2.10 -0.16 0.00 0.00 0.00 0.00 51.96 49.62 1fug s ALA 126 Cb -0.13 -0.24 0.16 0.00 0.00 0.00 0.00 23.12 22.91 1fug s ALA 126 CO -0.02 -0.16 1.04 0.95 0.00 0.00 0.00 175.76 177.57 1fug s THR 127 N -2.64 -0.11 -1.35 0.00 -4.23 -0.25 -3.37 115.64 103.70 1fug s THR 127 Ca 0.39 0.00 -0.15 0.00 -1.18 0.00 0.00 61.69 60.75 1fug s THR 127 Cb 0.05 -1.00 0.09 0.00 1.34 0.00 0.00 72.50 72.98 1fug s THR 127 CO 0.21 0.00 1.92 -0.46 -0.54 0.00 0.00 174.62 175.74 1fug n ASN 128 N 3.91 4.58 -0.09 3.99 6.94 -1.25 -3.86 115.26 129.48 1fug n ASN 128 Ca -0.16 -2.92 -0.21 0.00 -0.02 0.00 0.00 54.58 51.27 1fug n ASN 128 Cb 0.56 -1.65 -0.12 0.00 -2.36 0.00 0.00 39.78 36.21 1fug n ASN 128 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 1fug h GLU 129 N 6.62 0.02 0.00 -3.83 4.57 -1.78 -3.48 114.58 116.70 1fug h GLU 129 Ca 0.47 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.62 1fug h GLU 129 Cb 0.74 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.34 1fug h GLU 129 CO 1.63 1.01 -0.49 2.41 -1.18 0.00 0.00 179.01 182.39 1fug n THR 130 N -4.41 0.03 0.03 0.32 -1.04 -1.23 -4.84 114.28 103.15 1fug n THR 130 Ca -0.29 0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1fug n THR 130 Cb 0.68 -1.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 1fug n THR 130 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1fug n ASP 131 N -2.79 -0.34 -4.78 8.00 5.68 -1.26 -5.04 116.55 116.01 1fug n ASP 131 Ca 0.00 0.11 -0.30 0.00 -0.50 0.00 0.00 54.79 54.10 1fug n ASP 131 Cb 0.24 0.54 0.10 0.00 -1.14 0.00 0.00 41.12 40.86 1fug n ASP 131 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1fug s VAL 132 N -1.15 3.06 -0.27 2.12 0.11 -1.26 -4.90 120.40 118.11 1fug s VAL 132 Ca 0.00 0.34 0.02 0.00 -2.93 0.00 0.00 61.98 59.41 1fug s VAL 132 Cb 0.00 -3.01 0.35 0.00 -1.53 0.00 0.00 36.38 32.19 1fug s VAL 132 CO 0.00 -0.45 1.58 0.18 -3.33 0.00 0.00 175.10 173.09 1fug n LEU 133 N -3.52 5.30 -4.81 2.54 4.77 -1.26 -4.46 117.00 115.55 1fug n LEU 133 Ca 0.07 -2.78 -0.33 0.00 -0.03 0.00 0.00 56.01 52.94 1fug n LEU 133 Cb 0.56 -0.74 -0.05 0.00 -2.33 0.00 0.00 43.42 40.85 1fug n LEU 133 CO 0.56 0.87 0.69 -0.32 -1.33 0.00 0.00 177.39 177.86 1fug s MET 134 N -1.85 3.99 -1.17 3.23 1.75 -1.25 -1.09 119.30 122.91 1fug s MET 134 Ca 0.32 1.24 -0.21 0.00 -1.25 0.00 0.00 55.69 55.79 1fug s MET 134 Cb 0.27 -2.13 0.01 0.00 2.84 0.00 0.00 34.83 35.81 1fug s MET 134 CO 0.05 -0.26 1.76 -1.25 -0.65 0.00 0.00 175.02 174.67 1fug s PRO 135 N -3.25 3.34 0.00 4.11 0.04 -1.26 -3.52 135.00 134.47 1fug s PRO 135 Ca 0.65 -1.40 0.00 0.00 0.04 0.00 0.00 61.00 60.28 1fug s PRO 135 Cb -0.13 -5.37 0.00 0.00 0.04 0.00 0.00 34.50 29.04 1fug s PRO 135 CO 0.17 -2.84 0.03 0.00 0.04 0.00 0.00 177.00 174.40 1fug n ALA 136 N 10.76 1.33 0.16 8.56 0.00 -1.26 -2.82 120.51 137.23 1fug n ALA 136 Ca 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.74 1fug n ALA 136 Cb 0.47 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.84 1fug n ALA 136 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1fug h PRO 137 N 0.40 -0.32 -0.49 0.00 0.13 -1.99 0.23 132.00 129.96 1fug h PRO 137 Ca 0.00 0.02 0.06 0.00 -0.87 0.00 0.00 66.00 65.21 1fug h PRO 137 Cb 0.01 0.07 -0.03 0.00 0.13 0.00 0.00 31.00 31.18 1fug h PRO 137 CO 0.00 -0.19 0.33 0.97 -0.23 0.00 0.00 178.00 178.88 1fug h ILE 138 N -0.36 0.98 0.39 -3.56 2.10 -1.85 -0.04 117.51 115.17 1fug h ILE 138 Ca -0.03 -0.15 -0.02 0.00 1.08 0.00 0.00 64.86 65.74 1fug h ILE 138 Cb 0.27 0.50 0.00 0.00 -1.09 0.00 0.00 36.82 36.51 1fug h ILE 138 CO 0.06 0.08 -0.19 0.74 -1.08 0.00 0.00 178.15 177.76 1fug h THR 139 N 0.44 0.08 0.00 2.19 2.02 -1.74 0.29 112.91 116.20 1fug h THR 139 Ca 0.21 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 1fug h THR 139 Cb 0.28 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1fug h THR 139 CO -0.05 0.02 -0.02 1.88 0.37 0.00 0.00 175.52 177.71 1fug h TYR 140 N -1.12 0.00 0.32 3.16 0.05 -0.17 0.39 116.97 119.60 1fug h TYR 140 Ca -0.05 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 1fug h TYR 140 Cb 0.43 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.14 1fug h TYR 140 CO 0.01 0.02 -0.52 0.00 -1.05 0.00 0.00 178.16 176.62 1fug h ALA 141 N 1.98 -1.08 -0.64 3.88 0.00 -1.02 -1.99 119.26 120.38 1fug h ALA 141 Ca -0.00 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1fug h ALA 141 Cb 0.05 0.82 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1fug h ALA 141 CO 0.00 -1.16 0.39 0.45 0.00 0.00 0.00 179.25 178.93 1fug h HIS 142 N -0.89 0.73 -0.18 0.00 -0.00 0.15 -2.57 115.15 112.39 1fug h HIS 142 Ca -0.04 0.02 -0.19 0.00 -0.00 0.00 0.00 60.37 60.16 1fug h HIS 142 Cb 0.82 -0.24 0.01 0.00 -0.00 0.00 0.00 27.41 28.00 1fug h HIS 142 CO -0.35 0.41 -0.64 0.00 -0.00 0.00 0.00 177.93 177.35 1fug h ARG 143 N 0.76 0.76 0.04 2.45 2.47 -0.33 0.82 114.38 121.36 1fug h ARG 143 Ca 0.26 -0.57 0.02 0.00 -1.26 0.00 0.00 59.98 58.44 1fug h ARG 143 Cb 0.05 0.10 -0.04 0.00 -1.65 0.00 0.00 29.97 28.43 1fug h ARG 143 CO -0.12 1.19 -0.23 1.25 0.56 0.00 0.00 179.97 182.62 1fug h LEU 144 N 0.48 -0.65 -4.43 3.04 5.85 -1.22 0.72 115.31 119.09 1fug h LEU 144 Ca -0.03 0.09 -0.71 0.00 0.84 0.00 0.00 57.88 58.06 1fug h LEU 144 Cb 1.26 0.26 -0.28 0.00 0.37 0.00 0.00 40.66 42.28 1fug h LEU 144 CO 0.13 -0.30 0.95 1.33 -0.34 0.00 0.00 178.44 180.22 1fug n VAL 145 N -5.35 3.61 -0.08 1.05 0.24 -0.98 -2.22 118.33 114.59 1fug n VAL 145 Ca -0.05 -3.51 -0.17 0.00 -2.04 0.00 0.00 64.34 58.56 1fug n VAL 145 Cb 0.26 -1.20 -0.13 0.00 -1.47 0.00 0.00 33.84 31.30 1fug n VAL 145 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 1fug n GLN 146 N -0.73 0.68 -0.03 7.34 0.00 0.26 -4.53 117.38 120.38 1fug n GLN 146 Ca 0.59 0.16 0.04 0.00 -0.00 0.00 0.00 57.00 57.79 1fug n GLN 146 Cb 0.47 -1.58 0.41 0.00 0.00 0.00 0.00 30.24 29.53 1fug n GLN 146 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 1fug h ARG 147 N 0.02 0.59 -0.88 3.69 2.43 -1.13 -2.67 114.38 116.42 1fug h ARG 147 Ca -0.52 -0.04 0.23 0.00 -0.81 0.00 0.00 59.98 58.85 1fug h ARG 147 Cb 2.00 -0.13 -0.15 0.00 -0.42 0.00 0.00 29.97 31.26 1fug h ARG 147 CO -0.02 0.39 0.12 0.37 -1.51 0.00 0.00 179.97 179.32 1fug h GLN 148 N 0.61 0.11 -0.26 0.20 5.75 -1.80 0.12 115.11 119.84 1fug h GLN 148 Ca 0.17 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.66 1fug h GLN 148 Cb -0.04 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 1fug h GLN 148 CO -0.04 0.07 0.14 0.00 -2.65 0.00 0.00 178.83 176.35 1fug h ALA 149 N 1.83 0.34 -0.89 3.38 0.00 -1.77 -2.82 119.26 119.32 1fug h ALA 149 Ca 0.54 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.49 1fug h ALA 149 Cb 1.08 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.68 1fug h ALA 149 CO -0.74 -0.12 0.52 1.49 0.00 0.00 0.00 179.25 180.40 1fug h GLU 150 N 0.30 0.78 0.11 0.00 4.81 -0.83 -0.39 114.58 119.36 1fug h GLU 150 Ca 0.09 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1fug h GLU 150 Cb 0.09 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.30 1fug h GLU 150 CO -0.01 0.52 -0.05 0.28 -0.73 0.00 0.00 179.01 179.01 1fug h VAL 151 N 0.81 1.01 -0.40 0.32 2.07 -1.13 -1.07 116.25 117.85 1fug h VAL 151 Ca 0.45 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 67.59 1fug h VAL 151 Cb 0.50 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1fug h VAL 151 CO -0.29 0.10 0.16 0.08 0.02 0.00 0.00 177.57 177.64 1fug h ARG 152 N -0.34 0.33 0.00 1.57 0.11 -0.82 0.21 114.38 115.44 1fug h ARG 152 Ca -0.01 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 60.03 1fug h ARG 152 Cb 0.28 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 31.28 1fug h ARG 152 CO 0.02 0.22 -0.06 0.87 0.10 0.00 0.00 179.97 181.12 1fug h LYS 153 N 0.34 0.00 -0.01 0.08 1.57 -1.53 -3.20 116.57 113.81 1fug h LYS 153 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1fug h LYS 153 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1fug h LYS 153 CO -0.17 0.06 -0.08 0.27 -0.57 0.00 0.00 179.45 178.96 1fug n ASN 154 N -3.12 1.52 0.00 0.86 0.23 0.53 -4.95 115.26 110.33 1fug n ASN 154 Ca 0.03 -1.38 0.00 0.00 -0.53 0.00 0.00 54.58 52.70 1fug n ASN 154 Cb 0.51 0.05 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 1fug n ASN 154 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1fug n GLY 155 N 1.24 3.24 0.16 4.83 0.00 0.03 -4.92 105.19 109.77 1fug n GLY 155 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 1fug n GLY 155 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1fug h THR 156 N 0.00 0.15 -3.58 2.61 1.35 -1.86 -3.36 112.91 108.22 1fug h THR 156 Ca 0.00 -0.86 -0.63 0.00 -0.55 0.00 0.00 66.41 64.37 1fug h THR 156 Cb 0.00 0.26 -0.17 0.00 -1.73 0.00 0.00 68.15 66.51 1fug h THR 156 CO 0.00 0.04 -0.55 -0.22 -0.25 0.00 0.00 175.52 174.54 1fug s LEU 157 N -8.88 3.84 -0.01 3.87 2.96 -1.26 -4.98 118.68 114.22 1fug s LEU 157 Ca -0.06 -0.00 0.15 0.00 -0.22 0.00 0.00 54.13 53.99 1fug s LEU 157 Cb 0.00 -2.02 -0.20 0.00 0.50 0.00 0.00 46.19 44.47 1fug s LEU 157 CO 0.19 0.05 0.42 -0.81 -1.32 0.00 0.00 176.35 174.88 1fug n PRO 158 N 4.38 1.06 -0.32 0.98 -0.04 -1.26 -4.38 135.00 135.42 1fug n PRO 158 Ca -0.16 -0.09 0.11 0.00 -0.04 0.00 0.00 63.50 63.33 1fug n PRO 158 Cb 0.52 -1.29 0.29 0.00 -0.04 0.00 0.00 33.50 32.98 1fug n PRO 158 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1fug n TRP 159 N -1.79 0.84 -2.85 0.54 -0.00 -1.26 -4.87 117.44 108.06 1fug n TRP 159 Ca -0.01 -0.42 -0.42 0.00 -0.00 0.00 0.00 57.50 56.66 1fug n TRP 159 Cb 0.33 0.00 -0.04 0.00 -0.00 0.00 0.00 31.31 31.60 1fug n TRP 159 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 177.69 177.21 1fug s LEU 160 N -1.07 4.21 0.96 5.67 0.05 -1.26 -0.06 118.68 127.17 1fug s LEU 160 Ca 0.44 1.28 -0.16 0.00 0.05 0.00 0.00 54.13 55.74 1fug s LEU 160 Cb 0.23 -3.31 0.19 0.00 -2.05 0.00 0.00 46.19 41.25 1fug s LEU 160 CO 0.31 -0.39 1.30 -0.13 -0.55 0.00 0.00 176.35 176.89 1fug s ARG 161 N 1.99 0.68 0.25 1.48 1.81 -0.19 -4.93 118.95 120.05 1fug s ARG 161 Ca 0.41 -0.33 0.09 0.00 -1.72 0.00 0.00 55.73 54.18 1fug s ARG 161 Cb -0.17 -1.84 0.29 0.00 -0.45 0.00 0.00 34.95 32.77 1fug s ARG 161 CO 0.14 -2.40 1.57 -1.35 -0.68 0.00 0.00 175.30 172.59 1fug h PRO 162 N -1.63 0.04 -6.83 3.54 0.11 -1.83 -3.42 132.00 121.97 1fug h PRO 162 Ca -0.45 -0.03 -0.53 0.00 0.11 0.00 0.00 66.00 65.10 1fug h PRO 162 Cb 1.25 0.01 0.07 0.00 0.11 0.00 0.00 31.00 32.43 1fug h PRO 162 CO 0.41 0.68 0.73 -0.51 -0.21 0.00 0.00 178.00 179.10 1fug s ASP 163 N -6.85 6.62 -0.16 -2.05 1.11 -1.26 -3.49 116.67 110.60 1fug s ASP 163 Ca -0.02 2.76 -0.04 0.00 0.18 0.00 0.00 52.55 55.43 1fug s ASP 163 Cb 0.12 -2.64 0.08 0.00 1.07 0.00 0.00 42.92 41.55 1fug s ASP 163 CO 0.77 -0.69 0.24 0.00 1.18 0.00 0.00 175.17 176.67 1fug s ALA 164 N -0.58 -0.41 0.45 5.23 0.00 -1.24 -2.89 121.76 122.31 1fug s ALA 164 Ca 0.55 0.62 0.06 0.00 0.00 0.00 0.00 51.96 53.18 1fug s ALA 164 Cb -0.42 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 21.58 1fug s ALA 164 CO 0.50 -0.87 0.63 0.21 0.00 0.00 0.00 175.76 176.23 1fug s LYS 165 N 2.37 2.78 -0.05 0.00 2.20 0.94 -0.29 119.74 127.69 1fug s LYS 165 Ca 0.04 -1.05 -0.29 0.00 -0.36 0.00 0.00 55.97 54.31 1fug s LYS 165 Cb -0.14 -2.68 0.10 0.00 -1.51 0.00 0.00 37.83 33.61 1fug s LYS 165 CO -0.10 -0.37 0.86 -1.54 -0.36 0.00 0.00 175.35 173.84 1fug s SER 166 N -4.35 -0.44 -0.02 1.43 1.04 -0.52 -1.56 113.70 109.28 1fug s SER 166 Ca 0.55 0.26 0.00 0.00 0.48 0.00 0.00 55.95 57.24 1fug s SER 166 Cb -0.10 0.40 0.03 0.00 0.10 0.00 0.00 66.02 66.45 1fug s SER 166 CO 0.35 -0.56 0.03 -1.10 0.98 0.00 0.00 173.24 172.94 1fug s GLN 167 N -2.15 -0.02 -0.00 4.02 -0.21 -1.17 -1.09 119.66 119.03 1fug s GLN 167 Ca -0.01 0.18 -0.07 0.00 0.02 0.00 0.00 55.36 55.48 1fug s GLN 167 Cb -0.01 -0.25 -0.05 0.00 1.00 0.00 0.00 33.01 33.70 1fug s GLN 167 CO -0.02 -0.16 0.27 0.54 -2.12 0.00 0.00 175.29 173.79 1fug s VAL 168 N 1.03 5.30 -0.32 1.09 0.11 -0.86 -1.57 120.40 125.19 1fug s VAL 168 Ca -0.09 0.23 0.01 0.00 -2.93 0.00 0.00 61.98 59.20 1fug s VAL 168 Cb -0.13 -3.56 0.10 0.00 -1.53 0.00 0.00 36.38 31.26 1fug s VAL 168 CO -0.03 0.41 0.08 -0.89 -3.33 0.00 0.00 175.10 171.34 1fug s THR 169 N -1.26 1.37 0.24 5.04 2.01 0.60 -2.63 115.64 121.00 1fug s THR 169 Ca 0.26 -1.72 -0.13 0.00 0.31 0.00 0.00 61.69 60.41 1fug s THR 169 Cb -0.13 -2.02 -0.08 0.00 0.01 0.00 0.00 72.50 70.28 1fug s THR 169 CO 0.15 -0.64 0.61 -0.36 -0.69 0.00 0.00 174.62 173.69 1fug s PHE 170 N 1.37 3.47 0.09 4.92 0.40 -1.26 -1.02 117.98 125.95 1fug s PHE 170 Ca 0.10 1.05 0.01 0.00 -0.60 0.00 0.00 56.93 57.49 1fug s PHE 170 Cb -0.18 -2.39 -0.04 0.00 0.51 0.00 0.00 43.02 40.92 1fug s PHE 170 CO -0.19 0.26 0.23 1.14 0.70 0.00 0.00 175.22 177.36 1fug s GLN 171 N -2.59 3.41 -0.01 0.44 -2.07 -0.93 -1.25 119.66 116.66 1fug s GLN 171 Ca 0.47 -0.51 0.03 0.00 -1.82 0.00 0.00 55.36 53.53 1fug s GLN 171 Cb -0.12 -3.00 -0.01 0.00 -1.09 0.00 0.00 33.01 28.79 1fug s GLN 171 CO 0.20 0.58 -0.09 0.71 -1.32 0.00 0.00 175.29 175.36 1fug s TYR 172 N -1.58 0.82 0.36 9.60 2.02 0.26 -2.76 117.35 126.07 1fug s TYR 172 Ca 0.35 -0.16 0.08 0.00 -0.37 0.00 0.00 57.07 56.97 1fug s TYR 172 Cb -0.12 -0.53 -0.05 0.00 -0.40 0.00 0.00 41.96 40.86 1fug s TYR 172 CO 0.28 -0.01 0.12 0.34 -1.57 0.00 0.00 175.55 174.70 1fug s ASP 173 N -0.24 4.46 0.00 2.29 -1.08 -1.26 -0.15 116.67 120.68 1fug s ASP 173 Ca 0.03 -0.93 0.00 0.00 -0.52 0.00 0.00 52.55 51.13 1fug s ASP 173 Cb -0.04 -0.59 0.00 0.00 -1.46 0.00 0.00 42.92 40.83 1fug s ASP 173 CO -0.00 -0.36 0.67 0.47 0.52 0.00 0.00 175.17 176.47 1fug n ASP 174 N -1.13 0.00 0.00 -0.34 8.00 -1.26 -4.13 116.55 117.69 1fug n ASP 174 Ca -0.03 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1fug n ASP 174 Cb 0.63 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1fug n ASP 174 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fug n GLY 175 N -1.17 1.17 0.00 0.44 0.00 -1.26 -5.10 105.19 99.27 1fug n GLY 175 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1fug n GLY 175 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fug n LYS 176 N 0.00 0.00 -3.23 1.61 5.02 -1.26 -5.02 118.16 115.27 1fug n LYS 176 Ca 0.00 0.24 -0.02 0.00 -2.02 0.00 0.00 58.31 56.50 1fug n LYS 176 Cb 0.00 -0.69 -0.04 0.00 -0.02 0.00 0.00 35.03 34.28 1fug n LYS 176 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1fug s ILE 177 N -0.75 -0.81 -0.05 -0.18 -5.25 -1.26 -4.78 121.20 108.12 1fug s ILE 177 Ca 0.00 -0.11 -0.03 0.00 -0.99 0.00 0.00 60.65 59.52 1fug s ILE 177 Cb 0.00 -0.96 -0.01 0.00 2.95 0.00 0.00 42.46 44.43 1fug s ILE 177 CO 0.00 -0.11 -0.07 0.55 -1.79 0.00 0.00 174.94 173.52 1fug n VAL 178 N 5.39 0.51 -3.45 8.37 3.14 -1.14 -4.91 118.33 126.24 1fug n VAL 178 Ca 0.01 0.40 -0.11 0.00 -2.96 0.00 0.00 64.34 61.68 1fug n VAL 178 Cb 0.51 -1.82 -0.02 0.00 -1.06 0.00 0.00 33.84 31.45 1fug n VAL 178 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1fug s GLY 179 N -3.14 -0.56 0.14 7.55 0.00 -1.11 -4.97 107.32 105.22 1fug s GLY 179 Ca -0.05 0.71 -0.18 0.00 0.00 0.00 0.00 44.72 45.20 1fug s GLY 179 CO 0.08 0.25 0.61 -0.42 0.00 0.00 0.00 173.10 173.62 1fug s ILE 180 N -3.43 4.72 -0.25 0.90 -1.09 -1.22 -2.19 121.20 118.63 1fug s ILE 180 Ca 0.02 1.12 -0.02 0.00 -2.23 0.00 0.00 60.65 59.54 1fug s ILE 180 Cb -0.01 -3.84 -0.17 0.00 -1.58 0.00 0.00 42.46 36.86 1fug s ILE 180 CO -0.11 0.36 -0.20 -0.67 -1.23 0.00 0.00 174.94 173.09 1fug n ASP 181 N 1.15 1.99 -3.62 3.58 -0.08 -0.19 -4.41 116.55 114.97 1fug n ASP 181 Ca -0.06 -0.02 -0.13 0.00 -1.51 0.00 0.00 54.79 53.06 1fug n ASP 181 Cb 0.51 -0.53 -0.06 0.00 2.34 0.00 0.00 41.12 43.39 1fug n ASP 181 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1fug s ALA 182 N -2.52 -1.16 -0.20 -1.67 0.00 -0.64 -0.16 121.76 115.41 1fug s ALA 182 Ca -0.35 0.45 -0.17 0.00 0.00 0.00 0.00 51.96 51.89 1fug s ALA 182 Cb 0.10 0.37 0.05 0.00 0.00 0.00 0.00 23.12 23.64 1fug s ALA 182 CO 0.59 -0.48 0.51 0.54 0.00 0.00 0.00 175.76 176.93 1fug s VAL 183 N -2.47 -0.00 0.01 0.00 0.11 0.09 -0.29 120.40 117.85 1fug s VAL 183 Ca -0.05 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1fug s VAL 183 Cb -0.01 -0.72 -0.01 0.00 -1.53 0.00 0.00 36.38 34.11 1fug s VAL 183 CO -0.02 0.00 -0.07 0.54 -3.33 0.00 0.00 175.10 172.22 1fug s VAL 184 N 0.49 0.57 -0.09 2.04 0.11 -0.61 -0.92 120.40 122.00 1fug s VAL 184 Ca -0.02 -0.57 0.04 0.00 -2.93 0.00 0.00 61.98 58.50 1fug s VAL 184 Cb -0.04 -0.53 0.00 0.00 -1.53 0.00 0.00 36.38 34.28 1fug s VAL 184 CO -0.02 -0.02 -0.22 -0.22 -3.33 0.00 0.00 175.10 171.29 1fug s LEU 185 N -0.65 2.00 -0.34 2.54 2.96 -0.39 -3.05 118.68 121.76 1fug s LEU 185 Ca -0.01 -0.51 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 1fug s LEU 185 Cb -0.05 -1.29 0.08 0.00 0.50 0.00 0.00 46.19 45.42 1fug s LEU 185 CO 0.00 0.14 0.06 -0.44 -1.32 0.00 0.00 176.35 174.79 1fug s SER 186 N 0.38 4.96 0.14 3.68 0.01 -0.60 -0.90 113.70 121.37 1fug s SER 186 Ca -0.18 -1.65 0.02 0.00 1.31 0.00 0.00 55.95 55.46 1fug s SER 186 Cb -0.17 -1.72 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 1fug s SER 186 CO 0.08 -0.36 0.28 -0.89 0.41 0.00 0.00 173.24 172.75 1fug s THR 187 N 1.16 5.32 -0.37 1.44 2.01 -1.26 -0.04 115.64 123.89 1fug s THR 187 Ca 0.01 -0.67 -0.15 0.00 0.31 0.00 0.00 61.69 61.19 1fug s THR 187 Cb -0.21 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.58 1fug s THR 187 CO -0.03 -0.07 0.36 -1.58 -0.69 0.00 0.00 174.62 172.60 1fug s GLN 188 N -3.18 3.35 0.54 4.92 0.74 -1.14 -4.65 119.66 120.23 1fug s GLN 188 Ca 0.35 -0.62 -0.03 0.00 0.05 0.00 0.00 55.36 55.10 1fug s GLN 188 Cb -0.11 -3.87 0.01 0.00 1.10 0.00 0.00 33.01 30.13 1fug s GLN 188 CO 0.28 -0.63 0.80 -3.38 -0.55 0.00 0.00 175.29 171.81 1fug s HIS 189 N 1.96 3.19 0.95 1.67 -3.43 0.12 -1.02 115.29 118.73 1fug s HIS 189 Ca 0.10 0.40 -0.12 0.00 -0.80 0.00 0.00 55.06 54.65 1fug s HIS 189 Cb -0.17 -2.59 0.10 0.00 -1.43 0.00 0.00 32.58 28.49 1fug s HIS 189 CO 0.12 -0.67 0.77 0.45 -2.00 0.00 0.00 174.74 173.41 1fug n SER 190 N -2.37 -0.93 0.20 7.38 2.88 0.92 -4.36 113.62 117.33 1fug n SER 190 Ca 0.04 0.35 0.05 0.00 -1.33 0.00 0.00 58.87 57.97 1fug n SER 190 Cb 0.58 -1.33 0.40 0.00 -0.75 0.00 0.00 64.21 63.11 1fug n SER 190 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1fug h GLU 191 N -1.77 0.00 0.05 -1.46 3.07 -1.96 -3.21 114.58 109.30 1fug h GLU 191 Ca -0.44 0.00 -0.25 0.00 -0.50 0.00 0.00 59.36 58.17 1fug h GLU 191 Cb 1.28 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.17 1fug h GLU 191 CO 0.38 0.34 -1.19 1.05 -1.40 0.00 0.00 179.01 178.19 1fug h GLU 192 N 0.00 0.11 -6.11 2.33 -0.00 -1.96 -3.46 114.58 105.49 1fug h GLU 192 Ca -0.00 -0.19 -0.56 0.00 -0.00 0.00 0.00 59.36 58.60 1fug h GLU 192 Cb 0.67 0.07 -0.05 0.00 -0.00 0.00 0.00 28.75 29.45 1fug h GLU 192 CO 0.04 1.04 0.37 -1.50 -0.00 0.00 0.00 179.01 178.97 1fug s ILE 193 N -2.67 4.89 0.39 -1.06 1.10 -1.22 -5.02 121.20 117.61 1fug s ILE 193 Ca -0.02 1.76 -0.27 0.00 -0.51 0.00 0.00 60.65 61.61 1fug s ILE 193 Cb 0.09 -4.19 -0.10 0.00 0.15 0.00 0.00 42.46 38.41 1fug s ILE 193 CO 0.84 0.09 1.43 -0.62 -2.11 0.00 0.00 174.94 174.57 1fug s ASP 194 N 1.05 6.29 0.14 4.50 2.15 -1.26 -4.79 116.67 124.74 1fug s ASP 194 Ca 0.43 2.92 -0.24 0.00 0.43 0.00 0.00 52.55 56.09 1fug s ASP 194 Cb -0.18 -2.66 -0.01 0.00 -0.30 0.00 0.00 42.92 39.77 1fug s ASP 194 CO 0.17 -0.89 1.63 1.56 -0.17 0.00 0.00 175.17 177.47 1fug h GLN 195 N 2.86 -0.30 -0.79 4.34 1.08 -1.95 0.12 115.11 120.46 1fug h GLN 195 Ca -0.50 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 56.76 1fug h GLN 195 Cb 1.24 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.70 1fug h GLN 195 CO 0.63 -0.20 0.52 -0.22 -0.95 0.00 0.00 178.83 178.61 1fug h LYS 196 N -0.31 0.90 -0.09 1.46 1.63 -2.01 -2.97 116.57 115.17 1fug h LYS 196 Ca 0.10 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1fug h LYS 196 Cb 0.46 -0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.88 1fug h LYS 196 CO -0.31 0.59 0.05 1.03 -3.45 0.00 0.00 179.45 177.37 1fug h SER 197 N 0.93 0.11 -0.64 4.20 0.87 -1.20 -2.66 113.55 115.16 1fug h SER 197 Ca 0.32 -0.09 0.05 0.00 -1.23 0.00 0.00 61.79 60.85 1fug h SER 197 Cb 0.12 -0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 1fug h SER 197 CO -0.10 0.17 0.36 0.17 -0.53 0.00 0.00 176.83 176.90 1fug h LEU 198 N 0.05 0.56 -0.40 2.23 8.10 -1.09 -2.93 115.31 121.81 1fug h LEU 198 Ca 0.03 0.02 0.08 0.00 0.11 0.00 0.00 57.88 58.13 1fug h LEU 198 Cb 0.08 -0.09 -0.08 0.00 -0.44 0.00 0.00 40.66 40.13 1fug h LEU 198 CO -0.00 0.37 -0.11 1.56 -4.11 0.00 0.00 178.44 176.14 1fug h GLN 199 N 0.69 -0.01 0.15 0.17 4.20 -1.31 -1.50 115.11 117.49 1fug h GLN 199 Ca 0.28 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.98 1fug h GLN 199 Cb 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1fug h GLN 199 CO -0.16 -0.01 -0.07 0.93 -0.67 0.00 0.00 178.83 178.85 1fug h GLU 200 N -0.01 -0.19 0.00 1.46 4.39 -1.49 0.16 114.58 118.90 1fug h GLU 200 Ca 0.19 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 1fug h GLU 200 Cb 0.31 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1fug h GLU 200 CO -0.42 0.20 -0.03 0.00 -1.16 0.00 0.00 179.01 177.60 1fug h ALA 201 N 0.07 1.03 0.91 3.43 0.00 -1.52 1.05 119.26 124.24 1fug h ALA 201 Ca -0.02 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1fug h ALA 201 Cb 0.49 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1fug h ALA 201 CO 0.03 0.03 -0.44 0.28 0.00 0.00 0.00 179.25 179.16 1fug h VAL 202 N 0.00 0.00 0.16 0.00 2.07 -0.90 -3.06 116.25 114.52 1fug h VAL 202 Ca -0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1fug h VAL 202 Cb 0.35 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 1fug h VAL 202 CO 0.00 0.00 -0.40 -0.03 0.02 0.00 0.00 177.57 177.16 1fug h MET 203 N -1.28 -0.60 -0.36 1.57 -1.53 0.41 0.29 114.93 113.42 1fug h MET 203 Ca -0.13 0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.18 1fug h MET 203 Cb 0.94 0.14 0.00 0.00 -0.55 0.00 0.00 31.60 32.12 1fug h MET 203 CO 0.21 -0.40 0.00 0.39 0.14 0.00 0.00 176.91 177.25 1fug n GLU 204 N -4.74 0.80 0.00 0.39 4.71 -0.21 -3.16 120.64 118.43 1fug n GLU 204 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.08 1fug n GLU 204 Cb 0.32 -1.18 0.00 0.00 -1.01 0.00 0.00 31.44 29.57 1fug n GLU 204 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1fug n GLU 205 N -0.23 0.00 0.11 3.49 2.13 -0.22 -4.96 120.64 120.96 1fug n GLU 205 Ca 0.00 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.77 1fug n GLU 205 Cb 0.09 -0.01 -0.02 0.00 0.27 0.00 0.00 31.44 31.76 1fug n GLU 205 CO 0.00 0.00 0.00 0.97 -0.41 0.00 0.00 177.13 177.69 1fug h ILE 206 N 0.00 0.00 0.78 6.31 2.10 -0.60 -3.42 117.51 122.68 1fug h ILE 206 Ca 0.00 -0.23 -0.04 0.00 1.08 0.00 0.00 64.86 65.68 1fug h ILE 206 Cb 0.00 0.00 0.01 0.00 -1.09 0.00 0.00 36.82 35.74 1fug h ILE 206 CO 0.00 0.00 -0.37 -0.29 -1.08 0.00 0.00 178.15 176.41 1fug h ILE 207 N -0.53 0.00 0.03 2.19 6.09 -1.62 -3.34 117.51 120.32 1fug h ILE 207 Ca -0.03 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 63.24 1fug h ILE 207 Cb 0.24 0.00 -0.00 0.00 0.47 0.00 0.00 36.82 37.52 1fug h ILE 207 CO 0.05 0.00 -0.06 0.11 -3.07 0.00 0.00 178.15 175.18 1fug h LYS 208 N -1.26 -0.10 -0.35 2.19 1.79 -1.82 -2.08 116.57 114.93 1fug h LYS 208 Ca -0.11 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1fug h LYS 208 Cb 0.80 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.48 1fug h LYS 208 CO 0.18 -0.07 0.00 -0.35 -1.08 0.00 0.00 179.45 178.13 1fug n PRO 209 N -2.76 0.86 -0.01 3.15 -0.04 -1.26 -0.44 135.00 134.50 1fug n PRO 209 Ca -0.01 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.44 1fug n PRO 209 Cb 0.05 -1.18 -0.00 0.00 -0.04 0.00 0.00 33.50 32.33 1fug n PRO 209 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1fug n ILE 210 N -0.27 0.16 -1.96 0.52 2.08 -1.10 -5.02 119.36 113.77 1fug n ILE 210 Ca 0.00 0.47 -0.43 0.00 0.56 0.00 0.00 62.75 63.35 1fug n ILE 210 Cb 0.09 -1.59 -0.03 0.00 -0.75 0.00 0.00 39.64 37.36 1fug n ILE 210 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1fug s LEU 211 N -5.13 3.50 -0.28 1.39 1.98 0.41 -4.78 118.68 115.78 1fug s LEU 211 Ca -0.02 1.36 -0.28 0.00 -2.89 0.00 0.00 54.13 52.30 1fug s LEU 211 Cb 0.00 -3.50 -0.05 0.00 0.66 0.00 0.00 46.19 43.30 1fug s LEU 211 CO 0.04 -1.74 2.23 -2.84 -1.89 0.00 0.00 176.35 172.15 1fug s PRO 212 N 5.74 2.95 0.64 0.98 0.02 -1.26 -4.73 135.00 139.34 1fug s PRO 212 Ca 0.82 1.88 0.30 0.00 0.02 0.00 0.00 61.00 64.02 1fug s PRO 212 Cb -0.23 -4.40 1.61 0.00 0.02 0.00 0.00 34.50 31.49 1fug s PRO 212 CO 0.34 -2.32 1.93 0.00 -0.33 0.00 0.00 177.00 176.62 1fug h ALA 213 N 15.80 1.57 -0.97 -1.55 0.00 -1.86 -2.89 119.26 129.35 1fug h ALA 213 Ca -0.38 -0.00 0.17 0.00 0.00 0.00 0.00 54.91 54.70 1fug h ALA 213 Cb 1.24 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1fug h ALA 213 CO 1.00 -0.42 0.58 1.05 0.00 0.00 0.00 179.25 181.47 1fug h GLU 214 N 0.00 0.77 -1.81 0.00 4.11 -2.01 -2.94 114.58 112.70 1fug h GLU 214 Ca 0.06 -0.05 -0.20 0.00 0.07 0.00 0.00 59.36 59.24 1fug h GLU 214 Cb 0.77 -0.17 -0.08 0.00 0.50 0.00 0.00 28.75 29.76 1fug h GLU 214 CO -0.00 0.51 0.16 0.91 0.07 0.00 0.00 179.01 180.66 1fug n TRP 215 N -4.75 0.77 -3.39 2.06 8.01 -1.09 -4.86 117.44 114.18 1fug n TRP 215 Ca 0.21 -1.53 -0.45 0.00 -1.31 0.00 0.00 57.50 54.42 1fug n TRP 215 Cb 0.50 -0.88 -0.04 0.00 -2.01 0.00 0.00 31.31 28.87 1fug n TRP 215 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 1fug s LEU 216 N -0.93 6.31 0.52 -0.99 2.96 -1.11 -3.43 118.68 122.01 1fug s LEU 216 Ca 0.25 -2.36 -0.20 0.00 -0.22 0.00 0.00 54.13 51.60 1fug s LEU 216 Cb 0.17 -2.15 -0.06 0.00 0.50 0.00 0.00 46.19 44.65 1fug s LEU 216 CO -0.02 -0.65 1.14 0.42 -1.32 0.00 0.00 176.35 175.92 1fug s THR 217 N 0.69 3.15 -1.87 3.68 -4.23 -1.26 -4.90 115.64 110.90 1fug s THR 217 Ca 0.12 0.75 0.00 0.00 -1.18 0.00 0.00 61.69 61.38 1fug s THR 217 Cb -0.19 -3.32 0.00 0.00 1.34 0.00 0.00 72.50 70.33 1fug s THR 217 CO -0.04 -0.12 0.27 -1.20 -0.54 0.00 0.00 174.62 172.99 1fug n SER 218 N -1.10 0.00 -0.26 3.99 7.64 -1.26 -1.92 113.62 120.71 1fug n SER 218 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.99 1fug n SER 218 Cb 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1fug n SER 218 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fug n ALA 219 N -0.76 1.54 -1.76 -0.43 0.00 -1.26 -5.03 120.51 112.81 1fug n ALA 219 Ca 0.00 -0.78 -0.37 0.00 0.00 0.00 0.00 53.44 52.29 1fug n ALA 219 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 19.45 19.15 1fug n ALA 219 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fug s THR 220 N -0.02 3.15 -0.02 0.00 2.01 -0.81 -4.81 115.64 115.15 1fug s THR 220 Ca 0.00 0.09 -0.33 0.00 0.31 0.00 0.00 61.69 61.76 1fug s THR 220 Cb 0.00 -3.40 -0.11 0.00 0.01 0.00 0.00 72.50 69.01 1fug s THR 220 CO 0.00 -0.38 1.90 0.29 -0.69 0.00 0.00 174.62 175.73 1fug n LYS 221 N 9.08 2.46 -3.24 4.92 5.02 0.78 -4.85 118.16 132.32 1fug n LYS 221 Ca 0.30 0.90 -0.36 0.00 -2.02 0.00 0.00 58.31 57.13 1fug n LYS 221 Cb 0.54 -2.79 -0.03 0.00 -0.02 0.00 0.00 35.03 32.73 1fug n LYS 221 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1fug n PHE 222 N 6.71 3.08 -2.50 2.13 3.01 -1.26 -0.73 117.46 127.90 1fug n PHE 222 Ca 0.21 -3.39 -0.40 0.00 1.01 0.00 0.00 57.45 54.88 1fug n PHE 222 Cb 0.34 -0.99 -0.02 0.00 -0.01 0.00 0.00 39.48 38.80 1fug n PHE 222 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1fug s PHE 223 N -2.49 2.53 -0.93 1.38 0.08 -0.10 -4.89 117.98 113.57 1fug s PHE 223 Ca 0.34 -0.93 -0.24 0.00 0.12 0.00 0.00 56.93 56.22 1fug s PHE 223 Cb 0.07 -4.63 0.02 0.00 -0.57 0.00 0.00 43.02 37.91 1fug s PHE 223 CO 0.03 -1.84 1.57 0.42 -0.10 0.00 0.00 175.22 175.30 1fug s ILE 224 N 5.47 3.74 -0.60 0.64 -1.09 -1.26 -1.26 121.20 126.85 1fug s ILE 224 Ca 0.52 -0.44 -0.18 0.00 -2.23 0.00 0.00 60.65 58.32 1fug s ILE 224 Cb 0.01 -4.72 0.03 0.00 -1.58 0.00 0.00 42.46 36.19 1fug s ILE 224 CO -0.02 -1.63 0.64 -0.46 -1.23 0.00 0.00 174.94 172.25 1fug n ASN 225 N 10.40 -6.11 -3.32 3.58 0.23 -0.08 -4.79 115.26 115.18 1fug n ASN 225 Ca 0.30 -0.25 -0.29 0.00 -0.53 0.00 0.00 54.58 53.80 1fug n ASN 225 Cb 0.50 -2.89 -0.03 0.00 -2.08 0.00 0.00 39.78 35.28 1fug n ASN 225 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1fug n PRO 226 N -1.14 2.11 0.00 -0.53 -0.04 -1.26 0.00 135.00 134.15 1fug n PRO 226 Ca -0.10 -1.66 0.00 0.00 -0.04 0.00 0.00 63.50 61.69 1fug n PRO 226 Cb 0.62 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 1fug n PRO 226 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1fug n THR 227 N 4.62 0.00 0.00 0.52 -2.24 -1.26 -5.07 114.28 110.85 1fug n THR 227 Ca 0.49 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.27 1fug n THR 227 Cb 0.22 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 1fug n THR 227 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fug n GLY 228 N -1.02 1.22 0.99 3.38 0.00 0.10 -4.43 105.19 105.43 1fug n GLY 228 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1fug n GLY 228 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1fug n ARG 229 N 0.00 0.69 -1.95 1.61 3.00 -1.26 -4.75 116.66 114.00 1fug n ARG 229 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.42 1fug n ARG 229 Cb 0.00 -1.16 -0.03 0.00 0.00 0.00 0.00 32.46 31.27 1fug n ARG 229 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1fug s PHE 230 N 0.28 1.82 0.08 -0.14 0.08 -1.26 -4.56 117.98 114.27 1fug s PHE 230 Ca 0.00 0.27 0.00 0.00 0.12 0.00 0.00 56.93 57.32 1fug s PHE 230 Cb 0.00 -4.00 0.00 0.00 -0.57 0.00 0.00 43.02 38.45 1fug s PHE 230 CO 0.00 -3.79 0.00 1.55 -0.10 0.00 0.00 175.22 172.88 1fug n VAL 231 N 6.14 0.00 -2.30 -0.44 3.14 -1.26 0.13 118.33 123.74 1fug n VAL 231 Ca 0.20 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 61.18 1fug n VAL 231 Cb 0.44 -0.01 -0.03 0.00 -1.06 0.00 0.00 33.84 33.18 1fug n VAL 231 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1fug s ILE 232 N -1.16 3.55 0.00 1.55 1.01 -1.26 -4.70 121.20 120.18 1fug s ILE 232 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.97 1fug s ILE 232 Cb 0.00 -4.44 0.00 0.00 0.01 0.00 0.00 42.46 38.03 1fug s ILE 232 CO 0.00 -1.39 0.00 0.61 0.00 0.00 0.00 174.94 174.16 1fug n GLY 233 N 5.53 5.32 7.00 6.18 0.00 -1.26 -4.98 105.19 122.98 1fug n GLY 233 Ca 0.11 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1fug n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fug n GLY 234 N 1.03 0.91 1.99 -0.02 0.00 -1.26 -1.91 105.19 105.92 1fug n GLY 234 Ca 0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 46.02 45.31 1fug n GLY 234 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1fug n PRO 235 N 0.00 0.48 -4.45 1.61 -0.02 -1.26 -4.53 135.00 126.83 1fug n PRO 235 Ca 0.00 -0.12 -0.23 0.00 -2.02 0.00 0.00 63.50 61.13 1fug n PRO 235 Cb 0.00 -1.44 -0.10 0.00 -0.02 0.00 0.00 33.50 31.94 1fug n PRO 235 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1fug s MET 236 N 1.62 1.61 0.00 -0.52 -1.94 -0.80 -1.10 119.30 118.17 1fug s MET 236 Ca 0.08 -1.74 0.00 0.00 -1.71 0.00 0.00 55.69 52.32 1fug s MET 236 Cb 0.04 -1.63 0.00 0.00 2.01 0.00 0.00 34.83 35.25 1fug s MET 236 CO 0.00 0.29 0.00 0.41 -0.01 0.00 0.00 175.02 175.71 1fug n GLY 237 N -0.58 1.51 3.75 -0.03 0.00 -1.26 -4.60 105.19 103.99 1fug n GLY 237 Ca -0.06 0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1fug n GLY 237 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1fug s ASP 238 N -3.18 7.04 0.87 1.61 -4.77 -1.26 -5.04 116.67 111.93 1fug s ASP 238 Ca 0.00 1.24 -0.11 0.00 -3.30 0.00 0.00 52.55 50.38 1fug s ASP 238 Cb 0.00 -2.40 0.12 0.00 -1.09 0.00 0.00 42.92 39.55 1fug s ASP 238 CO 0.00 0.05 1.16 0.00 0.70 0.00 0.00 175.17 177.08 1fug n GLY 240 N 0.20 -2.48 0.00 0.00 0.00 0.18 -4.36 105.19 98.73 1fug n GLY 240 Ca 0.12 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1fug n GLY 240 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fug n LEU 241 N 0.00 0.00 -4.68 0.99 4.77 -1.26 -4.68 117.00 112.15 1fug n LEU 241 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1fug n LEU 241 Cb 0.00 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1fug n LEU 241 CO 0.00 0.00 1.45 -0.89 -1.33 0.00 0.00 177.39 176.62 1fug s THR 242 N 0.00 2.99 0.00 -5.08 2.01 -0.37 -4.27 115.64 110.93 1fug s THR 242 Ca 0.00 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1fug s THR 242 Cb 0.00 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.33 1fug s THR 242 CO 0.00 -0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.53 1fug n GLY 243 N 4.23 -0.23 1.97 4.40 0.00 -1.26 -4.83 105.19 109.46 1fug n GLY 243 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1fug n GLY 243 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fug n ARG 244 N -0.98 0.00 -2.37 1.61 1.74 -1.26 -4.90 116.66 110.50 1fug n ARG 244 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 1fug n ARG 244 Cb 0.48 -0.01 -0.04 0.00 -1.02 0.00 0.00 32.46 31.88 1fug n ARG 244 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1fug s LYS 245 N -1.98 3.19 -0.21 5.56 -0.14 -1.26 -4.52 119.74 120.38 1fug s LYS 245 Ca 0.00 -0.73 0.13 0.00 -1.36 0.00 0.00 55.97 54.01 1fug s LYS 245 Cb 0.00 -5.15 -0.23 0.00 -1.68 0.00 0.00 37.83 30.77 1fug s LYS 245 CO 0.00 -2.61 0.03 0.44 -0.76 0.00 0.00 175.35 172.45 1fug n ILE 246 N 7.19 1.44 0.04 2.17 -5.35 -1.26 -3.69 119.36 119.90 1fug n ILE 246 Ca 0.33 -0.77 -0.12 0.00 -0.27 0.00 0.00 62.75 61.92 1fug n ILE 246 Cb 0.50 -0.78 -0.09 0.00 -1.74 0.00 0.00 39.64 37.53 1fug n ILE 246 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 1fug h ILE 247 N 0.00 1.04 0.00 7.28 1.08 -1.88 0.26 117.51 125.30 1fug h ILE 247 Ca -0.54 -1.09 0.00 0.00 -0.39 0.00 0.00 64.86 62.84 1fug h ILE 247 Cb 2.14 1.68 0.00 0.00 -3.07 0.00 0.00 36.82 37.57 1fug h ILE 247 CO 0.00 0.24 0.00 1.33 -0.69 0.00 0.00 178.15 179.04 1fug n VAL 248 N -4.92 0.57 0.08 1.67 0.24 -1.26 0.17 118.33 114.88 1fug n VAL 248 Ca -0.08 0.10 -0.10 0.00 -2.04 0.00 0.00 64.34 62.21 1fug n VAL 248 Cb 0.27 -0.79 -0.09 0.00 -1.47 0.00 0.00 33.84 31.76 1fug n VAL 248 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 1fug h ASP 249 N 0.00 0.19 0.00 -1.34 1.82 -1.62 -3.41 116.42 112.07 1fug h ASP 249 Ca 0.00 -0.19 0.00 0.00 -0.39 0.00 0.00 57.03 56.45 1fug h ASP 249 Cb 0.41 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.36 1fug h ASP 249 CO 0.00 1.10 -0.41 0.35 -1.61 0.00 0.00 179.24 178.67 1fug n THR 250 N -3.50 1.21 -2.87 2.25 -2.24 0.46 -2.91 114.28 106.69 1fug n THR 250 Ca -0.04 0.28 -0.05 0.00 -2.27 0.00 0.00 64.05 61.97 1fug n THR 250 Cb 0.92 -1.87 -0.00 0.00 -2.10 0.00 0.00 70.33 67.29 1fug n THR 250 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1fug s TYR 251 N -2.27 -1.43 0.00 4.78 2.02 -0.74 -4.86 117.35 114.85 1fug s TYR 251 Ca -0.12 -0.59 0.00 0.00 -0.37 0.00 0.00 57.07 55.99 1fug s TYR 251 Cb 0.02 0.22 0.00 0.00 -0.40 0.00 0.00 41.96 41.80 1fug s TYR 251 CO 0.18 -1.23 0.00 0.41 -1.57 0.00 0.00 175.55 173.34 1fug n GLY 252 N 3.14 2.90 0.03 0.71 0.00 -1.26 0.02 105.19 110.73 1fug n GLY 252 Ca 0.18 -0.09 0.09 0.00 0.00 0.00 0.00 46.02 46.20 1fug n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fug n GLY 253 N 0.00 -1.06 0.00 -0.02 0.00 -1.26 -4.36 105.19 98.50 1fug n GLY 253 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1fug n GLY 253 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1fug n MET 254 N -2.36 0.00 -2.84 1.61 2.00 0.10 -4.69 117.12 110.94 1fug n MET 254 Ca -0.06 0.19 -0.41 0.00 0.00 0.00 0.00 57.70 57.42 1fug n MET 254 Cb 0.62 -1.70 -0.04 0.00 0.00 0.00 0.00 33.22 32.10 1fug n MET 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1fug s ALA 255 N -2.28 3.26 -0.08 3.04 0.00 0.80 -5.02 121.76 121.48 1fug s ALA 255 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 1fug s ALA 255 Cb 0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 1fug s ALA 255 CO 0.00 -0.24 1.37 0.50 0.00 0.00 0.00 175.76 177.40 1fug s ARG 256 N 1.08 4.25 0.07 0.00 3.52 -1.26 -4.97 118.95 121.63 1fug s ARG 256 Ca 0.46 1.85 0.09 0.00 -0.13 0.00 0.00 55.73 58.00 1fug s ARG 256 Cb -0.19 -3.73 -0.03 0.00 -1.56 0.00 0.00 34.95 29.43 1fug s ARG 256 CO 0.23 -0.66 -0.22 -1.58 -0.81 0.00 0.00 175.30 172.26 1fug s HIS 257 N 3.13 2.45 0.29 5.12 2.46 -1.26 -4.48 115.29 123.01 1fug s HIS 257 Ca 0.61 -0.32 -0.08 0.00 0.47 0.00 0.00 55.06 55.74 1fug s HIS 257 Cb -0.27 -1.39 -0.06 0.00 -0.13 0.00 0.00 32.58 30.73 1fug s HIS 257 CO 0.22 0.26 0.60 0.20 -2.47 0.00 0.00 174.74 173.55 1fug s GLY 258 N -1.63 2.04 0.20 1.59 0.00 -1.26 -4.96 107.32 103.30 1fug s GLY 258 Ca 0.14 -0.37 -0.32 0.00 0.00 0.00 0.00 44.72 44.18 1fug s GLY 258 CO 0.06 -0.23 1.24 0.61 0.00 0.00 0.00 173.10 174.78 1fug n GLY 259 N -0.70 0.28 0.00 0.20 0.00 -1.26 -4.93 105.19 98.78 1fug n GLY 259 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1fug n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fug n GLY 260 N 2.04 1.72 3.42 -0.02 0.00 -1.26 -4.89 105.19 106.20 1fug n GLY 260 Ca 0.14 -1.78 -0.44 0.00 0.00 0.00 0.00 46.02 43.94 1fug n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fug s ALA 261 N -1.49 4.25 0.04 4.61 0.00 -1.26 -4.79 121.76 123.11 1fug s ALA 261 Ca 0.00 -3.51 -0.19 0.00 0.00 0.00 0.00 51.96 48.25 1fug s ALA 261 Cb 0.00 -3.91 -0.16 0.00 0.00 0.00 0.00 23.12 19.05 1fug s ALA 261 CO 0.00 -2.56 1.28 0.74 0.00 0.00 0.00 175.76 175.22 1fug h PHE 262 N 7.06 0.54 -2.86 0.00 -1.00 -1.92 -3.34 116.94 115.43 1fug h PHE 262 Ca 0.26 -0.20 -0.47 0.00 2.81 0.00 0.00 57.97 60.36 1fug h PHE 262 Cb 0.88 -0.10 0.01 0.00 3.61 0.00 0.00 35.95 40.36 1fug h PHE 262 CO 0.98 0.90 -0.15 -1.12 -1.61 0.00 0.00 178.31 177.31 1fug s SER 263 N -6.36 6.24 0.00 2.17 0.01 -1.26 -4.48 113.70 110.02 1fug s SER 263 Ca -0.14 0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.59 1fug s SER 263 Cb 0.05 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.29 1fug s SER 263 CO 0.78 -0.37 0.00 0.61 0.41 0.00 0.00 173.24 174.68 1fug n GLY 264 N -1.86 0.79 3.24 3.44 0.00 -1.26 -4.93 105.19 104.61 1fug n GLY 264 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.70 1fug n GLY 264 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fug s LYS 265 N -0.15 1.81 0.66 1.61 1.02 -1.26 -1.62 119.74 121.80 1fug s LYS 265 Ca 0.00 -0.79 -0.16 0.00 0.02 0.00 0.00 55.97 55.04 1fug s LYS 265 Cb 0.00 -1.74 0.00 0.00 -0.52 0.00 0.00 37.83 35.57 1fug s LYS 265 CO 0.00 0.47 1.17 0.34 -0.92 0.00 0.00 175.35 176.41 1fug s ASP 266 N -0.51 4.82 0.00 2.83 2.15 -0.64 -4.92 116.67 120.41 1fug s ASP 266 Ca 0.08 2.24 0.00 0.00 0.43 0.00 0.00 52.55 55.30 1fug s ASP 266 Cb -0.09 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1fug s ASP 266 CO -0.01 -1.83 0.06 -0.81 -0.17 0.00 0.00 175.17 172.41 1fug n PRO 267 N -2.25 0.08 -0.08 4.34 -0.04 -1.26 -1.37 135.00 134.42 1fug n PRO 267 Ca 0.12 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.45 1fug n PRO 267 Cb 0.51 -1.02 -0.05 0.00 -0.04 0.00 0.00 33.50 32.90 1fug n PRO 267 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1fug h SER 268 N 0.44 0.67 -3.25 3.54 4.64 -1.91 -3.45 113.55 114.22 1fug h SER 268 Ca 0.00 -0.48 -0.55 0.00 -0.47 0.00 0.00 61.79 60.28 1fug h SER 268 Cb 0.02 -0.19 -0.07 0.00 -0.31 0.00 0.00 62.40 61.85 1fug h SER 268 CO 0.00 1.01 0.98 -0.54 -0.87 0.00 0.00 176.83 177.42 1fug s LYS 269 N -4.31 3.53 0.00 4.77 1.02 -0.47 -4.77 119.74 119.51 1fug s LYS 269 Ca -0.13 0.33 0.09 0.00 0.02 0.00 0.00 55.97 56.29 1fug s LYS 269 Cb 0.08 -4.01 0.41 0.00 -0.52 0.00 0.00 37.83 33.80 1fug s LYS 269 CO 0.81 -1.65 1.27 1.33 -0.92 0.00 0.00 175.35 176.19 1fug n VAL 270 N 6.73 1.22 -0.38 3.17 0.24 -1.26 -0.54 118.33 127.51 1fug n VAL 270 Ca 0.10 0.30 -0.09 0.00 -2.04 0.00 0.00 64.34 62.61 1fug n VAL 270 Cb 0.49 -1.15 -0.06 0.00 -1.47 0.00 0.00 33.84 31.65 1fug n VAL 270 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1fug h ASP 271 N 0.00 -1.94 0.10 -1.34 3.32 -1.89 -1.63 116.42 113.03 1fug h ASP 271 Ca 0.00 0.32 -0.23 0.00 0.02 0.00 0.00 57.03 57.14 1fug h ASP 271 Cb 0.14 0.88 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 1fug h ASP 271 CO 0.00 -0.26 -1.13 -0.09 -1.72 0.00 0.00 179.24 176.04 1fug h ARG 272 N -0.04 0.21 -0.00 3.56 2.43 -0.93 -3.32 114.38 116.29 1fug h ARG 272 Ca 0.20 -0.36 -0.18 0.00 -0.81 0.00 0.00 59.98 58.83 1fug h ARG 272 Cb 0.47 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 1fug h ARG 272 CO -0.92 1.17 -0.83 0.77 -1.51 0.00 0.00 179.97 178.66 1fug h SER 273 N -0.45 0.13 0.24 -3.80 0.02 -1.24 0.12 113.55 108.57 1fug h SER 273 Ca -0.24 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1fug h SER 273 Cb 1.62 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 64.11 1fug h SER 273 CO 0.05 0.90 -0.19 0.00 -1.14 0.00 0.00 176.83 176.45 1fug h ALA 274 N 1.09 -0.41 0.00 3.77 0.00 -1.49 -2.72 119.26 119.50 1fug h ALA 274 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1fug h ALA 274 Cb 1.44 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1fug h ALA 274 CO 0.12 -0.75 0.00 0.00 0.00 0.00 0.00 179.25 178.62 1fug h ALA 275 N 0.29 1.00 -0.03 0.00 0.00 -1.40 0.20 119.26 119.32 1fug h ALA 275 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fug h ALA 275 Cb 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1fug h ALA 275 CO -0.01 0.00 0.00 1.88 0.00 0.00 0.00 179.25 181.12 1fug h TYR 276 N 0.00 0.06 -0.71 0.00 0.05 -1.02 -3.35 116.97 112.00 1fug h TYR 276 Ca 0.00 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1fug h TYR 276 Cb 0.48 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.17 1fug h TYR 276 CO 0.00 0.33 0.46 0.00 -1.05 0.00 0.00 178.16 177.90 1fug h ALA 277 N 0.72 1.47 0.00 3.88 0.00 -0.37 0.84 119.26 125.79 1fug h ALA 277 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1fug h ALA 277 Cb 0.31 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1fug h ALA 277 CO 0.00 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.73 1fug n ALA 278 N -2.43 1.95 -0.07 0.00 0.00 -0.05 0.19 120.51 120.10 1fug n ALA 278 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.45 1fug n ALA 278 Cb 0.04 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.38 1fug n ALA 278 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1fug n ARG 279 N -0.38 1.49 -0.19 0.00 0.63 0.27 -3.56 116.66 114.93 1fug n ARG 279 Ca 0.00 -0.02 -0.04 0.00 -0.92 0.00 0.00 57.85 56.88 1fug n ARG 279 Cb 0.02 -1.38 0.06 0.00 0.45 0.00 0.00 32.46 31.61 1fug n ARG 279 CO 0.00 0.00 0.00 -0.92 -2.51 0.00 0.00 177.63 174.20 1fug h TYR 280 N 0.00 0.54 -0.61 -0.14 3.20 0.22 0.92 116.97 121.10 1fug h TYR 280 Ca -0.38 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.42 1fug h TYR 280 Cb 1.84 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.93 1fug h TYR 280 CO 0.00 0.27 0.03 -0.39 -1.64 0.00 0.00 178.16 176.43 1fug h VAL 281 N 0.57 1.26 0.33 1.81 -1.51 -1.10 -3.15 116.25 114.47 1fug h VAL 281 Ca 0.24 -1.10 -0.02 0.00 -1.23 0.00 0.00 66.70 64.59 1fug h VAL 281 Cb 0.14 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 30.08 1fug h VAL 281 CO -0.16 0.40 -0.16 0.00 -1.23 0.00 0.00 177.57 176.42 1fug h ALA 282 N 1.00 -0.45 -0.20 5.19 0.00 -1.38 0.49 119.26 123.91 1fug h ALA 282 Ca 0.18 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1fug h ALA 282 Cb 0.51 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1fug h ALA 282 CO 0.02 -0.48 -0.15 -0.22 0.00 0.00 0.00 179.25 178.43 1fug h LYS 283 N -1.00 -0.14 0.00 0.00 3.64 -0.99 0.55 116.57 118.64 1fug h LYS 283 Ca -0.05 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1fug h LYS 283 Cb 0.49 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1fug h LYS 283 CO 0.08 -0.10 -0.15 -0.97 -2.27 0.00 0.00 179.45 176.04 1fug h ASN 284 N -0.15 -0.43 0.16 4.20 -1.24 -1.62 1.37 115.58 117.87 1fug h ASN 284 Ca 0.12 0.06 0.00 0.00 0.71 0.00 0.00 56.30 57.19 1fug h ASN 284 Cb 0.32 0.18 0.00 0.00 0.73 0.00 0.00 38.32 39.56 1fug h ASN 284 CO -0.29 -0.21 0.00 0.40 -1.29 0.00 0.00 177.43 176.05 1fug h ILE 285 N -0.25 0.00 0.00 2.57 5.03 0.34 -0.19 117.51 125.02 1fug h ILE 285 Ca 0.05 -0.06 -0.11 0.00 -0.12 0.00 0.00 64.86 64.61 1fug h ILE 285 Cb 0.31 0.80 -0.02 0.00 -3.03 0.00 0.00 36.82 34.88 1fug h ILE 285 CO -0.14 0.00 -0.83 0.58 -0.68 0.00 0.00 178.15 177.08 1fug h VAL 286 N 0.00 0.53 -0.99 1.67 2.07 0.13 -3.29 116.25 116.38 1fug h VAL 286 Ca 0.00 -1.64 0.20 0.00 0.82 0.00 0.00 66.70 66.09 1fug h VAL 286 Cb 0.08 1.24 -0.10 0.00 -1.52 0.00 0.00 31.29 30.99 1fug h VAL 286 CO 0.00 0.18 0.62 0.00 0.02 0.00 0.00 177.57 178.39 1fug h ALA 287 N -0.71 1.88 -0.18 1.67 0.00 0.34 0.22 119.26 122.47 1fug h ALA 287 Ca -0.17 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.60 1fug h ALA 287 Cb 0.89 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.55 1fug h ALA 287 CO -0.10 -0.24 0.03 0.00 0.00 0.00 0.00 179.25 178.94 1fug n ALA 288 N -2.39 5.33 -0.04 0.00 0.00 -0.43 -4.86 120.51 118.12 1fug n ALA 288 Ca 0.23 -1.37 0.00 0.00 0.00 0.00 0.00 53.44 52.30 1fug n ALA 288 Cb 0.65 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1fug n ALA 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fug n GLY 289 N 1.47 0.66 0.10 0.00 0.00 0.76 -4.80 105.19 103.37 1fug n GLY 289 Ca 0.27 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.41 1fug n GLY 289 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fug h LEU 290 N 0.00 0.00 0.00 0.99 4.07 -1.73 -3.43 115.31 115.21 1fug h LEU 290 Ca 0.00 -0.10 -0.03 0.00 0.08 0.00 0.00 57.88 57.83 1fug h LEU 290 Cb 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 1fug h LEU 290 CO 0.00 0.05 -0.03 0.00 -1.08 0.00 0.00 178.44 177.38 1fug n ALA 291 N -1.86 0.03 -0.52 1.53 0.00 -1.24 0.51 120.51 118.96 1fug n ALA 291 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1fug n ALA 291 Cb 0.45 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1fug n ALA 291 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1fug n ASP 292 N -2.65 0.73 -2.79 0.00 -0.08 -1.12 -4.82 116.55 105.82 1fug n ASP 292 Ca 0.00 -1.25 -0.06 0.00 -1.51 0.00 0.00 54.79 51.98 1fug n ASP 292 Cb 0.04 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.51 1fug n ASP 292 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1fug n ARG 293 N -0.12 0.57 -1.84 -0.67 1.85 -1.26 -3.78 116.66 111.40 1fug n ARG 293 Ca 0.00 -2.04 -0.32 0.00 -1.00 0.00 0.00 57.85 54.49 1fug n ARG 293 Cb 0.26 -1.48 0.03 0.00 -1.05 0.00 0.00 32.46 30.22 1fug n ARG 293 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1fug s GLU 295 N -4.61 0.08 -0.08 0.00 -1.05 -1.18 -1.99 118.70 109.87 1fug s GLU 295 Ca 0.60 0.12 -0.17 0.00 -0.15 0.00 0.00 54.97 55.37 1fug s GLU 295 Cb -0.14 -1.34 -0.05 0.00 -0.44 0.00 0.00 34.13 32.16 1fug s GLU 295 CO 0.46 -0.59 0.46 -1.50 0.95 0.00 0.00 175.26 175.04 1fug s ILE 296 N 2.21 5.13 0.24 1.83 -1.16 -0.70 -2.65 121.20 126.10 1fug s ILE 296 Ca 0.04 0.93 -0.21 0.00 -0.51 0.00 0.00 60.65 60.89 1fug s ILE 296 Cb -0.15 -3.79 -0.09 0.00 0.61 0.00 0.00 42.46 39.04 1fug s ILE 296 CO -0.09 0.40 0.78 -1.58 -2.81 0.00 0.00 174.94 171.64 1fug s GLN 297 N 0.13 4.35 0.18 3.50 2.00 0.75 -1.60 119.66 128.97 1fug s GLN 297 Ca 0.25 0.99 0.07 0.00 -2.00 0.00 0.00 55.36 54.67 1fug s GLN 297 Cb -0.16 -2.88 -0.04 0.00 0.80 0.00 0.00 33.01 30.73 1fug s GLN 297 CO 0.11 0.37 -0.14 0.08 -0.50 0.00 0.00 175.29 175.22 1fug s VAL 298 N -1.53 1.56 0.20 1.34 1.01 0.54 -2.88 120.40 120.64 1fug s VAL 298 Ca 0.44 -2.11 -0.05 0.00 0.00 0.00 0.00 61.98 60.26 1fug s VAL 298 Cb -0.17 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1fug s VAL 298 CO 0.22 -0.60 0.23 -0.94 0.00 0.00 0.00 175.10 174.01 1fug s SER 299 N -3.16 0.09 0.15 3.32 1.04 -1.11 -0.00 113.70 114.03 1fug s SER 299 Ca 0.19 -1.18 -0.10 0.00 0.48 0.00 0.00 55.95 55.34 1fug s SER 299 Cb -0.01 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1fug s SER 299 CO 0.05 -0.91 0.30 -0.31 0.98 0.00 0.00 173.24 173.34 1fug s TYR 300 N -4.08 0.24 0.17 5.02 1.51 -0.96 -3.42 117.35 115.83 1fug s TYR 300 Ca 0.30 -0.61 0.11 0.00 -1.01 0.00 0.00 57.07 55.86 1fug s TYR 300 Cb 0.05 0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.87 1fug s TYR 300 CO 0.08 -0.70 -0.23 0.00 -1.11 0.00 0.00 175.55 173.59 1fug s ALA 301 N -3.92 2.54 0.03 3.71 0.00 -1.26 -3.49 121.76 119.37 1fug s ALA 301 Ca 0.12 -1.57 -0.30 0.00 0.00 0.00 0.00 51.96 50.22 1fug s ALA 301 Cb 0.03 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.72 1fug s ALA 301 CO -0.04 0.47 1.01 -1.50 0.00 0.00 0.00 175.76 175.70 1fug s ILE 302 N -1.49 4.69 0.00 0.00 2.07 -1.26 -0.99 121.20 124.22 1fug s ILE 302 Ca 0.19 1.97 0.00 0.00 -1.41 0.00 0.00 60.65 61.41 1fug s ILE 302 Cb -0.09 -4.26 0.00 0.00 0.13 0.00 0.00 42.46 38.24 1fug s ILE 302 CO 0.09 0.18 0.00 0.61 -1.91 0.00 0.00 174.94 173.91 1fug n GLY 303 N 2.83 0.45 3.06 1.50 0.00 -1.18 -4.95 105.19 106.91 1fug n GLY 303 Ca 0.06 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.98 1fug n GLY 303 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fug s VAL 304 N -2.00 -0.02 -0.04 1.61 0.11 -0.16 -4.99 120.40 114.91 1fug s VAL 304 Ca 0.00 0.08 -0.23 0.00 -2.93 0.00 0.00 61.98 58.90 1fug s VAL 304 Cb 0.00 -0.32 -0.24 0.00 -1.53 0.00 0.00 36.38 34.28 1fug s VAL 304 CO 0.00 0.03 1.03 0.00 -3.33 0.00 0.00 175.10 172.83 1fug h ALA 305 N 6.49 0.03 -2.21 1.54 0.00 -1.83 -3.39 119.26 119.89 1fug h ALA 305 Ca -0.33 -0.52 -0.56 0.00 0.00 0.00 0.00 54.91 53.50 1fug h ALA 305 Cb 1.17 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1fug h ALA 305 CO 0.38 0.19 0.85 -1.21 0.00 0.00 0.00 179.25 179.45 1fug s GLU 306 N -3.05 4.27 0.91 0.00 0.41 -1.26 -4.09 118.70 115.89 1fug s GLU 306 Ca -0.15 1.70 -0.12 0.00 -0.41 0.00 0.00 54.97 56.00 1fug s GLU 306 Cb 0.01 -3.70 0.14 0.00 -1.78 0.00 0.00 34.13 28.80 1fug s GLU 306 CO 0.77 -0.63 1.09 -1.25 -0.49 0.00 0.00 175.26 174.76 1fug s PRO 307 N 3.07 1.14 -0.01 0.39 0.04 -1.26 -4.63 135.00 133.73 1fug s PRO 307 Ca 0.56 0.85 0.21 0.00 0.04 0.00 0.00 61.00 62.67 1fug s PRO 307 Cb -0.24 -1.79 -0.26 0.00 0.04 0.00 0.00 34.50 32.25 1fug s PRO 307 CO 0.18 -2.33 0.54 0.25 0.04 0.00 0.00 177.00 175.67 1fug n THR 308 N -3.95 0.37 -3.60 1.26 -2.24 -1.22 -4.93 114.28 99.96 1fug n THR 308 Ca 0.07 -0.57 -0.03 0.00 -2.27 0.00 0.00 64.05 61.26 1fug n THR 308 Cb 0.55 -0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 1fug n THR 308 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1fug s SER 309 N -4.87 -0.65 -0.04 3.42 0.01 -1.26 -5.03 113.70 105.28 1fug s SER 309 Ca -0.07 1.00 0.00 0.00 1.31 0.00 0.00 55.95 58.19 1fug s SER 309 Cb 0.12 1.39 0.03 0.00 0.21 0.00 0.00 66.02 67.77 1fug s SER 309 CO 0.87 -0.15 -0.01 0.27 0.41 0.00 0.00 173.24 174.63 1fug s ILE 310 N 1.69 0.28 -0.08 1.44 -0.00 -1.26 -2.75 121.20 120.51 1fug s ILE 310 Ca -0.08 0.06 -0.03 0.00 -0.00 0.00 0.00 60.65 60.60 1fug s ILE 310 Cb -0.05 -0.37 0.05 0.00 -0.00 0.00 0.00 42.46 42.08 1fug s ILE 310 CO -0.17 0.18 0.17 -0.32 -0.00 0.00 0.00 174.94 174.81 1fug s MET 311 N 1.21 0.07 -0.48 0.37 1.75 -1.14 -4.94 119.30 116.14 1fug s MET 311 Ca -0.07 0.52 -0.03 0.00 -1.25 0.00 0.00 55.69 54.86 1fug s MET 311 Cb -0.13 -0.22 0.13 0.00 2.84 0.00 0.00 34.83 37.44 1fug s MET 311 CO -0.02 -0.26 0.28 0.54 -0.65 0.00 0.00 175.02 174.92 1fug s VAL 312 N 1.94 3.49 0.99 10.11 0.11 -1.26 -0.18 120.40 135.60 1fug s VAL 312 Ca -0.01 -2.28 -0.12 0.00 -2.93 0.00 0.00 61.98 56.63 1fug s VAL 312 Cb -0.12 -3.35 0.18 0.00 -1.53 0.00 0.00 36.38 31.56 1fug s VAL 312 CO -0.06 -0.75 1.09 -0.70 -3.33 0.00 0.00 175.10 171.35 1fug s GLU 313 N 0.83 0.52 -0.25 1.54 2.56 -1.08 -4.85 118.70 117.96 1fug s GLU 313 Ca 0.10 0.58 -0.03 0.00 0.00 0.00 0.00 54.97 55.62 1fug s GLU 313 Cb -0.22 -1.74 0.14 0.00 2.00 0.00 0.00 34.13 34.30 1fug s GLU 313 CO -0.04 -2.69 0.43 0.95 -0.56 0.00 0.00 175.26 173.36 1fug s THR 314 N -2.94 -0.69 -1.28 -1.70 -4.23 -1.26 -3.10 115.64 100.44 1fug s THR 314 Ca 0.65 -0.02 -0.13 0.00 -1.18 0.00 0.00 61.69 61.01 1fug s THR 314 Cb -0.19 -0.83 0.14 0.00 1.34 0.00 0.00 72.50 72.96 1fug s THR 314 CO 0.58 -0.07 1.74 0.49 -0.54 0.00 0.00 174.62 176.82 1fug n PHE 315 N 5.38 3.98 -4.10 3.99 3.01 -1.24 -4.75 117.46 123.73 1fug n PHE 315 Ca -0.04 -3.03 0.00 0.00 1.01 0.00 0.00 57.45 55.39 1fug n PHE 315 Cb 0.50 -2.19 0.00 0.00 -0.01 0.00 0.00 39.48 37.78 1fug n PHE 315 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fug n GLY 316 N 3.75 -0.81 3.28 1.37 0.00 -1.26 -4.93 105.19 106.59 1fug n GLY 316 Ca 0.41 -1.17 -0.18 0.00 0.00 0.00 0.00 46.02 45.07 1fug n GLY 316 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1fug n THR 317 N 0.00 -3.97 -3.77 2.61 -1.04 -1.26 -4.84 114.28 102.01 1fug n THR 317 Ca 0.00 -0.21 -0.37 0.00 -2.04 0.00 0.00 64.05 61.42 1fug n THR 317 Cb 0.00 -4.22 -0.13 0.00 -1.82 0.00 0.00 70.33 64.17 1fug n THR 317 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 1fug s GLU 318 N -5.72 3.02 -0.19 -2.82 1.03 -1.26 -2.78 118.70 109.99 1fug s GLU 318 Ca 0.27 -0.90 0.00 0.00 0.03 0.00 0.00 54.97 54.38 1fug s GLU 318 Cb -0.12 -3.36 0.20 0.00 -0.80 0.00 0.00 34.13 30.05 1fug s GLU 318 CO 0.65 -0.47 1.61 1.63 -1.33 0.00 0.00 175.26 177.36 1fug n LYS 319 N 4.85 1.49 -3.64 -4.83 4.01 0.18 -4.72 118.16 115.50 1fug n LYS 319 Ca -0.14 -1.07 -0.08 0.00 -0.51 0.00 0.00 58.31 56.51 1fug n LYS 319 Cb 0.48 -1.42 -0.07 0.00 -0.51 0.00 0.00 35.03 33.51 1fug n LYS 319 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 1fug s VAL 320 N -1.35 0.00 0.01 -0.18 -7.23 -1.26 -4.90 120.40 105.50 1fug s VAL 320 Ca 0.21 0.00 -0.08 0.00 -1.81 0.00 0.00 61.98 60.29 1fug s VAL 320 Cb 0.17 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 36.07 1fug s VAL 320 CO 0.02 0.00 1.12 1.55 -0.31 0.00 0.00 175.10 177.48 1fug h PRO 321 N 4.03 -0.26 0.00 4.82 0.13 -1.98 -3.48 132.00 135.26 1fug h PRO 321 Ca -0.28 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1fug h PRO 321 Cb 1.18 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1fug h PRO 321 CO 0.12 -0.18 0.00 0.45 -0.23 0.00 0.00 178.00 178.16 1fug n SER 322 N -2.86 -2.01 0.06 1.44 2.88 -1.26 -4.98 113.62 106.89 1fug n SER 322 Ca -0.03 0.56 0.09 0.00 -1.33 0.00 0.00 58.87 58.16 1fug n SER 322 Cb 0.11 2.07 0.38 0.00 -0.75 0.00 0.00 64.21 66.03 1fug n SER 322 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1fug n GLU 323 N -2.97 0.09 0.14 -1.46 4.07 -1.26 0.07 120.64 119.32 1fug n GLU 323 Ca 0.00 0.36 -0.15 0.00 -0.06 0.00 0.00 57.16 57.30 1fug n GLU 323 Cb 0.00 -1.68 -0.08 0.00 -0.06 0.00 0.00 31.44 29.62 1fug n GLU 323 CO 0.00 0.00 0.00 0.37 -0.06 0.00 0.00 177.13 177.44 1fug h GLN 324 N 0.00 -0.69 -0.05 5.31 5.75 -1.95 -2.17 115.11 121.32 1fug h GLN 324 Ca 0.00 0.05 -0.17 0.00 -0.15 0.00 0.00 58.65 58.37 1fug h GLN 324 Cb 0.27 0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.97 1fug h GLN 324 CO 0.00 -0.46 -0.73 1.37 -2.65 0.00 0.00 178.83 176.36 1fug h LEU 325 N -0.72 0.33 -0.10 -2.39 -0.00 -0.73 -1.67 115.31 110.03 1fug h LEU 325 Ca 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 57.88 57.66 1fug h LEU 325 Cb 0.72 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.28 1fug h LEU 325 CO -0.22 0.95 0.00 0.41 -0.00 0.00 0.00 178.44 179.58 1fug n THR 326 N -3.79 0.00 -0.11 0.15 -1.04 -1.10 0.62 114.28 109.00 1fug n THR 326 Ca -0.03 0.00 -0.16 0.00 -2.04 0.00 0.00 64.05 61.81 1fug n THR 326 Cb 0.71 -0.14 -0.10 0.00 -1.82 0.00 0.00 70.33 68.98 1fug n THR 326 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1fug n LEU 327 N -0.44 2.76 -0.34 -4.42 0.00 -0.69 -4.33 117.00 109.53 1fug n LEU 327 Ca 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 56.01 55.98 1fug n LEU 327 Cb 0.02 -0.74 0.16 0.00 0.00 0.00 0.00 43.42 42.86 1fug n LEU 327 CO 0.00 0.80 1.23 0.25 0.00 0.00 0.00 177.39 179.67 1fug h LEU 328 N -0.13 0.95 -0.11 -1.96 6.46 0.86 0.90 115.31 122.27 1fug h LEU 328 Ca -0.50 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.27 1fug h LEU 328 Cb 1.70 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 41.44 1fug h LEU 328 CO -0.12 0.61 0.03 0.58 -0.62 0.00 0.00 178.44 178.92 1fug h VAL 329 N 1.09 1.18 0.00 1.05 2.07 -0.90 -0.15 116.25 120.59 1fug h VAL 329 Ca 0.41 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1fug h VAL 329 Cb 0.17 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1fug h VAL 329 CO -0.17 0.17 -0.00 0.03 0.02 0.00 0.00 177.57 177.61 1fug h ARG 330 N -0.01 0.00 0.01 1.57 3.08 -0.23 -0.91 114.38 117.90 1fug h ARG 330 Ca 0.04 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.92 1fug h ARG 330 Cb 0.23 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.30 1fug h ARG 330 CO -0.00 0.00 -0.66 0.93 -1.07 0.00 0.00 179.97 179.17 1fug h GLU 331 N 0.00 0.42 -0.63 0.04 4.39 0.15 -3.41 114.58 115.53 1fug h GLU 331 Ca -0.00 -0.47 -0.30 0.00 0.34 0.00 0.00 59.36 58.93 1fug h GLU 331 Cb 0.00 0.14 -0.40 0.00 -0.10 0.00 0.00 28.75 28.39 1fug h GLU 331 CO 0.00 1.13 -1.11 1.97 -1.16 0.00 0.00 179.01 179.84 1fug n PHE 332 N -4.18 1.39 -3.05 4.33 1.16 -0.16 -4.87 117.46 112.08 1fug n PHE 332 Ca -0.11 -2.34 -0.09 0.00 -1.87 0.00 0.00 57.45 53.04 1fug n PHE 332 Cb 0.70 -0.27 -0.03 0.00 -1.61 0.00 0.00 39.48 38.27 1fug n PHE 332 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 1fug s PHE 333 N -3.61 -0.96 -0.85 2.97 0.08 -0.55 -4.99 117.98 110.07 1fug s PHE 333 Ca 0.29 -0.77 -0.26 0.00 0.12 0.00 0.00 56.93 56.32 1fug s PHE 333 Cb 0.37 -0.01 -0.13 0.00 -0.57 0.00 0.00 43.02 42.68 1fug s PHE 333 CO -0.02 -1.13 2.28 0.34 -0.10 0.00 0.00 175.22 176.58 1fug s ASP 334 N 0.99 4.12 0.00 1.36 -1.08 -1.26 -4.75 116.67 116.05 1fug s ASP 334 Ca 0.26 -0.24 0.11 0.00 -0.52 0.00 0.00 52.55 52.16 1fug s ASP 334 Cb -0.02 -2.56 0.65 0.00 -1.46 0.00 0.00 42.92 39.53 1fug s ASP 334 CO -0.08 -3.72 1.19 0.18 0.52 0.00 0.00 175.17 173.26 1fug n LEU 335 N 17.73 0.00 -4.74 -1.34 4.77 -1.26 -4.04 117.00 128.12 1fug n LEU 335 Ca 0.45 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 56.01 1fug n LEU 335 Cb 0.44 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1fug n LEU 335 CO 0.56 0.00 1.12 -0.13 -1.33 0.00 0.00 177.39 177.61 1fug s ARG 336 N -2.00 4.26 0.10 3.23 3.00 -1.26 -4.81 118.95 121.48 1fug s ARG 336 Ca 0.16 2.29 -0.26 0.00 0.00 0.00 0.00 55.73 57.93 1fug s ARG 336 Cb 0.07 -3.13 -0.09 0.00 0.00 0.00 0.00 34.95 31.80 1fug s ARG 336 CO 0.13 -0.45 1.43 -1.35 0.00 0.00 0.00 175.30 175.05 1fug h PRO 337 N 5.54 -0.32 0.00 3.54 0.11 -1.80 -0.58 132.00 138.48 1fug h PRO 337 Ca -0.45 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1fug h PRO 337 Cb 1.21 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1fug h PRO 337 CO 0.81 -0.22 0.00 0.98 -0.21 0.00 0.00 178.00 179.37 1fug n TYR 338 N -4.78 0.54 0.17 0.65 9.36 -1.26 -1.76 117.16 120.08 1fug n TYR 338 Ca -0.03 0.22 -0.14 0.00 3.32 0.00 0.00 57.90 61.27 1fug n TYR 338 Cb 0.27 -0.85 -0.08 0.00 -0.63 0.00 0.00 39.34 38.04 1fug n TYR 338 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1fug h GLY 339 N 2.08 -0.40 -0.07 2.98 0.00 -1.37 -3.05 103.07 103.23 1fug h GLY 339 Ca 0.00 0.15 0.15 0.00 0.00 0.00 0.00 47.33 47.63 1fug h GLY 339 CO 0.00 -0.15 0.12 1.41 0.00 0.00 0.00 176.54 177.92 1fug h LEU 340 N -0.52 -0.09 -0.54 3.11 -0.00 -1.00 0.52 115.31 116.79 1fug h LEU 340 Ca -0.04 0.15 0.05 0.00 -0.00 0.00 0.00 57.88 58.04 1fug h LEU 340 Cb 0.39 0.22 -0.07 0.00 -0.00 0.00 0.00 40.66 41.20 1fug h LEU 340 CO 0.06 -0.06 -0.33 0.40 -0.00 0.00 0.00 178.44 178.51 1fug h ILE 341 N 0.22 0.00 -0.09 1.22 5.03 -1.59 0.59 117.51 122.89 1fug h ILE 341 Ca 0.38 0.00 -0.06 0.00 -0.12 0.00 0.00 64.86 65.07 1fug h ILE 341 Cb 0.65 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 34.43 1fug h ILE 341 CO -0.52 0.00 -0.21 1.56 -0.68 0.00 0.00 178.15 178.30 1fug h GLN 342 N -0.01 0.14 -0.42 2.37 4.20 -0.97 -1.44 115.11 118.97 1fug h GLN 342 Ca 0.09 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.64 1fug h GLN 342 Cb 0.24 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1fug h GLN 342 CO -0.52 0.35 -0.21 1.98 -0.67 0.00 0.00 178.83 179.76 1fug h MET 343 N 0.13 0.84 -0.44 1.46 4.05 0.12 -3.29 114.93 117.80 1fug h MET 343 Ca 0.02 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.10 1fug h MET 343 Cb 0.45 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 1fug h MET 343 CO 0.03 0.97 0.00 1.28 0.23 0.00 0.00 176.91 179.42 1fug n LEU 344 N -4.12 4.44 -4.25 3.39 4.32 0.18 -4.93 117.00 116.04 1fug n LEU 344 Ca 0.00 -2.75 -0.38 0.00 -0.02 0.00 0.00 56.01 52.86 1fug n LEU 344 Cb 0.43 -0.55 -0.07 0.00 -1.62 0.00 0.00 43.42 41.61 1fug n LEU 344 CO 0.45 0.70 -0.16 -0.67 -1.22 0.00 0.00 177.39 176.50 1fug n ASP 345 N 0.26 -1.55 0.15 -1.43 2.03 -1.07 -4.77 116.55 110.16 1fug n ASP 345 Ca 0.23 -1.13 0.00 0.00 0.52 0.00 0.00 54.79 54.41 1fug n ASP 345 Cb 0.92 -1.44 0.22 0.00 -0.72 0.00 0.00 41.12 40.09 1fug n ASP 345 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1fug h LEU 346 N -0.81 0.00 -5.50 -2.67 3.38 -1.85 -3.36 115.31 104.50 1fug h LEU 346 Ca -0.54 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.20 1fug h LEU 346 Cb 1.26 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.01 1fug h LEU 346 CO 0.81 0.55 1.83 0.18 0.09 0.00 0.00 178.44 181.90 1fug n LEU 347 N -3.77 3.12 -3.97 1.67 7.99 -1.26 -4.78 117.00 116.00 1fug n LEU 347 Ca -0.01 -2.16 -0.12 0.00 -0.01 0.00 0.00 56.01 53.71 1fug n LEU 347 Cb 0.58 -0.85 -0.12 0.00 -0.11 0.00 0.00 43.42 42.92 1fug n LEU 347 CO 0.41 0.04 -0.38 -1.00 -1.51 0.00 0.00 177.39 174.95 1fug s HIS 348 N 3.72 0.34 0.23 -1.77 3.76 -1.26 -4.81 115.29 115.50 1fug s HIS 348 Ca 0.26 -0.32 -0.32 0.00 -0.15 0.00 0.00 55.06 54.54 1fug s HIS 348 Cb 0.07 -0.22 -0.13 0.00 1.11 0.00 0.00 32.58 33.41 1fug s HIS 348 CO -0.02 -0.09 1.43 -0.35 -0.85 0.00 0.00 174.74 174.87 1fug n PRO 349 N 2.16 2.05 0.00 8.40 -0.04 -1.26 -4.36 135.00 141.95 1fug n PRO 349 Ca -0.19 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.00 1fug n PRO 349 Cb 0.57 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 1fug n PRO 349 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1fug n ILE 350 N 2.10 0.00 0.31 0.52 2.08 -1.26 -5.06 119.36 118.05 1fug n ILE 350 Ca 0.12 0.00 0.19 0.00 0.56 0.00 0.00 62.75 63.63 1fug n ILE 350 Cb 0.31 0.00 1.03 0.00 -0.75 0.00 0.00 39.64 40.23 1fug n ILE 350 CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 1fug h TYR 351 N 0.00 0.00 0.00 1.39 0.05 -1.93 -3.25 116.97 113.23 1fug h TYR 351 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 1fug h TYR 351 Cb 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.74 1fug h TYR 351 CO 0.00 0.02 -0.07 -0.22 -1.05 0.00 0.00 178.16 176.84 1fug h LYS 352 N 0.00 0.00 0.00 4.88 1.63 -1.94 0.35 116.57 121.49 1fug h LYS 352 Ca -0.00 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.78 1fug h LYS 352 Cb 0.11 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1fug h LYS 352 CO 0.00 0.07 -0.09 0.93 -3.45 0.00 0.00 179.45 176.91 1fug h GLU 353 N 0.00 0.00 -0.48 1.90 5.08 -1.98 -2.94 114.58 116.17 1fug h GLU 353 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1fug h GLU 353 Cb 0.52 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1fug h GLU 353 CO 0.01 0.09 0.16 0.00 -1.00 0.00 0.00 179.01 178.27 1fug h THR 354 N 0.00 1.22 0.00 1.13 1.03 -0.55 -3.24 112.91 112.50 1fug h THR 354 Ca -0.00 -0.72 -0.05 0.00 -0.01 0.00 0.00 66.41 65.63 1fug h THR 354 Cb 0.29 0.80 -0.01 0.00 -1.07 0.00 0.00 68.15 68.16 1fug h THR 354 CO 0.01 0.27 -0.23 0.00 -0.01 0.00 0.00 175.52 175.56 1fug h ALA 355 N 1.01 1.20 -0.74 0.00 0.00 -1.66 -3.25 119.26 115.83 1fug h ALA 355 Ca 0.16 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1fug h ALA 355 Cb 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1fug h ALA 355 CO -0.01 0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.53 1fug n ALA 356 N -2.31 -0.35 -2.82 0.00 0.00 -1.22 -4.78 120.51 109.04 1fug n ALA 356 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 1fug n ALA 356 Cb 0.35 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.83 1fug n ALA 356 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1fug n TYR 357 N -1.63 0.13 0.00 0.00 4.01 -1.22 -4.81 117.16 113.64 1fug n TYR 357 Ca 0.00 -2.91 0.00 0.00 -0.16 0.00 0.00 57.90 54.83 1fug n TYR 357 Cb 0.00 0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1fug n TYR 357 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fug n GLY 358 N -0.01 2.47 0.13 2.72 0.00 -1.26 -4.85 105.19 104.39 1fug n GLY 358 Ca 0.12 -1.67 -0.24 0.00 0.00 0.00 0.00 46.02 44.23 1fug n GLY 358 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fug n HIS 359 N 1.38 0.36 -3.80 1.61 8.25 -1.14 -4.68 115.22 117.20 1fug n HIS 359 Ca 0.00 0.12 -0.36 0.00 -0.26 0.00 0.00 57.72 57.22 1fug n HIS 359 Cb 0.00 -1.04 -0.06 0.00 1.12 0.00 0.00 29.99 30.01 1fug n HIS 359 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1fug s PHE 360 N -2.49 3.61 0.00 4.41 0.08 -1.26 -4.78 117.98 117.54 1fug s PHE 360 Ca -0.34 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1fug s PHE 360 Cb 0.11 -1.99 0.00 0.00 -0.57 0.00 0.00 43.02 40.57 1fug s PHE 360 CO 0.57 0.69 0.00 0.41 -0.10 0.00 0.00 175.22 176.79 1fug n GLY 361 N 1.65 -0.81 3.76 4.36 0.00 -1.26 -4.97 105.19 107.91 1fug n GLY 361 Ca -0.16 0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1fug n GLY 361 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1fug s ARG 362 N 0.00 4.49 -1.06 1.61 1.70 -1.26 -4.93 118.95 119.50 1fug s ARG 362 Ca 0.00 2.00 -0.23 0.00 -0.47 0.00 0.00 55.73 57.03 1fug s ARG 362 Cb 0.00 -3.15 -0.01 0.00 -0.57 0.00 0.00 34.95 31.22 1fug s ARG 362 CO 0.00 -0.02 1.77 -1.21 -1.08 0.00 0.00 175.30 174.76 1fug s GLU 363 N -1.34 3.07 0.35 3.89 2.02 -1.26 -4.34 118.70 121.09 1fug s GLU 363 Ca 0.48 -0.99 0.00 0.00 0.02 0.00 0.00 54.97 54.48 1fug s GLU 363 Cb -0.36 -5.26 0.00 0.00 0.10 0.00 0.00 34.13 28.61 1fug s GLU 363 CO 0.45 -3.00 0.00 -2.39 0.02 0.00 0.00 175.26 170.34 1fug n HIS 364 N 11.73 -3.33 -1.76 1.61 1.44 -1.26 -5.14 115.22 118.51 1fug n HIS 364 Ca 0.41 0.88 -0.40 0.00 -2.01 0.00 0.00 57.72 56.60 1fug n HIS 364 Cb 0.48 1.86 0.03 0.00 0.12 0.00 0.00 29.99 32.48 1fug n HIS 364 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 1fug n PHE 365 N -3.44 2.63 0.21 -1.40 3.72 -1.26 -4.80 117.46 113.12 1fug n PHE 365 Ca 0.00 0.43 0.10 0.00 -0.05 0.00 0.00 57.45 57.93 1fug n PHE 365 Cb 0.00 -2.44 0.53 0.00 -0.94 0.00 0.00 39.48 36.63 1fug n PHE 365 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1fug h PRO 366 N 2.08 0.00 -0.33 -1.08 0.13 -1.97 -2.56 132.00 128.27 1fug h PRO 366 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1fug h PRO 366 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1fug h PRO 366 CO 0.60 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.70 1fug n TRP 367 N -2.31 0.00 -2.10 1.56 2.14 -1.26 -2.45 117.44 113.02 1fug n TRP 367 Ca -0.01 0.00 -0.00 0.00 2.07 0.00 0.00 57.50 59.56 1fug n TRP 367 Cb 0.27 -0.03 -0.01 0.00 -0.81 0.00 0.00 31.31 30.73 1fug n TRP 367 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1fug n GLU 368 N -0.09 0.00 -3.72 -2.67 1.02 -0.96 -4.10 120.64 110.12 1fug n GLU 368 Ca 0.00 -0.94 -0.36 0.00 -0.02 0.00 0.00 57.16 55.84 1fug n GLU 368 Cb 0.08 -0.12 -0.07 0.00 -0.02 0.00 0.00 31.44 31.31 1fug n GLU 368 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 1fug s LYS 369 N 0.00 3.97 0.00 3.49 0.00 -1.02 -4.96 119.74 121.21 1fug s LYS 369 Ca 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 55.97 55.95 1fug s LYS 369 Cb 0.08 -3.34 0.00 0.00 0.00 0.00 0.00 37.83 34.57 1fug s LYS 369 CO -0.04 0.45 1.30 0.25 0.00 0.00 0.00 175.35 177.31 1fug n THR 370 N 2.98 1.30 0.00 3.79 -2.24 -1.26 -4.59 114.28 114.25 1fug n THR 370 Ca -0.16 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1fug n THR 370 Cb 0.53 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.58 1fug n THR 370 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1fug n ASP 371 N 1.05 0.00 -0.25 3.42 -0.08 -1.26 -2.54 116.55 116.89 1fug n ASP 371 Ca 0.00 0.87 0.06 0.00 -1.51 0.00 0.00 54.79 54.21 1fug n ASP 371 Cb 0.44 -0.37 0.25 0.00 2.34 0.00 0.00 41.12 43.78 1fug n ASP 371 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1fug n LYS 372 N -2.23 1.33 0.33 -0.67 5.02 -1.26 -4.58 118.16 116.09 1fug n LYS 372 Ca 0.00 -0.50 -0.13 0.00 -2.02 0.00 0.00 58.31 55.66 1fug n LYS 372 Cb 0.00 -1.22 -0.06 0.00 -0.02 0.00 0.00 35.03 33.73 1fug n LYS 372 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fug h ALA 373 N 3.50 -1.12 0.00 7.82 0.00 -1.82 -2.95 119.26 124.70 1fug h ALA 373 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fug h ALA 373 Cb 0.20 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1fug h ALA 373 CO 0.00 -1.05 0.00 0.37 0.00 0.00 0.00 179.25 178.57 1fug h GLN 374 N -0.91 0.00 0.00 0.00 4.15 -1.82 -0.81 115.11 115.72 1fug h GLN 374 Ca -0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1fug h GLN 374 Cb 0.64 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.33 1fug h GLN 374 CO 0.14 0.00 0.00 -0.11 -1.93 0.00 0.00 178.83 176.93 1fug n LEU 375 N -2.43 0.00 -0.08 -2.39 -0.00 -1.11 -2.06 117.00 108.94 1fug n LEU 375 Ca 0.01 0.14 -0.18 0.00 -0.00 0.00 0.00 56.01 55.98 1fug n LEU 375 Cb 0.19 -0.14 -0.13 0.00 -0.00 0.00 0.00 43.42 43.33 1fug n LEU 375 CO 0.19 -0.09 -1.12 0.18 -0.00 0.00 0.00 177.39 176.55 1fug n LEU 376 N -1.14 2.55 -0.12 -1.96 4.32 -0.31 -4.10 117.00 116.25 1fug n LEU 376 Ca 0.07 0.01 -0.13 0.00 -0.02 0.00 0.00 56.01 55.94 1fug n LEU 376 Cb 0.06 -0.83 -0.02 0.00 -1.62 0.00 0.00 43.42 41.01 1fug n LEU 376 CO 0.07 0.86 0.57 0.03 -1.22 0.00 0.00 177.39 177.69 1fug h ARG 377 N 0.02 0.93 0.00 3.23 3.08 -1.55 0.49 114.38 120.58 1fug h ARG 377 Ca -0.51 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.06 1fug h ARG 377 Cb 1.98 0.01 0.00 0.00 0.08 0.00 0.00 29.97 32.04 1fug h ARG 377 CO -0.01 1.13 0.00 -0.25 -1.07 0.00 0.00 179.97 179.77 1fug n ASP 378 N -4.09 0.27 -0.10 7.04 8.00 -1.17 -1.64 116.55 124.87 1fug n ASP 378 Ca -0.02 0.54 -0.15 0.00 0.71 0.00 0.00 54.79 55.87 1fug n ASP 378 Cb 0.52 -0.61 -0.14 0.00 -0.02 0.00 0.00 41.12 40.88 1fug n ASP 378 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fug n ALA 379 N -1.60 1.41 -3.20 2.24 0.00 0.76 -4.00 120.51 116.13 1fug n ALA 379 Ca 0.05 -1.12 -0.45 0.00 0.00 0.00 0.00 53.44 51.92 1fug n ALA 379 Cb 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 19.45 19.49 1fug n ALA 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fug s ALA 380 N -2.52 4.17 0.02 0.00 0.00 0.14 -4.74 121.76 118.84 1fug s ALA 380 Ca -0.22 -3.42 0.00 0.00 0.00 0.00 0.00 51.96 48.32 1fug s ALA 380 Cb 0.08 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1fug s ALA 380 CO 0.72 -2.46 0.00 0.41 0.00 0.00 0.00 175.76 174.43 1fug n GLY 381 N 3.82 -2.07 2.63 0.00 0.00 -1.26 -4.61 105.19 103.69 1fug n GLY 381 Ca 0.23 -1.42 -0.24 0.00 0.00 0.00 0.00 46.02 44.59 1fug n GLY 381 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fug n LEU 382 N 0.00 3.97 -0.71 0.99 4.77 -1.26 -4.10 117.00 120.66 1fug n LEU 382 Ca 0.00 -5.19 0.09 0.00 -0.03 0.00 0.00 56.01 50.88 1fug n LEU 382 Cb 0.05 -0.30 0.07 0.00 -2.33 0.00 0.00 43.42 40.91 1fug n LEU 382 CO 0.00 2.21 0.53 2.29 -1.33 0.00 0.00 177.39 181.09