#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x1c n LEU 2 N 0.00 3.87 -4.12 -0.89 7.94 -1.26 -4.85 117.00 117.68 2x1c n LEU 2 Ca 0.00 1.03 -0.33 0.00 -1.11 0.00 0.00 56.01 55.60 2x1c n LEU 2 Cb 0.00 -1.53 -0.16 0.00 0.53 0.00 0.00 43.42 42.26 2x1c n LEU 2 CO 0.00 0.10 -0.50 -2.28 -1.11 0.00 0.00 177.39 173.61 2x1c s HIS 3 N 1.85 2.94 -0.19 1.96 5.65 -1.26 -0.92 115.29 125.32 2x1c s HIS 3 Ca 0.79 -1.80 -0.03 0.00 0.25 0.00 0.00 55.06 54.27 2x1c s HIS 3 Cb -0.53 -1.94 -0.01 0.00 -1.18 0.00 0.00 32.58 28.92 2x1c s HIS 3 CO 0.36 -0.81 -0.05 0.42 -0.65 0.00 0.00 174.74 174.00 2x1c s ILE 4 N 1.25 3.44 -0.27 0.89 1.01 -0.27 -5.01 121.20 122.24 2x1c s ILE 4 Ca 0.01 -0.49 -0.21 0.00 0.00 0.00 0.00 60.65 59.97 2x1c s ILE 4 Cb -0.15 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.77 2x1c s ILE 4 CO -0.10 0.45 0.64 -0.22 0.00 0.00 0.00 174.94 175.72 2x1c s LEU 5 N 1.04 4.09 -0.11 2.97 2.96 -1.26 -1.09 118.68 127.28 2x1c s LEU 5 Ca 0.01 0.63 0.02 0.00 -0.22 0.00 0.00 54.13 54.57 2x1c s LEU 5 Cb -0.15 -2.86 -0.01 0.00 0.50 0.00 0.00 46.19 43.67 2x1c s LEU 5 CO -0.00 -0.42 -0.17 0.00 -1.32 0.00 0.00 176.35 174.44 2x1c s GLN 7 N 0.17 1.01 0.00 0.00 -2.07 -1.26 -0.82 119.66 116.69 2x1c s GLN 7 Ca -0.10 -0.69 0.00 0.00 -1.82 0.00 0.00 55.36 52.75 2x1c s GLN 7 Cb -0.16 0.44 0.00 0.00 -1.09 0.00 0.00 33.01 32.21 2x1c s GLN 7 CO 0.06 -0.38 0.00 0.41 -1.32 0.00 0.00 175.29 174.06 2x1c n GLY 8 N -0.09 0.32 3.81 2.60 0.00 -1.25 -4.13 105.19 106.44 2x1c n GLY 8 Ca -0.16 -1.84 -0.30 0.00 0.00 0.00 0.00 46.02 43.71 2x1c n GLY 8 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x1c s THR 9 N 0.00 3.34 0.24 2.61 -4.23 -1.26 -4.78 115.64 111.57 2x1c s THR 9 Ca 0.00 0.44 -0.04 0.00 -1.18 0.00 0.00 61.69 60.91 2x1c s THR 9 Cb 0.00 -3.18 0.21 0.00 1.34 0.00 0.00 72.50 70.87 2x1c s THR 9 CO 0.00 -0.57 1.78 -0.65 -0.54 0.00 0.00 174.62 174.64 2x1c h PRO 10 N -0.98 0.64 -0.49 3.99 0.11 -1.93 -0.06 132.00 133.27 2x1c h PRO 10 Ca -0.46 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 2x1c h PRO 10 Cb 1.25 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2x1c h PRO 10 CO 0.58 0.42 0.28 0.35 -0.21 0.00 0.00 178.00 179.42 2x1c h PHE 11 N 0.66 0.66 -0.66 0.65 3.04 -1.88 -1.29 116.94 118.11 2x1c h PHE 11 Ca 0.41 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.31 2x1c h PHE 11 Cb 0.48 -0.21 -0.03 0.00 2.56 0.00 0.00 35.95 38.74 2x1c h PHE 11 CO -0.09 0.48 0.26 0.93 -2.02 0.00 0.00 178.31 177.86 2x1c h GLU 12 N 0.65 0.98 -0.16 1.11 5.08 -1.67 1.00 114.58 121.56 2x1c h GLU 12 Ca 0.17 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2x1c h GLU 12 Cb 0.03 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2x1c h GLU 12 CO -0.03 0.80 0.07 0.82 -1.00 0.00 0.00 179.01 179.67 2x1c h ILE 13 N 0.96 1.14 -0.58 3.13 2.04 -0.79 -1.86 117.51 121.54 2x1c h ILE 13 Ca 0.22 -0.40 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 2x1c h ILE 13 Cb 0.20 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2x1c h ILE 13 CO -0.02 0.13 0.14 1.23 0.00 0.00 0.00 178.15 179.62 2x1c h GLY 14 N 0.12 1.01 1.02 5.37 0.00 -0.85 -2.68 103.07 107.06 2x1c h GLY 14 Ca 0.05 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 2x1c h GLY 14 CO -0.01 0.59 0.46 -1.82 0.00 0.00 0.00 176.54 175.77 2x1c h TYR 15 N 0.84 1.13 -0.26 5.60 3.20 -0.68 0.48 116.97 127.28 2x1c h TYR 15 Ca 0.18 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 2x1c h TYR 15 Cb 0.36 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2x1c h TYR 15 CO 0.03 0.78 0.11 1.49 -1.64 0.00 0.00 178.16 178.93 2x1c h GLU 16 N 1.15 0.38 0.16 1.82 4.57 -1.21 -0.05 114.58 121.39 2x1c h GLU 16 Ca 0.29 -0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.42 2x1c h GLU 16 Cb 0.02 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 2x1c h GLU 16 CO -0.05 0.40 -0.30 1.25 -1.18 0.00 0.00 179.01 179.13 2x1c h HIS 17 N 0.28 -0.81 -0.74 0.92 2.76 -1.21 -1.17 115.15 115.18 2x1c h HIS 17 Ca 0.09 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.24 2x1c h HIS 17 Cb 0.15 0.33 -0.03 0.00 1.55 0.00 0.00 27.41 29.41 2x1c h HIS 17 CO -0.01 -0.41 0.33 0.78 -1.30 0.00 0.00 177.93 177.32 2x1c h GLY 18 N -0.54 1.16 0.62 5.26 0.00 -0.78 -1.44 103.07 107.34 2x1c h GLY 18 Ca 0.02 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 2x1c h GLY 18 CO -0.15 0.56 -0.08 1.76 0.00 0.00 0.00 176.54 178.64 2x1c h SER 19 N 1.04 -0.18 0.12 0.19 0.02 -0.93 -1.68 113.55 112.14 2x1c h SER 19 Ca 0.25 -0.28 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 2x1c h SER 19 Cb 0.15 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2x1c h SER 19 CO -0.03 0.21 -0.25 0.00 -1.14 0.00 0.00 176.83 175.62 2x1c h ALA 20 N 0.16 1.36 -0.44 3.77 0.00 -1.20 -3.03 119.26 119.87 2x1c h ALA 20 Ca -0.02 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 2x1c h ALA 20 Cb 0.45 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2x1c h ALA 20 CO 0.04 0.45 0.02 0.00 0.00 0.00 0.00 179.25 179.76 2x1c n ALA 21 N -2.48 3.57 -0.15 0.00 0.00 -0.55 -4.79 120.51 116.11 2x1c n ALA 21 Ca -0.01 -2.19 -0.04 0.00 0.00 0.00 0.00 53.44 51.20 2x1c n ALA 21 Cb 0.35 -0.94 0.02 0.00 0.00 0.00 0.00 19.45 18.89 2x1c n ALA 21 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2x1c h LYS 22 N 2.78 -0.09 -0.32 0.00 3.64 -1.17 0.11 116.57 121.51 2x1c h LYS 22 Ca 0.03 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.33 2x1c h LYS 22 Cb 1.77 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.60 2x1c h LYS 22 CO 0.39 -0.06 -0.19 0.00 -2.27 0.00 0.00 179.45 177.32 2x1c h ALA 23 N 1.26 1.07 -0.36 5.00 0.00 -1.87 -2.36 119.26 121.99 2x1c h ALA 23 Ca 0.23 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2x1c h ALA 23 Cb 0.45 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2x1c h ALA 23 CO -0.55 0.57 -0.30 0.28 0.00 0.00 0.00 179.25 179.25 2x1c h VAL 24 N 0.53 1.28 -0.81 0.00 2.07 -1.47 -2.86 116.25 114.99 2x1c h VAL 24 Ca 0.08 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.11 2x1c h VAL 24 Cb 0.63 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.78 2x1c h VAL 24 CO 0.04 0.48 0.39 0.40 0.02 0.00 0.00 177.57 178.91 2x1c h ILE 25 N 0.64 1.25 -0.71 4.57 2.04 -0.70 -0.12 117.51 124.48 2x1c h ILE 25 Ca 0.06 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.28 2x1c h ILE 25 Cb 0.88 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 2x1c h ILE 25 CO 0.08 0.30 0.41 0.00 0.00 0.00 0.00 178.15 178.94 2x1c h ALA 26 N 1.27 0.96 -0.56 1.87 0.00 -1.32 -0.32 119.26 121.17 2x1c h ALA 26 Ca 0.28 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.10 2x1c h ALA 26 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2x1c h ALA 26 CO -0.04 0.09 -0.06 0.00 0.00 0.00 0.00 179.25 179.25 2x1c h ARG 27 N 0.74 1.01 -0.52 0.00 3.08 -1.13 -1.79 114.38 115.77 2x1c h ARG 27 Ca 0.32 -0.34 0.01 0.00 0.07 0.00 0.00 59.98 60.04 2x1c h ARG 27 Cb 0.20 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 2x1c h ARG 27 CO -0.19 1.02 0.34 0.77 -1.07 0.00 0.00 179.97 180.85 2x1c h SER 28 N 0.91 0.59 0.03 7.04 0.02 -0.34 -1.17 113.55 120.63 2x1c h SER 28 Ca 0.15 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2x1c h SER 28 Cb 0.61 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.00 2x1c h SER 28 CO 0.04 0.43 -0.02 0.40 -1.14 0.00 0.00 176.83 176.54 2x1c h ILE 29 N 0.70 1.15 -0.94 3.27 2.04 -0.96 -1.22 117.51 121.55 2x1c h ILE 29 Ca 0.19 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.52 2x1c h ILE 29 Cb -0.07 1.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 2x1c h ILE 29 CO -0.05 0.15 0.61 0.44 0.00 0.00 0.00 178.15 179.30 2x1c h ASP 30 N -0.30 1.00 -0.19 1.72 3.32 -1.23 0.64 116.42 121.39 2x1c h ASP 30 Ca -0.00 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2x1c h ASP 30 Cb 0.27 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2x1c h ASP 30 CO 0.01 0.68 -0.05 0.15 -1.72 0.00 0.00 179.24 178.31 2x1c h PHE 31 N 1.16 0.41 -0.70 4.55 3.57 -1.11 -1.39 116.94 123.43 2x1c h PHE 31 Ca 0.38 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.80 2x1c h PHE 31 Cb 0.05 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.65 2x1c h PHE 31 CO -0.00 0.63 0.46 0.00 -2.23 0.00 0.00 178.31 177.16 2x1c h ALA 32 N 0.72 0.89 -0.64 2.41 0.00 -0.61 -0.91 119.26 121.13 2x1c h ALA 32 Ca 0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 2x1c h ALA 32 Cb 0.50 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2x1c h ALA 32 CO 0.02 0.29 0.19 0.28 0.00 0.00 0.00 179.25 180.03 2x1c h VAL 33 N 0.93 1.25 -0.80 0.00 2.07 -0.86 -2.52 116.25 116.32 2x1c h VAL 33 Ca 0.26 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 2x1c h VAL 33 Cb -0.09 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 2x1c h VAL 33 CO -0.06 0.33 0.43 0.44 0.02 0.00 0.00 177.57 178.73 2x1c h ASP 34 N 0.92 1.01 -0.95 0.57 3.32 -0.91 -0.01 116.42 120.37 2x1c h ASP 34 Ca 0.20 -0.10 0.02 0.00 0.02 0.00 0.00 57.03 57.17 2x1c h ASP 34 Cb 0.31 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.55 2x1c h ASP 34 CO -0.00 0.82 0.63 0.25 -1.72 0.00 0.00 179.24 179.21 2x1c h LEU 35 N 1.11 1.06 0.02 1.55 5.85 -0.92 -2.91 115.31 121.07 2x1c h LEU 35 Ca 0.28 -0.02 -0.16 0.00 0.84 0.00 0.00 57.88 58.83 2x1c h LEU 35 Cb 0.05 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2x1c h LEU 35 CO -0.04 0.74 -0.85 0.40 -0.34 0.00 0.00 178.44 178.36 2x1c h ILE 36 N 1.24 1.24 -0.45 4.05 2.04 -1.19 -3.36 117.51 121.08 2x1c h ILE 36 Ca 0.37 -2.27 0.13 0.00 1.00 0.00 0.00 64.86 64.09 2x1c h ILE 36 Cb -0.06 2.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 2x1c h ILE 36 CO -0.10 0.47 0.36 0.03 0.00 0.00 0.00 178.15 178.91 2x1c h ARG 37 N -0.90 0.00 0.00 2.37 3.08 -1.07 0.11 114.38 117.97 2x1c h ARG 37 Ca -0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2x1c h ARG 37 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 2x1c h ARG 37 CO -0.10 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.21 2x1c n GLY 38 N -1.58 -0.90 0.00 0.04 0.00 -1.10 -4.11 105.19 97.55 2x1c n GLY 38 Ca 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2x1c n GLY 38 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x1c n LYS 39 N -1.07 1.03 -4.31 1.61 5.02 0.36 -5.12 118.16 115.68 2x1c n LYS 39 Ca 0.18 -0.05 -0.30 0.00 -2.02 0.00 0.00 58.31 56.12 2x1c n LYS 39 Cb 0.12 -0.32 -0.11 0.00 -0.02 0.00 0.00 35.03 34.70 2x1c n LYS 39 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2x1c s THR 40 N -0.16 3.00 -0.40 -0.18 -1.32 -1.05 -5.02 115.64 110.52 2x1c s THR 40 Ca 0.00 -1.40 0.23 0.00 -1.21 0.00 0.00 61.69 59.31 2x1c s THR 40 Cb 0.00 -2.37 0.25 0.00 -1.51 0.00 0.00 72.50 68.87 2x1c s THR 40 CO 0.00 0.13 1.47 0.11 -2.21 0.00 0.00 174.62 174.12 2x1c h LYS 41 N 3.78 0.00 -7.13 7.08 1.57 -1.94 -3.48 116.57 116.45 2x1c h LYS 41 Ca -0.49 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.81 2x1c h LYS 41 Cb 1.17 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.50 2x1c h LYS 41 CO 0.48 0.00 0.37 0.15 -0.57 0.00 0.00 179.45 179.88 2x1c s LYS 42 N -3.25 3.75 0.66 3.15 1.02 -1.26 -5.07 119.74 118.74 2x1c s LYS 42 Ca 0.05 1.20 -0.11 0.00 0.02 0.00 0.00 55.97 57.13 2x1c s LYS 42 Cb 0.06 -2.10 -0.02 0.00 -0.52 0.00 0.00 37.83 35.26 2x1c s LYS 42 CO 0.70 -0.45 1.06 0.95 -0.92 0.00 0.00 175.35 176.68 2x1c s THR 43 N -2.28 4.16 0.28 2.17 -4.23 -1.26 -4.94 115.64 109.53 2x1c s THR 43 Ca 0.64 0.69 -0.03 0.00 -1.18 0.00 0.00 61.69 61.81 2x1c s THR 43 Cb -0.14 -3.69 0.26 0.00 1.34 0.00 0.00 72.50 70.27 2x1c s THR 43 CO 0.26 -0.91 1.94 0.44 -0.54 0.00 0.00 174.62 175.81 2x1c h ASP 44 N -0.47 1.03 -0.74 3.99 3.32 -1.99 -1.82 116.42 119.74 2x1c h ASP 44 Ca -0.44 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.59 2x1c h ASP 44 Cb 1.22 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 40.48 2x1c h ASP 44 CO 0.63 0.73 0.47 -0.33 -1.72 0.00 0.00 179.24 179.02 2x1c h GLU 45 N 1.21 0.99 -0.39 3.56 3.07 -1.99 0.89 114.58 121.92 2x1c h GLU 45 Ca 0.34 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 59.05 2x1c h GLU 45 Cb -0.10 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 27.59 2x1c h GLU 45 CO -0.08 0.68 -0.05 1.49 -1.40 0.00 0.00 179.01 179.64 2x1c h GLU 46 N 1.01 0.72 -0.55 2.33 4.81 -1.87 -2.74 114.58 118.29 2x1c h GLU 46 Ca 0.27 -0.26 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 2x1c h GLU 46 Cb -0.08 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 2x1c h GLU 46 CO -0.05 0.85 0.06 -0.07 -0.73 0.00 0.00 179.01 179.07 2x1c h LEU 47 N 0.54 0.85 -0.96 1.64 3.38 -0.95 -1.91 115.31 117.89 2x1c h LEU 47 Ca 0.10 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.91 2x1c h LEU 47 Cb 0.55 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 2x1c h LEU 47 CO 0.03 0.87 0.63 0.50 0.09 0.00 0.00 178.44 180.57 2x1c h LYS 48 N 0.84 1.22 -0.74 1.13 1.63 -0.79 -1.22 116.57 118.65 2x1c h LYS 48 Ca 0.17 -0.07 -0.05 0.00 -0.85 0.00 0.00 60.65 59.85 2x1c h LYS 48 Cb 0.41 -0.28 -0.03 0.00 -0.60 0.00 0.00 32.23 31.73 2x1c h LYS 48 CO 0.01 0.81 0.28 0.37 -3.45 0.00 0.00 179.45 177.47 2x1c h GLN 49 N 1.26 1.10 -0.74 1.90 5.75 -1.10 0.03 115.11 123.31 2x1c h GLN 49 Ca 0.37 -0.20 -0.00 0.00 -0.15 0.00 0.00 58.65 58.66 2x1c h GLN 49 Cb -0.08 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.26 2x1c h GLN 49 CO -0.10 0.91 0.46 0.28 -2.65 0.00 0.00 178.83 177.73 2x1c h VAL 50 N 1.08 1.20 -0.34 2.39 2.07 -0.69 -1.90 116.25 120.06 2x1c h VAL 50 Ca 0.24 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 67.25 2x1c h VAL 50 Cb 0.23 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 2x1c h VAL 50 CO -0.02 0.21 -0.14 -0.07 0.02 0.00 0.00 177.57 177.58 2x1c h LEU 51 N 1.01 0.58 -0.56 2.57 3.38 -0.78 -1.38 115.31 120.12 2x1c h LEU 51 Ca 0.27 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2x1c h LEU 51 Cb -0.06 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2x1c h LEU 51 CO -0.05 0.74 0.33 -1.28 0.09 0.00 0.00 178.44 178.27 2x1c h SER 52 N 0.54 0.69 -0.47 -0.43 0.87 -0.61 0.08 113.55 114.22 2x1c h SER 52 Ca 0.09 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2x1c h SER 52 Cb 0.55 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 2x1c h SER 52 CO 0.03 0.56 0.19 1.56 -0.53 0.00 0.00 176.83 178.65 2x1c h GLN 53 N 0.76 0.69 -0.78 2.24 4.20 -0.88 -1.66 115.11 119.67 2x1c h GLN 53 Ca 0.20 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2x1c h GLN 53 Cb 0.01 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 2x1c h GLN 53 CO -0.04 0.62 0.32 -0.07 -0.67 0.00 0.00 178.83 178.99 2x1c h LEU 54 N 0.61 1.08 -0.86 1.46 3.38 -1.09 -2.46 115.31 117.42 2x1c h LEU 54 Ca 0.16 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2x1c h LEU 54 Cb 0.18 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2x1c h LEU 54 CO -0.01 0.95 0.30 1.23 0.09 0.00 0.00 178.44 181.00 2x1c h GLY 55 N 1.16 1.22 1.41 0.83 0.00 -0.82 -2.51 103.07 104.36 2x1c h GLY 55 Ca 0.26 -0.66 -0.08 0.00 0.00 0.00 0.00 47.33 46.85 2x1c h GLY 55 CO -0.02 0.62 -0.09 3.21 0.00 0.00 0.00 176.54 180.26 2x1c h ARG 56 N 1.11 0.70 -0.08 4.80 3.08 -1.06 -0.01 114.38 122.92 2x1c h ARG 56 Ca 0.26 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2x1c h ARG 56 Cb 0.21 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 2x1c h ARG 56 CO -0.02 0.78 0.04 0.28 -1.07 0.00 0.00 179.97 179.98 2x1c h VAL 57 N 0.65 1.00 -0.47 2.04 2.07 -1.23 -1.06 116.25 119.25 2x1c h VAL 57 Ca 0.12 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.57 2x1c h VAL 57 Cb 0.53 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2x1c h VAL 57 CO 0.03 0.02 0.17 0.40 0.02 0.00 0.00 177.57 178.20 2x1c h ILE 58 N 0.09 1.22 -0.59 4.57 2.04 -1.19 0.23 117.51 123.88 2x1c h ILE 58 Ca 0.03 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.25 2x1c h ILE 58 Cb 0.00 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 2x1c h ILE 58 CO -0.02 0.26 0.29 -0.08 0.00 0.00 0.00 178.15 178.60 2x1c h GLU 59 N 0.62 0.53 -0.05 2.37 4.81 -0.86 0.83 114.58 122.83 2x1c h GLU 59 Ca 0.15 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 2x1c h GLU 59 Cb 0.23 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.50 2x1c h GLU 59 CO -0.01 0.35 -0.44 0.93 -0.73 0.00 0.00 179.01 179.12 2x1c h GLU 60 N 0.55 0.38 0.20 1.92 5.08 -0.97 -3.31 114.58 118.43 2x1c h GLU 60 Ca 0.27 -0.34 -0.34 0.00 -1.00 0.00 0.00 59.36 57.94 2x1c h GLU 60 Cb 0.21 0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.55 2x1c h GLU 60 CO -0.20 1.00 -1.66 0.00 -1.00 0.00 0.00 179.01 177.15 2x1c h ARG 61 N -0.12 0.42 -2.09 2.33 3.08 -0.83 -3.40 114.38 113.77 2x1c h ARG 61 Ca -0.04 -0.71 -0.57 0.00 0.07 0.00 0.00 59.98 58.73 2x1c h ARG 61 Cb 1.11 0.26 -0.40 0.00 0.08 0.00 0.00 29.97 31.03 2x1c h ARG 61 CO 0.09 1.33 -0.91 0.91 -1.07 0.00 0.00 179.97 180.31 2x1c n TRP 62 N -3.61 1.38 0.10 3.04 8.01 0.27 -4.98 117.44 121.65 2x1c n TRP 62 Ca -0.22 -3.82 0.13 0.00 -1.31 0.00 0.00 57.50 52.28 2x1c n TRP 62 Cb 1.08 -0.44 0.62 0.00 -2.01 0.00 0.00 31.31 30.57 2x1c n TRP 62 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 2x1c h PRO 63 N 3.85 0.10 -0.42 -0.99 0.13 -1.65 -0.94 132.00 132.08 2x1c h PRO 63 Ca 0.12 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 65.12 2x1c h PRO 63 Cb 0.79 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 2x1c h PRO 63 CO 0.62 0.06 -0.25 0.87 -0.23 0.00 0.00 178.00 179.07 2x1c h LYS 64 N 0.10 0.87 -0.27 0.86 1.57 -1.91 -0.54 116.57 117.25 2x1c h LYS 64 Ca 0.14 -0.37 -0.14 0.00 -1.87 0.00 0.00 60.65 58.40 2x1c h LYS 64 Cb 0.44 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 2x1c h LYS 64 CO -0.01 1.02 -0.42 1.88 -0.57 0.00 0.00 179.45 181.34 2x1c h TYR 65 N 0.75 0.79 -0.71 -1.35 0.05 -1.57 -2.44 116.97 112.48 2x1c h TYR 65 Ca 0.09 -0.24 -0.06 0.00 0.05 0.00 0.00 58.73 58.58 2x1c h TYR 65 Cb 0.79 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 38.34 2x1c h TYR 65 CO 0.05 0.97 0.21 -0.92 -1.05 0.00 0.00 178.16 177.41 2x1c h TYR 66 N 0.53 1.16 -0.81 4.88 3.20 -1.07 -0.39 116.97 124.47 2x1c h TYR 66 Ca 0.04 -0.12 -0.03 0.00 3.14 0.00 0.00 58.73 61.76 2x1c h TYR 66 Cb 0.95 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 38.85 2x1c h TYR 66 CO 0.04 0.92 0.38 0.93 -1.64 0.00 0.00 178.16 178.80 2x1c h GLU 67 N 1.06 1.18 -0.59 1.82 4.39 -1.00 0.12 114.58 121.56 2x1c h GLU 67 Ca 0.23 -0.18 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 2x1c h GLU 67 Cb 0.32 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 2x1c h GLU 67 CO -0.01 0.91 0.19 1.49 -1.16 0.00 0.00 179.01 180.43 2x1c h GLU 68 N 1.16 0.91 -0.55 2.33 4.81 -1.12 -1.06 114.58 121.06 2x1c h GLU 68 Ca 0.28 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2x1c h GLU 68 Cb 0.13 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2x1c h GLU 68 CO -0.03 0.82 0.34 0.82 -0.73 0.00 0.00 179.01 180.22 2x1c h ILE 69 N 0.83 1.16 -0.89 2.32 2.04 -0.49 -0.13 117.51 122.35 2x1c h ILE 69 Ca 0.19 -0.34 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2x1c h ILE 69 Cb 0.28 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 2x1c h ILE 69 CO -0.01 0.16 0.59 0.03 0.00 0.00 0.00 178.15 178.92 2x1c h ARG 70 N 0.74 1.06 -0.38 2.37 3.08 -0.56 -1.22 114.38 119.47 2x1c h ARG 70 Ca 0.20 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.12 2x1c h ARG 70 Cb -0.04 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.76 2x1c h ARG 70 CO -0.04 0.70 -0.01 0.78 -1.07 0.00 0.00 179.97 180.33 2x1c h GLY 71 N 1.09 0.73 0.75 0.04 0.00 -0.46 -1.16 103.07 104.05 2x1c h GLY 71 Ca 0.36 -0.55 0.03 0.00 0.00 0.00 0.00 47.33 47.18 2x1c h GLY 71 CO -0.12 0.50 0.09 -2.22 0.00 0.00 0.00 176.54 174.79 2x1c h ILE 72 N 0.50 0.91 -0.43 2.60 2.04 -0.67 -0.86 117.51 121.60 2x1c h ILE 72 Ca 0.11 -0.07 0.05 0.00 1.00 0.00 0.00 64.86 65.94 2x1c h ILE 72 Cb 0.48 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 2x1c h ILE 72 CO 0.02 0.04 0.17 0.00 0.00 0.00 0.00 178.15 178.38 2x1c h ALA 73 N 1.18 0.52 -0.28 1.87 0.00 -0.97 -0.08 119.26 121.49 2x1c h ALA 73 Ca 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2x1c h ALA 73 Cb 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2x1c h ALA 73 CO -0.14 -0.21 0.08 -0.22 0.00 0.00 0.00 179.25 178.76 2x1c h LYS 74 N 0.35 0.44 -0.70 0.00 3.64 -0.97 -0.35 116.57 118.98 2x1c h LYS 74 Ca 0.20 -0.10 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 2x1c h LYS 74 Cb 0.16 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 2x1c h LYS 74 CO -0.18 0.51 0.16 0.78 -2.27 0.00 0.00 179.45 178.45 2x1c h GLY 75 N 0.29 1.21 0.81 5.01 0.00 -0.91 -2.66 103.07 106.82 2x1c h GLY 75 Ca 0.09 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.65 2x1c h GLY 75 CO -0.00 0.72 -0.06 0.00 0.00 0.00 0.00 176.54 177.20 2x1c n ALA 76 N -2.46 2.69 -3.72 3.60 0.00 -0.07 -3.53 120.51 117.03 2x1c n ALA 76 Ca 0.05 -0.26 -0.23 0.00 0.00 0.00 0.00 53.44 53.00 2x1c n ALA 76 Cb 0.27 -1.37 0.04 0.00 0.00 0.00 0.00 19.45 18.39 2x1c n ALA 76 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2x1c n GLU 77 N -0.85 -5.36 -4.50 0.00 1.02 -0.41 -4.95 120.64 105.59 2x1c n GLU 77 Ca 0.17 0.65 -0.24 0.00 -0.02 0.00 0.00 57.16 57.72 2x1c n GLU 77 Cb 0.25 -5.34 -0.10 0.00 -0.02 0.00 0.00 31.44 26.22 2x1c n GLU 77 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2x1c s ARG 78 N -6.09 1.72 0.43 3.49 1.81 -0.28 -5.04 118.95 114.99 2x1c s ARG 78 Ca 0.18 -1.89 -0.23 0.00 -1.72 0.00 0.00 55.73 52.07 2x1c s ARG 78 Cb -0.09 -1.44 -0.08 0.00 -0.45 0.00 0.00 34.95 32.89 2x1c s ARG 78 CO 0.80 0.06 1.09 -0.51 -0.68 0.00 0.00 175.30 176.06 2x1c s ASP 79 N -3.55 6.51 0.32 0.23 1.01 -1.26 -4.47 116.67 115.47 2x1c s ASP 79 Ca 0.32 2.11 0.05 0.00 0.71 0.00 0.00 52.55 55.74 2x1c s ASP 79 Cb 0.04 -2.59 0.70 0.00 1.01 0.00 0.00 42.92 42.08 2x1c s ASP 79 CO 0.15 -0.67 1.86 0.58 0.21 0.00 0.00 175.17 177.30 2x1c h VAL 80 N 2.01 0.88 -0.50 -1.27 2.07 -1.93 -1.58 116.25 115.92 2x1c h VAL 80 Ca -0.49 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 66.77 2x1c h VAL 80 Cb 1.23 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2x1c h VAL 80 CO 0.61 0.15 0.33 0.77 0.02 0.00 0.00 177.57 179.46 2x1c h SER 81 N 0.83 0.53 -0.38 0.57 4.64 -1.92 -0.19 113.55 117.63 2x1c h SER 81 Ca 0.46 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.66 2x1c h SER 81 Cb 0.60 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.54 2x1c h SER 81 CO -0.23 0.37 -0.19 -0.33 -0.87 0.00 0.00 176.83 175.59 2x1c h GLU 82 N 0.62 0.86 -0.21 4.77 5.08 -1.67 -0.53 114.58 123.49 2x1c h GLU 82 Ca 0.20 -0.34 -0.21 0.00 -1.00 0.00 0.00 59.36 58.01 2x1c h GLU 82 Cb 0.02 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.23 2x1c h GLU 82 CO -0.05 0.97 -0.67 0.82 -1.00 0.00 0.00 179.01 179.08 2x1c h ILE 83 N 0.75 1.28 -0.45 3.13 1.08 -1.28 -2.64 117.51 119.37 2x1c h ILE 83 Ca 0.11 -1.87 0.07 0.00 -0.39 0.00 0.00 64.86 62.79 2x1c h ILE 83 Cb 0.71 1.82 -0.06 0.00 -3.07 0.00 0.00 36.82 36.22 2x1c h ILE 83 CO 0.05 0.60 0.09 0.58 -0.69 0.00 0.00 178.15 178.79 2x1c h VAL 84 N 0.60 0.76 -0.55 1.67 2.07 -0.94 -2.13 116.25 117.72 2x1c h VAL 84 Ca -0.02 -0.08 0.10 0.00 0.82 0.00 0.00 66.70 67.52 2x1c h VAL 84 Cb 1.29 0.51 -0.08 0.00 -1.52 0.00 0.00 31.29 31.50 2x1c h VAL 84 CO 0.14 0.04 0.12 -0.03 0.02 0.00 0.00 177.57 177.86 2x1c h MET 85 N 0.23 0.25 -0.98 1.57 1.85 -0.98 -0.88 114.93 115.99 2x1c h MET 85 Ca 0.22 -0.01 0.02 0.00 -0.61 0.00 0.00 59.70 59.32 2x1c h MET 85 Cb 0.28 -0.06 -0.05 0.00 0.43 0.00 0.00 31.60 32.21 2x1c h MET 85 CO -0.29 0.16 0.65 -0.07 -0.40 0.00 0.00 176.91 176.96 2x1c h LEU 86 N 0.25 1.10 -0.03 3.39 3.38 -1.09 -2.31 115.31 120.00 2x1c h LEU 86 Ca 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2x1c h LEU 86 Cb 0.39 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2x1c h LEU 86 CO -0.36 0.78 -0.09 0.59 0.09 0.00 0.00 178.44 179.45 2x1c n ASN 87 N -4.43 0.13 -0.68 -0.43 3.02 -0.54 -3.67 115.26 108.66 2x1c n ASN 87 Ca 0.12 0.16 0.06 0.00 -0.03 0.00 0.00 54.58 54.89 2x1c n ASN 87 Cb 0.05 -0.30 0.12 0.00 -0.61 0.00 0.00 39.78 39.04 2x1c n ASN 87 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2x1c n THR 88 N -1.41 1.34 -0.20 3.41 -2.24 -0.45 -4.46 114.28 110.28 2x1c n THR 88 Ca 0.09 -2.09 0.01 0.00 -2.27 0.00 0.00 64.05 59.79 2x1c n THR 88 Cb 0.32 0.14 0.11 0.00 -2.10 0.00 0.00 70.33 68.80 2x1c n THR 88 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2x1c h ARG 89 N 0.65 0.20 -0.22 -0.78 2.43 -1.50 0.56 114.38 115.72 2x1c h ARG 89 Ca -0.05 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.15 2x1c h ARG 89 Cb 1.26 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.72 2x1c h ARG 89 CO 0.02 0.13 -0.08 1.15 -1.51 0.00 0.00 179.97 179.68 2x1c h THR 90 N 0.20 0.72 -0.21 0.20 2.02 -1.90 0.16 112.91 114.11 2x1c h THR 90 Ca 0.32 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.40 2x1c h THR 90 Cb 0.50 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.62 2x1c h THR 90 CO -0.45 0.00 -0.24 -0.33 0.37 0.00 0.00 175.52 174.87 2x1c h GLU 91 N -0.04 0.53 -0.44 6.66 3.07 -1.65 -2.93 114.58 119.78 2x1c h GLU 91 Ca 0.11 -0.29 -0.13 0.00 -0.50 0.00 0.00 59.36 58.55 2x1c h GLU 91 Cb 0.21 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 2x1c h GLU 91 CO -0.25 0.88 -0.24 0.35 -1.40 0.00 0.00 179.01 178.36 2x1c h PHE 92 N 0.20 1.08 -0.68 4.33 3.57 0.23 -3.02 116.94 122.65 2x1c h PHE 92 Ca 0.03 -0.28 -0.30 0.00 3.53 0.00 0.00 57.97 60.95 2x1c h PHE 92 Cb 0.80 -0.25 -0.18 0.00 2.79 0.00 0.00 35.95 39.12 2x1c h PHE 92 CO 0.08 1.08 0.38 0.00 -2.23 0.00 0.00 178.31 177.63 2x1c n ALA 93 N -2.51 4.55 -1.78 2.41 0.00 0.54 -4.97 120.51 118.75 2x1c n ALA 93 Ca -0.01 -2.02 -0.42 0.00 0.00 0.00 0.00 53.44 50.99 2x1c n ALA 93 Cb 0.46 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2x1c n ALA 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2x1c s TYR 94 N -2.47 1.73 0.00 0.00 5.04 -1.11 -2.84 117.35 117.70 2x1c s TYR 94 Ca 0.43 -0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.91 2x1c s TYR 94 Cb 0.35 -4.13 0.00 0.00 0.35 0.00 0.00 41.96 38.53 2x1c s TYR 94 CO 0.09 -4.89 0.00 0.41 -1.34 0.00 0.00 175.55 169.82 2x1c n GLY 95 N 4.33 1.44 2.89 8.97 0.00 -1.26 -5.08 105.19 116.48 2x1c n GLY 95 Ca 0.18 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 2x1c n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x1c s LEU 96 N 0.00 3.85 0.48 0.99 1.43 -1.13 -5.00 118.68 119.30 2x1c s LEU 96 Ca 0.00 -2.71 0.24 0.00 -1.03 0.00 0.00 54.13 50.63 2x1c s LEU 96 Cb 0.00 -1.44 1.21 0.00 0.03 0.00 0.00 46.19 45.99 2x1c s LEU 96 CO 0.00 -0.27 1.98 0.11 0.23 0.00 0.00 176.35 178.40 2x1c h LYS 97 N 6.81 0.00 0.00 1.70 1.57 -1.98 -1.38 116.57 123.29 2x1c h LYS 97 Ca -0.06 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 2x1c h LYS 97 Cb 0.93 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 2x1c h LYS 97 CO 0.60 0.19 -0.25 0.00 -0.57 0.00 0.00 179.45 179.42 2x1c h ALA 98 N 1.81 0.99 -0.07 3.86 0.00 -1.99 -3.26 119.26 120.61 2x1c h ALA 98 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2x1c h ALA 98 Cb 0.47 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2x1c h ALA 98 CO 0.02 0.31 0.01 0.00 0.00 0.00 0.00 179.25 179.59 2x1c n ALA 99 N -2.23 2.68 -2.68 0.00 0.00 -0.52 -4.94 120.51 112.82 2x1c n ALA 99 Ca 0.00 -0.23 -0.37 0.00 0.00 0.00 0.00 53.44 52.84 2x1c n ALA 99 Cb 0.46 -1.02 -0.07 0.00 0.00 0.00 0.00 19.45 18.82 2x1c n ALA 99 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2x1c s ARG 100 N -1.10 4.12 0.75 0.00 0.52 -1.23 -5.08 118.95 116.92 2x1c s ARG 100 Ca 0.06 0.21 -0.08 0.00 -0.52 0.00 0.00 55.73 55.41 2x1c s ARG 100 Cb 0.05 -3.36 0.08 0.00 0.52 0.00 0.00 34.95 32.24 2x1c s ARG 100 CO 0.02 0.38 1.07 0.16 0.02 0.00 0.00 175.30 176.94 2x1c s ASP 101 N 0.01 4.55 0.27 0.23 -4.77 -1.26 -4.92 116.67 110.77 2x1c s ASP 101 Ca 0.20 0.41 0.03 0.00 -3.30 0.00 0.00 52.55 49.88 2x1c s ASP 101 Cb -0.14 -0.95 -0.04 0.00 -1.09 0.00 0.00 42.92 40.70 2x1c s ASP 101 CO 0.07 -1.79 0.18 -0.83 0.70 0.00 0.00 175.17 173.51 2x1c s GLY 102 N -4.58 1.87 -0.10 2.12 0.00 0.15 -4.62 107.32 102.16 2x1c s GLY 102 Ca 0.62 -1.83 -0.30 0.00 0.00 0.00 0.00 44.72 43.21 2x1c s GLY 102 CO 0.46 -1.48 0.97 0.00 0.00 0.00 0.00 173.10 173.05 2x1c s ALA 103 N -3.79 -1.90 -0.08 3.20 0.00 -1.26 -1.11 121.76 116.82 2x1c s ALA 103 Ca 0.39 1.36 0.02 0.00 0.00 0.00 0.00 51.96 53.73 2x1c s ALA 103 Cb 0.05 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.96 2x1c s ALA 103 CO 0.18 -0.48 -0.15 0.99 0.00 0.00 0.00 175.76 176.31 2x1c s THR 104 N -1.99 1.33 0.02 0.00 2.01 -1.01 -4.21 115.64 111.79 2x1c s THR 104 Ca 0.02 -0.59 0.02 0.00 0.31 0.00 0.00 61.69 61.45 2x1c s THR 104 Cb -0.01 -1.20 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 2x1c s THR 104 CO -0.03 0.40 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.33 2x1c s THR 105 N 0.65 0.58 -0.03 -0.82 2.01 0.31 -1.56 115.64 116.78 2x1c s THR 105 Ca -0.14 -0.70 -0.12 0.00 0.31 0.00 0.00 61.69 61.03 2x1c s THR 105 Cb -0.16 -0.56 0.02 0.00 0.01 0.00 0.00 72.50 71.81 2x1c s THR 105 CO 0.04 -0.11 0.27 0.00 -0.69 0.00 0.00 174.62 174.13 2x1c s ALA 106 N -0.76 -0.67 -0.03 7.40 0.00 -0.40 -0.93 121.76 126.37 2x1c s ALA 106 Ca -0.03 0.32 0.03 0.00 0.00 0.00 0.00 51.96 52.29 2x1c s ALA 106 Cb -0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 2x1c s ALA 106 CO 0.00 -0.22 -0.13 -0.47 0.00 0.00 0.00 175.76 174.94 2x1c s TYR 107 N -1.04 1.27 -0.10 0.00 6.14 -0.00 -1.19 117.35 122.44 2x1c s TYR 107 Ca -0.11 -0.33 -0.01 0.00 0.64 0.00 0.00 57.07 57.26 2x1c s TYR 107 Cb -0.05 -0.87 0.03 0.00 0.42 0.00 0.00 41.96 41.48 2x1c s TYR 107 CO 0.03 -0.12 -0.06 0.00 0.64 0.00 0.00 175.55 176.04 2x1c s GLN 109 N 1.73 4.61 0.01 0.00 2.00 0.09 -1.60 119.66 126.49 2x1c s GLN 109 Ca 0.04 1.67 -0.08 0.00 -2.00 0.00 0.00 55.36 55.00 2x1c s GLN 109 Cb -0.13 -3.30 0.00 0.00 0.80 0.00 0.00 33.01 30.39 2x1c s GLN 109 CO -0.07 0.09 0.15 -0.51 -0.50 0.00 0.00 175.29 174.45 2x1c s LEU 110 N -0.24 1.50 0.58 3.68 1.43 -1.26 -4.90 118.68 119.47 2x1c s LEU 110 Ca 0.49 -0.22 0.37 0.00 -1.03 0.00 0.00 54.13 53.74 2x1c s LEU 110 Cb -0.28 0.74 1.67 0.00 0.03 0.00 0.00 46.19 48.35 2x1c s LEU 110 CO 0.34 -0.40 2.10 1.55 0.23 0.00 0.00 176.35 180.17 2x1c h PRO 111 N 4.14 0.00 -0.42 1.29 0.13 -1.98 -1.91 132.00 133.26 2x1c h PRO 111 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2x1c h PRO 111 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2x1c h PRO 111 CO 0.42 0.01 0.00 0.27 -0.23 0.00 0.00 178.00 178.46 2x1c n ASN 112 N -3.10 4.34 0.00 1.44 0.23 -1.26 -5.03 115.26 111.88 2x1c n ASN 112 Ca -0.01 -2.75 0.00 0.00 -0.53 0.00 0.00 54.58 51.29 2x1c n ASN 112 Cb 0.24 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.40 2x1c n ASN 112 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x1c n GLY 113 N 0.19 3.99 3.76 4.83 0.00 -0.72 -4.79 105.19 112.45 2x1c n GLY 113 Ca 0.22 -1.27 -0.35 0.00 0.00 0.00 0.00 46.02 44.63 2x1c n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x1c s ALA 114 N -0.01 2.56 -0.02 4.61 0.00 -1.26 -4.26 121.76 123.40 2x1c s ALA 114 Ca 0.00 0.80 0.07 0.00 0.00 0.00 0.00 51.96 52.84 2x1c s ALA 114 Cb 0.00 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 2x1c s ALA 114 CO 0.00 -1.07 -0.24 -0.51 0.00 0.00 0.00 175.76 173.94 2x1c s LEU 115 N -4.23 2.05 -0.01 0.00 1.43 -0.63 -2.43 118.68 114.87 2x1c s LEU 115 Ca 0.72 -0.44 -0.03 0.00 -1.03 0.00 0.00 54.13 53.35 2x1c s LEU 115 Cb -0.25 -1.25 -0.00 0.00 0.03 0.00 0.00 46.19 44.72 2x1c s LEU 115 CO 0.33 0.30 0.07 -1.58 0.23 0.00 0.00 176.35 175.70 2x1c s GLN 116 N -0.59 0.23 0.11 1.70 0.74 -1.02 -0.62 119.66 120.21 2x1c s GLN 116 Ca 0.09 -0.18 -0.25 0.00 0.05 0.00 0.00 55.36 55.07 2x1c s GLN 116 Cb -0.09 0.10 0.08 0.00 1.10 0.00 0.00 33.01 34.20 2x1c s GLN 116 CO -0.01 -0.04 1.09 0.20 -0.55 0.00 0.00 175.29 175.98 2x1c s GLY 117 N -0.64 -0.13 0.13 2.59 0.00 -0.33 0.82 107.32 109.75 2x1c s GLY 117 Ca -0.07 0.06 -0.22 0.00 0.00 0.00 0.00 44.72 44.50 2x1c s GLY 117 CO 0.00 1.53 0.55 -0.86 0.00 0.00 0.00 173.10 174.32 2x1c s GLN 118 N -2.55 1.19 -0.06 2.90 -2.07 -0.67 -1.27 119.66 117.12 2x1c s GLN 118 Ca 0.18 -0.46 -0.04 0.00 -1.82 0.00 0.00 55.36 53.22 2x1c s GLN 118 Cb -0.00 0.54 -0.04 0.00 -1.09 0.00 0.00 33.01 32.42 2x1c s GLN 118 CO 0.02 -0.49 0.14 -0.80 -1.32 0.00 0.00 175.29 172.83 2x1c s ASN 119 N -2.59 6.17 -0.13 12.60 0.01 -0.60 -1.45 114.94 128.95 2x1c s ASN 119 Ca 0.00 0.35 0.02 0.00 -0.71 0.00 0.00 52.86 52.52 2x1c s ASN 119 Cb -0.00 -1.92 0.00 0.00 0.41 0.00 0.00 41.25 39.73 2x1c s ASN 119 CO -0.10 0.33 -0.21 0.86 -1.51 0.00 0.00 177.10 176.47 2x1c s TRP 120 N -1.16 2.66 -0.09 2.20 -0.00 -0.60 -2.41 118.94 119.54 2x1c s TRP 120 Ca 0.21 -1.10 0.04 0.00 -0.00 0.00 0.00 56.10 55.24 2x1c s TRP 120 Cb -0.12 -1.79 -0.00 0.00 -0.00 0.00 0.00 33.47 31.56 2x1c s TRP 120 CO 0.11 -0.47 -0.23 -0.51 -0.00 0.00 0.00 176.95 175.85 2x1c s ASP 121 N 0.58 3.18 0.00 5.86 1.01 -0.27 -0.59 116.67 126.44 2x1c s ASP 121 Ca -0.12 -0.52 0.00 0.00 0.71 0.00 0.00 52.55 52.62 2x1c s ASP 121 Cb -0.16 -1.30 0.00 0.00 1.01 0.00 0.00 42.92 42.47 2x1c s ASP 121 CO 0.03 0.18 0.00 0.33 0.21 0.00 0.00 175.17 175.93 2x1c n PHE 122 N 3.38 -0.73 -2.09 4.23 7.35 -0.67 -0.67 117.46 128.27 2x1c n PHE 122 Ca -0.19 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.10 2x1c n PHE 122 Cb 0.53 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.34 2x1c n PHE 122 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2x1c s PHE 123 N -7.15 3.04 0.56 -5.13 0.08 -1.26 -1.31 117.98 106.81 2x1c s PHE 123 Ca 0.00 1.28 0.24 0.00 0.12 0.00 0.00 56.93 58.57 2x1c s PHE 123 Cb 0.00 -3.72 1.57 0.00 -0.57 0.00 0.00 43.02 40.29 2x1c s PHE 123 CO 0.00 -2.12 2.18 0.77 -0.10 0.00 0.00 175.22 175.95 2x1c h SER 124 N 4.02 0.00 -0.01 1.36 0.02 -1.90 -1.60 113.55 115.44 2x1c h SER 124 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 2x1c h SER 124 Cb 1.22 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.76 2x1c h SER 124 CO 0.70 0.00 0.01 0.00 -1.14 0.00 0.00 176.83 176.40 2x1c h ALA 125 N 1.95 1.42 0.00 3.77 0.00 -1.96 -1.70 119.26 122.73 2x1c h ALA 125 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2x1c h ALA 125 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2x1c h ALA 125 CO -0.00 -0.02 -0.25 1.79 0.00 0.00 0.00 179.25 180.77 2x1c h THR 126 N 0.00 0.00 -0.78 0.00 1.35 -1.67 -3.36 112.91 108.45 2x1c h THR 126 Ca 0.00 -0.68 0.09 0.00 -0.55 0.00 0.00 66.41 65.27 2x1c h THR 126 Cb 0.03 1.53 -0.07 0.00 -1.73 0.00 0.00 68.15 67.92 2x1c h THR 126 CO -0.00 0.00 0.44 0.50 -0.25 0.00 0.00 175.52 176.21 2x1c h LYS 127 N 0.00 0.72 0.00 4.72 3.64 -1.44 -0.11 116.57 124.10 2x1c h LYS 127 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2x1c h LYS 127 Cb 0.84 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 2x1c h LYS 127 CO 0.00 0.48 0.00 -0.85 -2.27 0.00 0.00 179.45 176.81 2x1c n GLU 128 N -4.77 0.00 0.00 1.90 0.28 -1.26 -2.23 120.64 114.57 2x1c n GLU 128 Ca 0.12 0.24 0.12 0.00 -0.16 0.00 0.00 57.16 57.48 2x1c n GLU 128 Cb 0.26 -1.50 0.14 0.00 1.43 0.00 0.00 31.44 31.77 2x1c n GLU 128 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2x1c n ASN 129 N -1.51 2.45 -4.72 -1.84 3.02 -0.07 -4.93 115.26 107.67 2x1c n ASN 129 Ca 0.04 -1.75 -0.42 0.00 -0.03 0.00 0.00 54.58 52.42 2x1c n ASN 129 Cb 0.18 0.13 -0.03 0.00 -0.61 0.00 0.00 39.78 39.45 2x1c n ASN 129 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2x1c s LEU 130 N -2.15 4.39 0.30 3.41 1.43 -0.95 -1.28 118.68 123.83 2x1c s LEU 130 Ca 0.27 2.04 0.02 0.00 -1.03 0.00 0.00 54.13 55.43 2x1c s LEU 130 Cb 0.20 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.78 2x1c s LEU 130 CO 0.39 -0.43 0.11 0.27 0.23 0.00 0.00 176.35 176.92 2x1c s ILE 131 N 0.77 0.61 0.06 -0.59 -4.36 0.48 -4.62 121.20 113.56 2x1c s ILE 131 Ca 0.57 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 59.02 2x1c s ILE 131 Cb -0.30 -2.60 -0.03 0.00 1.25 0.00 0.00 42.46 40.78 2x1c s ILE 131 CO 0.31 0.00 -0.16 0.00 0.24 0.00 0.00 174.94 175.33 2x1c s ARG 132 N -3.92 0.99 0.01 0.37 1.70 -0.10 -1.48 118.95 116.52 2x1c s ARG 132 Ca 0.36 -0.92 0.08 0.00 -0.47 0.00 0.00 55.73 54.78 2x1c s ARG 132 Cb 0.07 -1.06 -0.02 0.00 -0.57 0.00 0.00 34.95 33.37 2x1c s ARG 132 CO 0.15 0.25 -0.25 -0.51 -1.08 0.00 0.00 175.30 173.87 2x1c s LEU 133 N -1.48 2.11 -0.24 -1.89 1.43 -0.68 -1.12 118.68 116.81 2x1c s LEU 133 Ca 0.02 -0.51 -0.05 0.00 -1.03 0.00 0.00 54.13 52.57 2x1c s LEU 133 Cb -0.09 -1.23 -0.00 0.00 0.03 0.00 0.00 46.19 44.90 2x1c s LEU 133 CO 0.02 0.27 -0.00 -0.89 0.23 0.00 0.00 176.35 175.97 2x1c s THR 134 N -0.69 3.57 -0.21 5.49 2.01 -0.25 -1.97 115.64 123.59 2x1c s THR 134 Ca 0.10 -0.56 -0.03 0.00 0.31 0.00 0.00 61.69 61.52 2x1c s THR 134 Cb -0.10 -2.70 -0.00 0.00 0.01 0.00 0.00 72.50 69.71 2x1c s THR 134 CO 0.01 0.31 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.53 2x1c s ILE 135 N 1.48 3.08 -0.22 1.82 1.01 0.10 -0.18 121.20 128.29 2x1c s ILE 135 Ca 0.04 -0.60 -0.07 0.00 0.00 0.00 0.00 60.65 60.03 2x1c s ILE 135 Cb -0.15 -2.38 -0.03 0.00 0.01 0.00 0.00 42.46 39.91 2x1c s ILE 135 CO -0.01 0.45 0.05 -0.13 0.00 0.00 0.00 174.94 175.30 2x1c s ARG 136 N 1.40 3.75 -0.09 2.79 0.52 0.00 -1.56 118.95 125.76 2x1c s ARG 136 Ca 0.05 -0.45 -0.00 0.00 -0.52 0.00 0.00 55.73 54.81 2x1c s ARG 136 Cb -0.14 -3.24 0.02 0.00 0.52 0.00 0.00 34.95 32.11 2x1c s ARG 136 CO -0.05 -0.00 -0.07 -0.65 0.02 0.00 0.00 175.30 174.55 2x1c s GLN 137 N 1.10 1.35 -0.02 3.54 -0.21 -1.26 -3.80 119.66 120.35 2x1c s GLN 137 Ca 0.04 -0.21 -0.36 0.00 0.02 0.00 0.00 55.36 54.85 2x1c s GLN 137 Cb -0.14 -1.40 -0.14 0.00 1.00 0.00 0.00 33.01 32.33 2x1c s GLN 137 CO 0.03 -0.21 1.66 0.00 -2.12 0.00 0.00 175.29 174.65 2x1c n ALA 138 N 4.72 0.43 -0.65 6.09 0.00 -1.26 -1.25 120.51 128.58 2x1c n ALA 138 Ca -0.14 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2x1c n ALA 138 Cb 0.50 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.63 2x1c n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x1c n GLY 139 N 3.72 1.07 3.52 0.00 0.00 -0.55 -4.92 105.19 108.03 2x1c n GLY 139 Ca 0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 2x1c n GLY 139 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x1c s LEU 140 N 0.00 2.79 0.38 0.99 1.43 -0.38 -4.91 118.68 118.98 2x1c s LEU 140 Ca 0.00 -0.68 -0.27 0.00 -1.03 0.00 0.00 54.13 52.16 2x1c s LEU 140 Cb 0.00 -1.49 -0.11 0.00 0.03 0.00 0.00 46.19 44.62 2x1c s LEU 140 CO 0.00 0.11 1.26 -2.65 0.23 0.00 0.00 176.35 175.30 2x1c n PRO 141 N 0.11 2.00 -2.33 1.29 -0.02 -1.26 -3.82 135.00 130.96 2x1c n PRO 141 Ca -0.11 0.70 -0.41 0.00 -2.02 0.00 0.00 63.50 61.67 2x1c n PRO 141 Cb 0.56 -2.33 -0.03 0.00 -0.02 0.00 0.00 33.50 31.67 2x1c n PRO 141 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2x1c s THR 142 N -1.15 3.24 -0.06 3.45 2.01 -1.26 -4.67 115.64 117.19 2x1c s THR 142 Ca 0.58 1.20 0.04 0.00 0.31 0.00 0.00 61.69 63.82 2x1c s THR 142 Cb -0.54 -3.77 -0.02 0.00 0.01 0.00 0.00 72.50 68.18 2x1c s THR 142 CO 0.60 0.27 -0.17 -0.63 -0.69 0.00 0.00 174.62 174.00 2x1c s ILE 143 N -0.93 2.82 -0.13 1.82 1.01 -0.60 -0.90 121.20 124.28 2x1c s ILE 143 Ca 0.48 -0.80 -0.00 0.00 0.00 0.00 0.00 60.65 60.32 2x1c s ILE 143 Cb -0.35 -2.09 0.03 0.00 0.01 0.00 0.00 42.46 40.05 2x1c s ILE 143 CO 0.44 0.58 -0.10 -0.54 0.00 0.00 0.00 174.94 175.32 2x1c s LYS 144 N -0.49 1.83 0.05 2.79 1.02 -0.23 -0.72 119.74 124.00 2x1c s LYS 144 Ca 0.06 -0.41 -0.09 0.00 0.02 0.00 0.00 55.97 55.56 2x1c s LYS 144 Cb -0.12 -1.84 -0.00 0.00 -0.52 0.00 0.00 37.83 35.35 2x1c s LYS 144 CO 0.01 -0.27 0.18 -0.59 -0.92 0.00 0.00 175.35 173.76 2x1c s PHE 145 N 1.61 0.11 -0.15 3.18 -0.71 -0.83 -0.92 117.98 120.26 2x1c s PHE 145 Ca 0.04 -0.40 -0.09 0.00 -1.04 0.00 0.00 56.93 55.44 2x1c s PHE 145 Cb -0.13 -0.06 -0.05 0.00 -1.21 0.00 0.00 43.02 41.58 2x1c s PHE 145 CO -0.09 -0.46 0.16 0.42 -1.34 0.00 0.00 175.22 173.91 2x1c s ILE 146 N -2.98 5.43 0.08 -4.49 -1.09 0.27 -1.68 121.20 116.74 2x1c s ILE 146 Ca -0.02 0.26 -0.14 0.00 -2.23 0.00 0.00 60.65 58.52 2x1c s ILE 146 Cb 0.01 -3.46 0.02 0.00 -1.58 0.00 0.00 42.46 37.45 2x1c s ILE 146 CO -0.06 0.52 0.32 0.28 -1.23 0.00 0.00 174.94 174.77 2x1c s THR 147 N -0.31 0.09 0.25 2.92 -1.32 -0.55 -2.66 115.64 114.06 2x1c s THR 147 Ca 0.12 -0.75 -0.30 0.00 -1.21 0.00 0.00 61.69 59.56 2x1c s THR 147 Cb -0.12 -1.12 -0.09 0.00 -1.51 0.00 0.00 72.50 69.66 2x1c s THR 147 CO 0.02 -0.41 1.22 -1.61 -2.21 0.00 0.00 174.62 171.62 2x1c s GLU 148 N -3.30 4.48 0.25 7.08 2.02 -1.26 -0.39 118.70 127.59 2x1c s GLU 148 Ca 0.00 1.97 -0.31 0.00 0.02 0.00 0.00 54.97 56.66 2x1c s GLU 148 Cb 0.02 -3.17 -0.13 0.00 0.10 0.00 0.00 34.13 30.95 2x1c s GLU 148 CO -0.08 -0.05 1.53 0.00 0.02 0.00 0.00 175.26 176.67 2x1c n ALA 149 N 1.69 1.88 0.00 5.21 0.00 -0.40 -2.51 120.51 126.38 2x1c n ALA 149 Ca 0.02 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2x1c n ALA 149 Cb 0.44 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.51 2x1c n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x1c n GLY 150 N 2.39 0.83 3.80 0.00 0.00 -1.26 -4.68 105.19 106.27 2x1c n GLY 150 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2x1c n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x1c s ILE 151 N -2.12 5.36 -1.62 -0.61 1.01 -1.04 -4.74 121.20 117.42 2x1c s ILE 151 Ca 0.00 0.40 0.27 0.00 0.00 0.00 0.00 60.65 61.31 2x1c s ILE 151 Cb 0.00 -3.52 0.28 0.00 0.01 0.00 0.00 42.46 39.22 2x1c s ILE 151 CO 0.00 0.52 1.62 2.30 0.00 0.00 0.00 174.94 179.38 2x1c n ILE 152 N 2.66 0.00 -3.64 2.92 -5.35 -1.26 -4.85 119.36 109.84 2x1c n ILE 152 Ca -0.16 -0.09 -0.05 0.00 -0.27 0.00 0.00 62.75 62.17 2x1c n ILE 152 Cb 0.53 0.25 -0.06 0.00 -1.74 0.00 0.00 39.64 38.62 2x1c n ILE 152 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2x1c s GLY 153 N -2.57 -0.61 0.00 3.28 0.00 -1.26 -4.75 107.32 101.42 2x1c s GLY 153 Ca 0.23 2.47 0.00 0.00 0.00 0.00 0.00 44.72 47.43 2x1c s GLY 153 CO 0.53 2.59 0.00 1.17 0.00 0.00 0.00 173.10 177.39 2x1c n LYS 154 N 4.55 0.00 -4.09 2.90 3.00 -1.26 -4.72 118.16 118.53 2x1c n LYS 154 Ca -0.18 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.81 2x1c n LYS 154 Cb 0.56 0.00 -0.16 0.00 0.00 0.00 0.00 35.03 35.43 2x1c n LYS 154 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2x1c s VAL 155 N 1.92 1.96 -1.53 3.15 1.01 -1.09 -4.82 120.40 121.00 2x1c s VAL 155 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.08 2x1c s VAL 155 Cb 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 36.38 34.59 2x1c s VAL 155 CO 0.00 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2x1c n GLY 156 N 4.65 -0.56 3.40 4.51 0.00 -1.09 -0.57 105.19 115.53 2x1c n GLY 156 Ca -0.20 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 2x1c n GLY 156 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x1c s PHE 157 N -3.12 0.89 0.32 1.61 -0.71 -0.10 -0.35 117.98 116.52 2x1c s PHE 157 Ca 0.00 -1.15 0.03 0.00 -1.04 0.00 0.00 56.93 54.77 2x1c s PHE 157 Cb 0.00 -0.21 -0.05 0.00 -1.21 0.00 0.00 43.02 41.55 2x1c s PHE 157 CO 0.00 -0.88 0.10 0.54 -1.34 0.00 0.00 175.22 173.64 2x1c s ASN 158 N -3.14 1.99 0.24 1.98 2.20 -0.21 -1.07 114.94 116.93 2x1c s ASN 158 Ca 0.32 -1.46 0.22 0.00 -0.94 0.00 0.00 52.86 50.99 2x1c s ASN 158 Cb 0.03 0.17 0.96 0.00 -2.00 0.00 0.00 41.25 40.41 2x1c s ASN 158 CO 0.14 -0.75 1.67 -1.54 -2.94 0.00 0.00 177.10 173.68 2x1c n SER 159 N -0.78 0.59 -0.23 3.54 3.41 -0.08 -1.12 113.62 118.96 2x1c n SER 159 Ca -0.02 0.66 0.14 0.00 -0.26 0.00 0.00 58.87 59.39 2x1c n SER 159 Cb 0.66 -0.78 0.57 0.00 -0.26 0.00 0.00 64.21 64.39 2x1c n SER 159 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x1c n ALA 160 N -1.75 2.78 -0.41 7.33 0.00 -1.26 -4.92 120.51 122.28 2x1c n ALA 160 Ca 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2x1c n ALA 160 Cb 0.20 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2x1c n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x1c n GLY 161 N 1.24 0.75 3.69 0.00 0.00 -0.27 -4.88 105.19 105.70 2x1c n GLY 161 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2x1c n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x1c s VAL 162 N -2.46 4.40 -0.04 1.61 1.01 -1.26 -4.29 120.40 119.37 2x1c s VAL 162 Ca 0.00 1.70 0.06 0.00 0.00 0.00 0.00 61.98 63.75 2x1c s VAL 162 Cb 0.00 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.27 2x1c s VAL 162 CO 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 175.10 174.86 2x1c s ALA 163 N 2.15 2.01 -0.05 5.51 0.00 0.42 -1.05 121.76 130.76 2x1c s ALA 163 Ca 0.54 -0.99 0.05 0.00 0.00 0.00 0.00 51.96 51.55 2x1c s ALA 163 Cb -0.23 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 2x1c s ALA 163 CO 0.21 0.42 -0.19 0.08 0.00 0.00 0.00 175.76 176.28 2x1c s VAL 164 N -0.28 1.57 0.17 0.00 1.01 0.52 -1.09 120.40 122.30 2x1c s VAL 164 Ca 0.01 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.27 2x1c s VAL 164 Cb -0.12 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2x1c s VAL 164 CO 0.02 0.45 -0.17 0.20 0.00 0.00 0.00 175.10 175.59 2x1c s ASN 165 N -0.03 2.60 -0.04 3.32 -0.87 -0.25 -2.67 114.94 117.00 2x1c s ASN 165 Ca -0.03 -0.88 0.03 0.00 -1.57 0.00 0.00 52.86 50.40 2x1c s ASN 165 Cb -0.12 -0.15 0.01 0.00 -0.02 0.00 0.00 41.25 40.97 2x1c s ASN 165 CO 0.02 -0.07 -0.11 -0.47 -2.57 0.00 0.00 177.10 173.91 2x1c s TYR 166 N -2.21 1.18 -0.04 2.20 5.04 -1.26 -1.25 117.35 121.01 2x1c s TYR 166 Ca 0.16 -0.34 0.02 0.00 -2.44 0.00 0.00 57.07 54.47 2x1c s TYR 166 Cb -0.05 -0.85 0.01 0.00 0.35 0.00 0.00 41.96 41.42 2x1c s TYR 166 CO 0.06 -0.16 -0.08 -0.80 -1.34 0.00 0.00 175.55 173.23 2x1c s ASN 167 N 0.33 1.24 0.36 4.32 -0.87 -0.32 -4.85 114.94 115.15 2x1c s ASN 167 Ca -0.07 -0.19 -0.28 0.00 -1.57 0.00 0.00 52.86 50.75 2x1c s ASN 167 Cb -0.11 -0.45 -0.12 0.00 -0.02 0.00 0.00 41.25 40.55 2x1c s ASN 167 CO 0.01 0.03 1.35 0.00 -2.57 0.00 0.00 177.10 175.92 2x1c n ALA 168 N 3.57 1.61 -2.94 0.60 0.00 -1.26 -0.89 120.51 121.20 2x1c n ALA 168 Ca -0.21 0.35 -0.10 0.00 0.00 0.00 0.00 53.44 53.48 2x1c n ALA 168 Cb 0.53 -2.30 -0.11 0.00 0.00 0.00 0.00 19.45 17.56 2x1c n ALA 168 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2x1c s LEU 169 N -1.36 2.21 -0.36 0.00 2.96 -1.26 -4.44 118.68 116.44 2x1c s LEU 169 Ca 0.55 -0.45 0.08 0.00 -0.22 0.00 0.00 54.13 54.09 2x1c s LEU 169 Cb -0.54 0.04 0.44 0.00 0.50 0.00 0.00 46.19 46.63 2x1c s LEU 169 CO 0.63 -0.25 1.13 1.41 -1.32 0.00 0.00 176.35 177.95 2x1c n HIS 170 N 1.75 2.85 -2.76 5.38 8.25 -1.26 -4.09 115.22 125.34 2x1c n HIS 170 Ca -0.22 -2.69 -0.36 0.00 -0.26 0.00 0.00 57.72 54.18 2x1c n HIS 170 Cb 0.55 -0.21 -0.06 0.00 1.12 0.00 0.00 29.99 31.39 2x1c n HIS 170 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2x1c s LEU 171 N -3.55 4.27 0.41 2.41 1.43 -1.26 -0.25 118.68 122.15 2x1c s LEU 171 Ca 0.46 1.84 -0.24 0.00 -1.03 0.00 0.00 54.13 55.16 2x1c s LEU 171 Cb 0.40 -4.09 -0.08 0.00 0.03 0.00 0.00 46.19 42.45 2x1c s LEU 171 CO -0.08 -0.14 1.12 -1.58 0.23 0.00 0.00 176.35 175.90 2x1c s GLN 172 N -2.23 4.02 0.00 1.70 0.74 0.08 -4.52 119.66 119.46 2x1c s GLN 172 Ca 0.52 1.69 0.00 0.00 0.05 0.00 0.00 55.36 57.62 2x1c s GLN 172 Cb -0.18 -2.55 0.00 0.00 1.10 0.00 0.00 33.01 31.38 2x1c s GLN 172 CO 0.23 -0.30 0.00 0.41 -0.55 0.00 0.00 175.29 175.08 2x1c n GLY 173 N 0.47 4.28 2.81 2.59 0.00 -1.26 -4.71 105.19 109.38 2x1c n GLY 173 Ca 0.05 -1.15 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 2x1c n GLY 173 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2x1c s LEU 174 N 0.00 0.99 -0.33 0.99 2.96 -1.26 -4.54 118.68 117.49 2x1c s LEU 174 Ca 0.00 -0.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.89 2x1c s LEU 174 Cb 0.00 -0.30 0.09 0.00 0.50 0.00 0.00 46.19 46.48 2x1c s LEU 174 CO 0.00 -0.12 0.04 -0.60 -1.32 0.00 0.00 176.35 174.35 2x1c s ARG 175 N 1.29 1.65 0.65 1.98 3.52 0.85 -5.00 118.95 123.88 2x1c s ARG 175 Ca -0.06 -1.79 0.40 0.00 -0.13 0.00 0.00 55.73 54.16 2x1c s ARG 175 Cb -0.13 -3.19 2.26 0.00 -1.56 0.00 0.00 34.95 32.32 2x1c s ARG 175 CO -0.02 -0.89 2.34 -1.35 -0.81 0.00 0.00 175.30 174.57 2x1c h PRO 176 N 7.67 0.00 -0.12 5.12 0.11 -1.95 -1.28 132.00 141.56 2x1c h PRO 176 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2x1c h PRO 176 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2x1c h PRO 176 CO 0.53 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.57 2x1c n THR 177 N -3.30 0.13 -1.99 -1.15 -2.24 -1.26 -4.90 114.28 99.57 2x1c n THR 177 Ca -0.03 -0.48 -0.29 0.00 -2.27 0.00 0.00 64.05 60.97 2x1c n THR 177 Cb 0.08 1.06 0.19 0.00 -2.10 0.00 0.00 70.33 69.56 2x1c n THR 177 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2x1c s GLY 178 N -1.85 1.81 -0.15 3.38 0.00 -0.48 -4.98 107.32 105.04 2x1c s GLY 178 Ca 0.33 -1.33 -0.29 0.00 0.00 0.00 0.00 44.72 43.43 2x1c s GLY 178 CO 0.31 -0.53 1.04 0.54 0.00 0.00 0.00 173.10 174.46 2x1c s VAL 179 N -3.88 4.70 0.55 1.40 0.11 -0.65 -4.33 120.40 118.30 2x1c s VAL 179 Ca 0.75 2.00 -0.21 0.00 -2.93 0.00 0.00 61.98 61.59 2x1c s VAL 179 Cb -0.03 -4.29 -0.05 0.00 -1.53 0.00 0.00 36.38 30.49 2x1c s VAL 179 CO 0.53 -0.07 1.27 -2.84 -3.33 0.00 0.00 175.10 170.66 2x1c s PRO 180 N 2.53 3.15 0.24 1.54 0.02 -1.26 -1.30 135.00 139.93 2x1c s PRO 180 Ca 0.47 2.02 -0.05 0.00 0.02 0.00 0.00 61.00 63.46 2x1c s PRO 180 Cb -0.17 -2.16 0.35 0.00 0.02 0.00 0.00 34.50 32.54 2x1c s PRO 180 CO 0.13 -1.11 1.83 0.66 -0.33 0.00 0.00 177.00 178.18 2x1c h SER 181 N 1.33 0.74 1.33 2.53 4.64 -1.95 -1.58 113.55 120.59 2x1c h SER 181 Ca -0.50 0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 60.80 2x1c h SER 181 Cb 1.29 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 2x1c h SER 181 CO 0.57 0.46 -0.20 0.45 -0.87 0.00 0.00 176.83 177.24 2x1c h HIS 182 N 0.87 0.00 -0.29 4.77 3.86 -1.85 -1.41 115.15 121.10 2x1c h HIS 182 Ca 0.37 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.50 2x1c h HIS 182 Cb 0.25 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 2x1c h HIS 182 CO -0.05 0.20 -0.16 0.82 0.86 0.00 0.00 177.93 179.60 2x1c h ILE 183 N 0.00 1.30 -0.93 2.45 1.08 -1.64 -2.36 117.51 117.41 2x1c h ILE 183 Ca -0.00 -1.27 0.04 0.00 -0.39 0.00 0.00 64.86 63.24 2x1c h ILE 183 Cb 0.92 1.51 -0.05 0.00 -3.07 0.00 0.00 36.82 36.12 2x1c h ILE 183 CO 0.03 0.40 0.61 0.00 -0.69 0.00 0.00 178.15 178.50 2x1c h ALA 184 N 0.74 1.42 -0.59 1.87 0.00 -0.96 -0.43 119.26 121.31 2x1c h ALA 184 Ca 0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2x1c h ALA 184 Cb 0.69 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2x1c h ALA 184 CO 0.05 0.48 0.33 -0.07 0.00 0.00 0.00 179.25 180.03 2x1c h LEU 185 N 1.15 0.74 -0.69 0.00 3.38 -1.18 -1.17 115.31 117.54 2x1c h LEU 185 Ca 0.38 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.16 2x1c h LEU 185 Cb 0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2x1c h LEU 185 CO -0.12 0.62 -0.02 -0.09 0.09 0.00 0.00 178.44 178.92 2x1c h ARG 186 N 0.80 0.99 -0.39 1.13 9.65 -0.96 -0.95 114.38 124.65 2x1c h ARG 186 Ca 0.21 -0.31 0.04 0.00 -1.10 0.00 0.00 59.98 58.81 2x1c h ARG 186 Cb 0.04 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.49 2x1c h ARG 186 CO -0.03 0.99 0.17 0.82 2.80 0.00 0.00 179.97 184.72 2x1c h ILE 187 N 0.91 0.94 -0.56 1.20 2.04 -0.82 -1.46 117.51 119.76 2x1c h ILE 187 Ca 0.16 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 2x1c h ILE 187 Cb 0.55 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 2x1c h ILE 187 CO 0.03 0.07 0.24 0.00 0.00 0.00 0.00 178.15 178.49 2x1c h ALA 188 N 1.23 0.73 0.00 1.87 0.00 -1.00 -2.62 119.26 119.46 2x1c h ALA 188 Ca 0.17 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2x1c h ALA 188 Cb 0.11 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2x1c h ALA 188 CO -0.14 0.32 -0.04 -0.07 0.00 0.00 0.00 179.25 179.32 2x1c h LEU 189 N 0.76 0.00 -1.14 0.00 3.38 -0.82 -1.71 115.31 115.79 2x1c h LEU 189 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2x1c h LEU 189 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2x1c h LEU 189 CO -0.02 0.04 0.00 -0.62 0.09 0.00 0.00 178.44 177.93 2x1c n GLU 190 N -3.28 1.77 -3.30 1.13 1.02 -0.58 -4.72 120.64 112.68 2x1c n GLU 190 Ca -0.01 -1.13 -0.26 0.00 -0.02 0.00 0.00 57.16 55.73 2x1c n GLU 190 Cb 0.20 -1.45 -0.02 0.00 -0.02 0.00 0.00 31.44 30.15 2x1c n GLU 190 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2x1c s SER 191 N -1.85 6.34 0.00 1.62 0.01 -0.64 -4.57 113.70 114.61 2x1c s SER 191 Ca 0.36 0.58 0.24 0.00 1.31 0.00 0.00 55.95 58.44 2x1c s SER 191 Cb 0.20 -2.09 0.38 0.00 0.21 0.00 0.00 66.02 64.73 2x1c s SER 191 CO 0.31 -0.29 1.33 0.35 0.41 0.00 0.00 173.24 175.35 2x1c n THR 192 N -1.54 0.00 -3.48 1.44 -2.24 -1.26 -4.78 114.28 102.41 2x1c n THR 192 Ca -0.03 -0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.54 2x1c n THR 192 Cb 0.55 0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 69.37 2x1c n THR 192 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2x1c s SER 193 N -2.72 -0.48 0.32 3.42 1.04 -1.26 -4.83 113.70 109.19 2x1c s SER 193 Ca 0.17 -0.10 -0.00 0.00 0.48 0.00 0.00 55.95 56.50 2x1c s SER 193 Cb 0.18 0.57 0.51 0.00 0.10 0.00 0.00 66.02 67.38 2x1c s SER 193 CO 0.64 -0.95 1.97 -0.65 0.98 0.00 0.00 173.24 175.22 2x1c h PRO 194 N 2.09 0.96 -0.65 4.02 0.11 -1.90 -0.85 132.00 135.77 2x1c h PRO 194 Ca -0.34 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.74 2x1c h PRO 194 Cb 1.30 -0.21 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 2x1c h PRO 194 CO 0.40 0.66 0.39 0.77 -0.21 0.00 0.00 178.00 180.01 2x1c h SER 195 N 0.98 0.61 -0.56 -2.05 0.02 -1.95 -0.23 113.55 110.36 2x1c h SER 195 Ca 0.26 0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 61.17 2x1c h SER 195 Cb -0.06 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2x1c h SER 195 CO -0.05 0.41 0.16 -0.61 -1.14 0.00 0.00 176.83 175.60 2x1c h GLN 196 N 0.74 0.89 -0.55 3.45 4.15 -1.87 -1.89 115.11 120.04 2x1c h GLN 196 Ca 0.28 -0.20 0.03 0.00 0.77 0.00 0.00 58.65 59.53 2x1c h GLN 196 Cb 0.09 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.62 2x1c h GLN 196 CO -0.14 0.82 0.32 0.00 -1.93 0.00 0.00 178.83 177.89 2x1c h ALA 197 N 1.03 0.70 0.12 3.38 0.00 -0.60 0.98 119.26 124.88 2x1c h ALA 197 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2x1c h ALA 197 Cb 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2x1c h ALA 197 CO -0.00 0.02 -0.10 -0.92 0.00 0.00 0.00 179.25 178.25 2x1c h TYR 198 N 0.62 -0.25 -0.95 0.00 3.20 -0.94 -1.19 116.97 117.46 2x1c h TYR 198 Ca 0.23 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.17 2x1c h TYR 198 Cb 0.06 0.09 -0.07 0.00 1.54 0.00 0.00 36.73 38.35 2x1c h TYR 198 CO -0.07 -0.15 0.61 -0.44 -1.64 0.00 0.00 178.16 176.46 2x1c h ASP 199 N -0.23 0.96 1.05 -2.11 5.19 -1.02 -0.56 116.42 119.70 2x1c h ASP 199 Ca -0.00 0.02 -0.15 0.00 -0.62 0.00 0.00 57.03 56.27 2x1c h ASP 199 Cb 0.21 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 2x1c h ASP 199 CO -0.01 0.60 -0.74 0.03 -3.12 0.00 0.00 179.24 176.00 2x1c h ARG 200 N 1.09 0.00 -0.08 3.56 3.08 -0.53 0.41 114.38 121.90 2x1c h ARG 200 Ca 0.42 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.39 2x1c h ARG 200 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2x1c h ARG 200 CO -0.18 0.74 -0.25 0.82 -1.07 0.00 0.00 179.97 180.02 2x1c h ILE 201 N 0.00 1.42 -0.39 2.04 2.04 -0.91 -3.17 117.51 118.53 2x1c h ILE 201 Ca -0.01 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.22 2x1c h ILE 201 Cb 1.46 2.25 -0.02 0.00 -0.74 0.00 0.00 36.82 39.77 2x1c h ILE 201 CO 0.10 0.46 0.20 0.58 0.00 0.00 0.00 178.15 179.49 2x1c h VAL 202 N -0.17 1.13 -0.24 1.67 2.07 -1.06 -2.45 116.25 117.20 2x1c h VAL 202 Ca -0.01 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.22 2x1c h VAL 202 Cb 0.88 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2x1c h VAL 202 CO 0.05 0.15 0.24 -0.08 0.02 0.00 0.00 177.57 177.95 2x1c h GLU 203 N 0.55 0.00 0.00 1.57 4.81 -0.88 -1.63 114.58 118.99 2x1c h GLU 203 Ca 0.14 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2x1c h GLU 203 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2x1c h GLU 203 CO -0.02 0.00 0.00 1.96 -0.73 0.00 0.00 179.01 180.22 2x1c h GLN 204 N 0.00 0.00 -0.03 1.92 1.08 -1.50 -3.46 115.11 113.12 2x1c h GLN 204 Ca 0.12 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.30 2x1c h GLN 204 Cb 0.59 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.01 2x1c h GLN 204 CO -0.00 0.00 -0.01 0.41 -0.95 0.00 0.00 178.83 178.28 2x1c n GLY 205 N 0.23 0.48 0.00 3.46 0.00 -0.61 -4.85 105.19 103.89 2x1c n GLY 205 Ca 0.02 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2x1c n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x1c n GLY 206 N -2.74 4.50 3.86 -0.02 0.00 -1.26 -5.06 105.19 104.48 2x1c n GLY 206 Ca -0.01 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 2x1c n GLY 206 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2x1c s MET 207 N -3.44 3.91 0.14 1.61 1.00 -1.26 -1.63 119.30 119.63 2x1c s MET 207 Ca 0.00 0.64 -0.01 0.00 0.00 0.00 0.00 55.69 56.32 2x1c s MET 207 Cb 0.00 -2.37 -0.07 0.00 0.00 0.00 0.00 34.83 32.39 2x1c s MET 207 CO 0.00 0.02 1.33 0.00 0.00 0.00 0.00 175.02 176.37 2x1c h ALA 208 N 1.69 0.42 -3.00 3.03 0.00 -1.39 -3.36 119.26 116.65 2x1c h ALA 208 Ca -0.48 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 53.70 2x1c h ALA 208 Cb 1.18 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2x1c h ALA 208 CO 0.64 0.89 0.00 0.00 0.00 0.00 0.00 179.25 180.78 2x1c n ALA 209 N -2.50 0.00 -2.54 0.00 0.00 -1.26 -0.10 120.51 114.11 2x1c n ALA 209 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 2x1c n ALA 209 Cb 0.84 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.15 2x1c n ALA 209 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2x1c s SER 210 N 1.66 4.02 0.14 0.00 0.15 -1.26 -3.81 113.70 114.59 2x1c s SER 210 Ca 0.00 -0.21 -0.15 0.00 0.70 0.00 0.00 55.95 56.29 2x1c s SER 210 Cb 0.00 -0.93 0.05 0.00 -1.71 0.00 0.00 66.02 63.43 2x1c s SER 210 CO 0.00 0.33 0.71 0.00 1.20 0.00 0.00 173.24 175.48 2x1c n ALA 211 N 2.45 -1.85 -3.05 5.45 0.00 -1.15 -4.27 120.51 118.09 2x1c n ALA 211 Ca -0.17 -0.73 -0.23 0.00 0.00 0.00 0.00 53.44 52.31 2x1c n ALA 211 Cb 0.52 0.42 -0.16 0.00 0.00 0.00 0.00 19.45 20.23 2x1c n ALA 211 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2x1c s PHE 212 N -3.33 1.26 -0.05 0.00 2.19 -0.07 -2.00 117.98 115.98 2x1c s PHE 212 Ca 0.16 -0.36 0.04 0.00 0.33 0.00 0.00 56.93 57.11 2x1c s PHE 212 Cb -0.02 -0.89 -0.00 0.00 -1.31 0.00 0.00 43.02 40.80 2x1c s PHE 212 CO 0.04 -0.14 -0.18 0.42 1.83 0.00 0.00 175.22 177.19 2x1c s ILE 213 N 0.21 1.49 -0.09 3.12 1.01 -0.77 -1.17 121.20 125.01 2x1c s ILE 213 Ca -0.05 -0.75 0.01 0.00 0.00 0.00 0.00 60.65 59.86 2x1c s ILE 213 Cb -0.11 -1.28 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2x1c s ILE 213 CO 0.01 0.43 -0.11 -0.32 0.00 0.00 0.00 174.94 174.96 2x1c s MET 214 N 0.03 2.96 -0.06 2.79 -2.45 -0.38 -0.35 119.30 121.85 2x1c s MET 214 Ca -0.04 -0.63 0.01 0.00 -1.25 0.00 0.00 55.69 53.78 2x1c s MET 214 Cb -0.12 -2.57 0.02 0.00 1.25 0.00 0.00 34.83 33.41 2x1c s MET 214 CO 0.02 0.47 -0.08 0.08 1.05 0.00 0.00 175.02 176.56 2x1c s VAL 215 N -0.31 0.87 0.03 10.11 1.01 -0.38 -1.09 120.40 130.63 2x1c s VAL 215 Ca 0.03 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 2x1c s VAL 215 Cb -0.13 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.42 2x1c s VAL 215 CO 0.03 0.31 0.22 -0.83 0.00 0.00 0.00 175.10 174.82 2x1c s GLY 216 N 0.95 -0.01 0.00 4.51 0.00 -0.25 -1.42 107.32 111.10 2x1c s GLY 216 Ca -0.10 -0.16 0.00 0.00 0.00 0.00 0.00 44.72 44.46 2x1c s GLY 216 CO 0.00 -0.35 0.00 1.16 0.00 0.00 0.00 173.10 173.92 2x1c n ASN 217 N 0.77 0.98 0.30 1.64 0.23 -0.27 -0.44 115.26 118.47 2x1c n ASN 217 Ca -0.19 -0.24 0.19 0.00 -0.53 0.00 0.00 54.58 53.81 2x1c n ASN 217 Cb 0.58 0.00 0.92 0.00 -2.08 0.00 0.00 39.78 39.20 2x1c n ASN 217 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 2x1c h GLY 218 N 0.00 0.00 0.00 4.83 0.00 -1.86 -3.35 103.07 102.69 2x1c h GLY 218 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 2x1c h GLY 218 CO 0.00 0.00 -1.81 1.57 0.00 0.00 0.00 176.54 176.30 2x1c n HIS 219 N -3.15 0.00 -3.90 5.60 -0.00 -1.26 -4.61 115.22 107.90 2x1c n HIS 219 Ca -0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 57.72 57.61 2x1c n HIS 219 Cb 0.20 -0.56 -0.09 0.00 -0.00 0.00 0.00 29.99 29.54 2x1c n HIS 219 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.34 174.51 2x1c s GLU 220 N -2.29 0.62 -0.01 1.57 -1.05 -1.26 -5.17 118.70 111.11 2x1c s GLU 220 Ca -0.15 -0.69 -0.26 0.00 -0.15 0.00 0.00 54.97 53.72 2x1c s GLU 220 Cb 0.04 0.25 0.06 0.00 -0.44 0.00 0.00 34.13 34.04 2x1c s GLU 220 CO 0.38 -0.16 0.57 0.00 0.95 0.00 0.00 175.26 177.00 2x1c s ALA 221 N -2.54 -1.47 0.09 -0.84 0.00 -1.26 -1.12 121.76 114.61 2x1c s ALA 221 Ca -0.05 0.93 -0.09 0.00 0.00 0.00 0.00 51.96 52.75 2x1c s ALA 221 Cb -0.01 0.14 -0.00 0.00 0.00 0.00 0.00 23.12 23.24 2x1c s ALA 221 CO -0.04 -0.40 0.19 -0.59 0.00 0.00 0.00 175.76 174.92 2x1c s PHE 222 N -1.60 0.15 0.13 0.00 -0.12 -0.51 -4.57 117.98 111.45 2x1c s PHE 222 Ca -0.10 -0.57 0.08 0.00 -0.05 0.00 0.00 56.93 56.30 2x1c s PHE 222 Cb -0.01 -0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.28 2x1c s PHE 222 CO 0.05 -0.54 -0.14 0.20 -0.05 0.00 0.00 175.22 174.74 2x1c s GLY 223 N -2.83 1.73 -0.15 1.99 0.00 -0.19 -1.25 107.32 106.62 2x1c s GLY 223 Ca 0.05 -1.35 0.00 0.00 0.00 0.00 0.00 44.72 43.42 2x1c s GLY 223 CO -0.11 -1.33 -0.12 1.08 0.00 0.00 0.00 173.10 172.62 2x1c s LEU 224 N -2.30 1.67 -0.23 0.66 1.43 0.53 0.18 118.68 120.61 2x1c s LEU 224 Ca 0.20 -0.51 -0.10 0.00 -1.03 0.00 0.00 54.13 52.69 2x1c s LEU 224 Cb -0.10 -1.12 -0.05 0.00 0.03 0.00 0.00 46.19 44.95 2x1c s LEU 224 CO 0.12 -0.08 0.14 -1.61 0.23 0.00 0.00 176.35 175.15 2x1c s GLU 225 N 1.52 4.03 0.07 1.70 2.02 -0.41 -1.84 118.70 125.79 2x1c s GLU 225 Ca 0.04 -0.29 -0.02 0.00 0.02 0.00 0.00 54.97 54.72 2x1c s GLU 225 Cb -0.13 -3.49 -0.03 0.00 0.10 0.00 0.00 34.13 30.57 2x1c s GLU 225 CO -0.10 0.07 0.03 -0.59 0.02 0.00 0.00 175.26 174.68 2x1c s PHE 226 N 1.02 0.52 0.33 1.61 -0.12 -0.85 -1.30 117.98 119.20 2x1c s PHE 226 Ca 0.07 -1.02 0.05 0.00 -0.05 0.00 0.00 56.93 55.98 2x1c s PHE 226 Cb -0.13 -0.35 -0.02 0.00 -0.63 0.00 0.00 43.02 41.89 2x1c s PHE 226 CO 0.04 -0.44 0.32 -1.54 -0.05 0.00 0.00 175.22 173.55 2x1c s SER 227 N -2.93 1.42 0.27 1.98 1.04 -0.02 -2.94 113.70 112.53 2x1c s SER 227 Ca 0.10 -1.68 0.19 0.00 0.48 0.00 0.00 55.95 55.04 2x1c s SER 227 Cb 0.07 0.58 1.01 0.00 0.10 0.00 0.00 66.02 67.78 2x1c s SER 227 CO -0.08 -1.11 1.59 -2.65 0.98 0.00 0.00 173.24 171.97 2x1c n PRO 228 N -0.59 0.13 -0.16 4.02 -0.02 -1.25 -2.79 135.00 134.34 2x1c n PRO 228 Ca 0.06 0.60 0.06 0.00 -2.02 0.00 0.00 63.50 62.19 2x1c n PRO 228 Cb 0.62 -1.89 0.09 0.00 -0.02 0.00 0.00 33.50 32.30 2x1c n PRO 228 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2x1c n THR 229 N -2.16 1.27 -3.64 3.45 -2.24 -1.26 -4.61 114.28 105.09 2x1c n THR 229 Ca -0.01 -1.50 -0.07 0.00 -2.27 0.00 0.00 64.05 60.20 2x1c n THR 229 Cb 0.05 0.07 -0.07 0.00 -2.10 0.00 0.00 70.33 68.29 2x1c n THR 229 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2x1c s SER 230 N -2.10 -0.77 -0.25 3.42 0.15 -1.12 -5.02 113.70 108.01 2x1c s SER 230 Ca 0.19 1.28 -0.04 0.00 0.70 0.00 0.00 55.95 58.09 2x1c s SER 230 Cb 0.17 1.31 0.09 0.00 -1.71 0.00 0.00 66.02 65.88 2x1c s SER 230 CO 0.02 -0.21 0.10 -0.63 1.20 0.00 0.00 173.24 173.72 2x1c s ILE 231 N 1.25 0.16 0.02 6.45 1.01 -1.26 -0.84 121.20 127.98 2x1c s ILE 231 Ca -0.07 -0.71 0.08 0.00 0.00 0.00 0.00 60.65 59.95 2x1c s ILE 231 Cb -0.05 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.39 2x1c s ILE 231 CO -0.14 -0.56 -0.22 -0.13 0.00 0.00 0.00 174.94 173.89 2x1c s ARG 232 N 2.00 2.04 -0.23 2.79 0.52 -0.42 -4.99 118.95 120.67 2x1c s ARG 232 Ca 0.06 -0.98 -0.08 0.00 -0.52 0.00 0.00 55.73 54.21 2x1c s ARG 232 Cb -0.16 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 33.16 2x1c s ARG 232 CO -0.25 0.55 0.09 0.21 0.02 0.00 0.00 175.30 175.92 2x1c s LYS 233 N -1.10 3.85 0.06 3.54 2.20 -1.26 -1.29 119.74 125.74 2x1c s LYS 233 Ca 0.12 -0.39 -0.21 0.00 -0.36 0.00 0.00 55.97 55.14 2x1c s LYS 233 Cb -0.10 -3.36 -0.06 0.00 -1.51 0.00 0.00 37.83 32.80 2x1c s LYS 233 CO 0.02 0.00 0.61 -1.14 -0.36 0.00 0.00 175.35 174.49 2x1c s GLN 234 N 1.14 4.30 0.34 4.03 0.74 0.13 -4.93 119.66 125.40 2x1c s GLN 234 Ca 0.05 0.80 0.05 0.00 0.05 0.00 0.00 55.36 56.31 2x1c s GLN 234 Cb -0.14 -3.28 -0.07 0.00 1.10 0.00 0.00 33.01 30.62 2x1c s GLN 234 CO 0.04 0.52 0.04 0.14 -0.55 0.00 0.00 175.29 175.48 2x1c s VAL 235 N -0.75 1.40 0.41 1.34 -7.23 -1.26 -1.02 120.40 113.28 2x1c s VAL 235 Ca 0.31 -2.01 -0.27 0.00 -1.81 0.00 0.00 61.98 58.20 2x1c s VAL 235 Cb -0.20 -2.80 -0.10 0.00 0.56 0.00 0.00 36.38 33.85 2x1c s VAL 235 CO 0.19 -0.04 1.46 -0.76 -0.31 0.00 0.00 175.10 175.65 2x1c s LEU 236 N -3.52 4.23 0.00 1.32 1.43 -1.26 -4.81 118.68 116.06 2x1c s LEU 236 Ca 0.35 2.99 -0.12 0.00 -1.03 0.00 0.00 54.13 56.32 2x1c s LEU 236 Cb 0.08 -3.78 0.16 0.00 0.03 0.00 0.00 46.19 42.68 2x1c s LEU 236 CO 0.16 -1.00 0.96 -0.90 0.23 0.00 0.00 176.35 175.80 2x1c n ASP 237 N 0.18 0.05 0.30 2.29 5.68 0.08 -4.83 116.55 120.29 2x1c n ASP 237 Ca 0.03 -1.34 0.20 0.00 -0.50 0.00 0.00 54.79 53.17 2x1c n ASP 237 Cb 0.40 -0.74 1.06 0.00 -1.14 0.00 0.00 41.12 40.70 2x1c n ASP 237 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2x1c h ALA 238 N -1.86 1.00 -0.30 2.12 0.00 -1.95 -0.26 119.26 118.01 2x1c h ALA 238 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2x1c h ALA 238 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2x1c h ALA 238 CO 0.22 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.56 2x1c n ASN 239 N -2.89 2.95 -0.15 0.00 3.02 -1.26 -4.94 115.26 111.99 2x1c n ASN 239 Ca -0.02 -1.92 -0.01 0.00 -0.03 0.00 0.00 54.58 52.59 2x1c n ASN 239 Cb 0.07 -0.19 -0.00 0.00 -0.61 0.00 0.00 39.78 39.05 2x1c n ASN 239 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x1c n GLY 240 N 1.40 0.36 3.34 7.41 0.00 -0.11 -4.80 105.19 112.79 2x1c n GLY 240 Ca 0.18 -0.89 -0.24 0.00 0.00 0.00 0.00 46.02 45.07 2x1c n GLY 240 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x1c s ARG 241 N -3.50 1.27 -0.04 1.61 0.52 -1.26 -0.74 118.95 116.83 2x1c s ARG 241 Ca 0.00 -1.33 0.01 0.00 -0.52 0.00 0.00 55.73 53.89 2x1c s ARG 241 Cb 0.00 -1.51 0.02 0.00 0.52 0.00 0.00 34.95 33.99 2x1c s ARG 241 CO 0.00 0.33 -0.02 -1.64 0.02 0.00 0.00 175.30 173.99 2x1c s MET 242 N -2.36 0.56 -0.03 3.54 -1.94 -0.38 -0.74 119.30 117.95 2x1c s MET 242 Ca 0.13 -0.02 0.05 0.00 -1.71 0.00 0.00 55.69 54.14 2x1c s MET 242 Cb -0.08 -0.65 -0.01 0.00 2.01 0.00 0.00 34.83 36.10 2x1c s MET 242 CO 0.06 -0.10 -0.19 0.08 -0.01 0.00 0.00 175.02 174.86 2x1c s VAL 243 N 0.94 1.51 -0.03 -6.03 1.01 -1.26 -0.82 120.40 115.71 2x1c s VAL 243 Ca -0.11 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.04 2x1c s VAL 243 Cb -0.14 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 34.97 2x1c s VAL 243 CO -0.01 0.43 0.10 -2.28 0.00 0.00 0.00 175.10 173.34 2x1c s HIS 244 N -0.21 -0.05 0.00 5.22 2.46 -0.11 -5.00 115.29 117.60 2x1c s HIS 244 Ca 0.02 0.13 0.00 0.00 0.47 0.00 0.00 55.06 55.67 2x1c s HIS 244 Cb -0.10 0.00 0.00 0.00 -0.13 0.00 0.00 32.58 32.35 2x1c s HIS 244 CO 0.01 -0.11 0.00 0.25 -2.47 0.00 0.00 174.74 172.42 2x1c n THR 245 N 2.60 0.00 -1.74 0.89 -2.24 -1.26 -0.53 114.28 112.00 2x1c n THR 245 Ca -0.15 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.68 2x1c n THR 245 Cb 0.58 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.94 2x1c n THR 245 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2x1c n ASN 246 N 0.00 1.51 -4.11 3.42 4.13 -1.26 -4.70 115.26 114.24 2x1c n ASN 246 Ca 0.00 -3.13 -0.09 0.00 1.68 0.00 0.00 54.58 53.04 2x1c n ASN 246 Cb 0.00 -0.43 -0.10 0.00 -1.54 0.00 0.00 39.78 37.71 2x1c n ASN 246 CO 0.00 0.00 0.00 -1.38 0.28 0.00 0.00 177.26 176.16 2x1c s HIS 247 N -2.11 0.66 0.08 3.10 -3.43 -1.26 -4.54 115.29 107.78 2x1c s HIS 247 Ca 0.32 -0.92 -0.31 0.00 -0.80 0.00 0.00 55.06 53.35 2x1c s HIS 247 Cb 0.32 -0.43 -0.07 0.00 -1.43 0.00 0.00 32.58 30.98 2x1c s HIS 247 CO -0.07 -0.25 1.29 0.00 -2.00 0.00 0.00 174.74 173.72 2x1c n LEU 249 N 4.06 0.21 -4.99 0.00 4.77 -1.26 -5.04 117.00 114.75 2x1c n LEU 249 Ca 0.10 -0.13 -0.18 0.00 -0.03 0.00 0.00 56.01 55.76 2x1c n LEU 249 Cb 0.44 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.53 2x1c n LEU 249 CO 0.57 0.05 0.08 -0.76 -1.33 0.00 0.00 177.39 176.00 2x1c s LEU 250 N -3.83 3.86 -1.28 2.23 1.43 -1.26 -5.02 118.68 114.80 2x1c s LEU 250 Ca -0.03 -0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 2x1c s LEU 250 Cb 0.12 -2.70 0.14 0.00 0.03 0.00 0.00 46.19 43.78 2x1c s LEU 250 CO 0.72 -0.53 1.75 0.00 0.23 0.00 0.00 176.35 178.52 2x1c n GLN 251 N -1.69 3.37 -1.85 1.70 6.02 -1.26 -4.99 117.38 118.68 2x1c n GLN 251 Ca 0.02 -3.48 -0.32 0.00 -0.01 0.00 0.00 57.00 53.21 2x1c n GLN 251 Cb 0.58 -3.09 0.03 0.00 1.02 0.00 0.00 30.24 28.78 2x1c n GLN 251 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2x1c s HIS 252 N 1.70 2.97 0.81 1.08 3.76 -1.26 -5.01 115.29 119.34 2x1c s HIS 252 Ca 0.44 1.49 -0.13 0.00 -0.15 0.00 0.00 55.06 56.71 2x1c s HIS 252 Cb 0.05 -2.99 0.07 0.00 1.11 0.00 0.00 32.58 30.82 2x1c s HIS 252 CO 0.00 -1.23 1.06 0.41 -0.85 0.00 0.00 174.74 174.13 2x1c n GLY 253 N -1.22 -0.35 0.19 -2.22 0.00 -1.26 -4.88 105.19 95.45 2x1c n GLY 253 Ca 0.09 -0.50 0.14 0.00 0.00 0.00 0.00 46.02 45.74 2x1c n GLY 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x1c h LYS 254 N -0.93 0.00 0.00 1.61 1.57 -2.03 -1.50 116.57 115.30 2x1c h LYS 254 Ca -0.46 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2x1c h LYS 254 Cb 1.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.61 2x1c h LYS 254 CO 0.44 0.00 -0.06 -2.95 -0.57 0.00 0.00 179.45 176.32 2x1c h ASN 255 N 0.00 0.00 -3.88 0.86 -1.07 -2.03 -3.44 115.58 106.02 2x1c h ASN 255 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 56.30 55.89 2x1c h ASN 255 Cb 0.18 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.42 2x1c h ASN 255 CO 0.00 0.06 0.38 -1.61 0.07 0.00 0.00 177.43 176.33 2x1c s GLU 256 N -3.73 4.50 -0.10 4.14 0.41 -0.57 -5.05 118.70 118.31 2x1c s GLU 256 Ca 0.00 1.46 0.00 0.00 -0.41 0.00 0.00 54.97 56.03 2x1c s GLU 256 Cb 0.10 -2.83 0.02 0.00 -1.78 0.00 0.00 34.13 29.64 2x1c s GLU 256 CO 0.56 0.18 -0.09 0.21 -0.49 0.00 0.00 175.26 175.63 2x1c s LYS 257 N -2.01 1.59 -0.10 1.61 2.20 -1.26 -4.97 119.74 116.80 2x1c s LYS 257 Ca 0.51 -0.30 -0.18 0.00 -0.36 0.00 0.00 55.97 55.64 2x1c s LYS 257 Cb -0.22 -1.56 -0.04 0.00 -1.51 0.00 0.00 37.83 34.50 2x1c s LYS 257 CO 0.28 -0.19 0.47 -2.00 -0.36 0.00 0.00 175.35 173.54 2x1c s GLU 258 N 1.44 4.28 -1.02 4.03 2.12 -1.26 -0.74 118.70 127.55 2x1c s GLU 258 Ca 0.00 0.45 -0.02 0.00 0.36 0.00 0.00 54.97 55.76 2x1c s GLU 258 Cb -0.13 -3.40 0.31 0.00 0.26 0.00 0.00 34.13 31.16 2x1c s GLU 258 CO -0.05 0.25 1.50 1.28 -0.54 0.00 0.00 175.26 177.69 2x1c n LEU 259 N 3.36 6.41 -3.23 2.70 4.77 0.65 -4.88 117.00 126.79 2x1c n LEU 259 Ca -0.08 -5.30 -0.08 0.00 -0.03 0.00 0.00 56.01 50.52 2x1c n LEU 259 Cb 0.52 -1.17 0.02 0.00 -2.33 0.00 0.00 43.42 40.45 2x1c n LEU 259 CO 0.42 1.84 0.19 0.47 -1.33 0.00 0.00 177.39 178.98 2x1c n ASP 260 N 0.86 -7.07 -4.66 -1.43 8.00 -1.26 -4.95 116.55 106.04 2x1c n ASP 260 Ca 0.32 -0.36 -0.30 0.00 0.71 0.00 0.00 54.79 55.15 2x1c n ASP 260 Cb 0.32 -4.73 0.17 0.00 -0.02 0.00 0.00 41.12 36.85 2x1c n ASP 260 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 2x1c s PRO 261 N -3.71 0.84 0.58 -0.24 0.02 -1.26 -4.99 135.00 126.24 2x1c s PRO 261 Ca 0.12 1.19 -0.18 0.00 0.02 0.00 0.00 61.00 62.16 2x1c s PRO 261 Cb -0.02 -1.73 -0.04 0.00 0.02 0.00 0.00 34.50 32.72 2x1c s PRO 261 CO 0.77 -2.64 1.10 -0.51 -0.33 0.00 0.00 177.00 175.40 2x1c s LEU 262 N -6.55 3.62 0.41 -5.54 1.43 -1.26 -4.92 118.68 105.86 2x1c s LEU 262 Ca 0.66 2.04 0.17 0.00 -1.03 0.00 0.00 54.13 55.97 2x1c s LEU 262 Cb -0.21 -4.56 1.07 0.00 0.03 0.00 0.00 46.19 42.52 2x1c s LEU 262 CO 0.59 -1.27 1.83 -0.65 0.23 0.00 0.00 176.35 177.08 2x1c h PRO 263 N 0.80 0.41 0.00 1.29 0.11 -2.03 -1.18 132.00 131.40 2x1c h PRO 263 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2x1c h PRO 263 Cb 1.25 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2x1c h PRO 263 CO 0.56 0.27 0.00 0.38 -0.21 0.00 0.00 178.00 179.00 2x1c h ASP 264 N 0.42 0.00 -0.80 -2.05 3.04 -1.92 -1.91 116.42 113.20 2x1c h ASP 264 Ca 0.50 0.00 0.09 0.00 -3.24 0.00 0.00 57.03 54.39 2x1c h ASP 264 Cb 1.24 0.00 -0.07 0.00 -1.04 0.00 0.00 39.33 39.46 2x1c h ASP 264 CO -0.21 0.00 0.45 -1.28 -2.04 0.00 0.00 179.24 176.16 2x1c h SER 265 N 0.00 0.64 -0.19 4.15 0.87 -1.58 0.94 113.55 118.38 2x1c h SER 265 Ca 0.00 0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.50 2x1c h SER 265 Cb 0.23 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2x1c h SER 265 CO 0.00 0.37 -0.31 -0.50 -0.53 0.00 0.00 176.83 175.85 2x1c h TRP 266 N 0.76 0.67 -0.31 2.24 6.55 -1.53 -2.67 115.95 121.66 2x1c h TRP 266 Ca 0.38 -0.23 0.02 0.00 0.95 0.00 0.00 58.89 60.01 2x1c h TRP 266 Cb 0.35 -0.13 -0.02 0.00 -0.86 0.00 0.00 29.16 28.50 2x1c h TRP 266 CO -0.07 0.96 0.16 -0.97 -1.05 0.00 0.00 178.44 177.47 2x1c h ASN 267 N 0.20 0.24 -0.80 -3.49 -0.73 -1.35 -1.55 115.58 108.10 2x1c h ASN 267 Ca 0.01 0.01 -0.04 0.00 1.87 0.00 0.00 56.30 58.16 2x1c h ASN 267 Cb 0.90 -0.03 -0.04 0.00 0.27 0.00 0.00 38.32 39.42 2x1c h ASN 267 CO 0.07 0.18 0.35 0.03 -0.37 0.00 0.00 177.43 177.69 2x1c h ARG 268 N 0.33 1.19 0.21 6.67 3.08 -0.89 0.32 114.38 125.29 2x1c h ARG 268 Ca 0.13 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 2x1c h ARG 268 Cb 0.04 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2x1c h ARG 268 CO -0.09 0.94 -0.10 1.25 -1.07 0.00 0.00 179.97 180.90 2x1c h HIS 269 N 1.17 -0.27 -0.74 3.04 2.76 -1.17 -0.02 115.15 119.93 2x1c h HIS 269 Ca 0.27 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.50 2x1c h HIS 269 Cb 0.18 0.09 -0.06 0.00 1.55 0.00 0.00 27.41 29.17 2x1c h HIS 269 CO 0.02 -0.08 0.44 0.37 -1.30 0.00 0.00 177.93 177.38 2x1c h GLN 270 N -0.40 0.77 -0.29 5.26 4.15 -1.16 -1.85 115.11 121.59 2x1c h GLN 270 Ca -0.03 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 2x1c h GLN 270 Cb 0.31 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.81 2x1c h GLN 270 CO 0.05 0.51 0.09 -0.09 -1.93 0.00 0.00 178.83 177.46 2x1c h ARG 271 N 0.80 0.46 -0.65 1.69 9.65 -0.80 -1.35 114.38 124.18 2x1c h ARG 271 Ca 0.33 -0.10 -0.06 0.00 -1.10 0.00 0.00 59.98 59.05 2x1c h ARG 271 Cb 0.18 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 2x1c h ARG 271 CO -0.18 0.52 0.16 1.98 2.80 0.00 0.00 179.97 185.25 2x1c h MET 272 N 0.31 1.03 -0.72 0.20 4.05 -0.80 -0.52 114.93 118.48 2x1c h MET 272 Ca 0.09 -0.24 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 2x1c h MET 272 Cb 0.25 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 30.88 2x1c h MET 272 CO -0.00 0.92 0.46 0.93 0.23 0.00 0.00 176.91 179.45 2x1c h GLU 273 N 0.95 0.96 -0.41 0.39 4.39 -1.27 -0.06 114.58 119.54 2x1c h GLU 273 Ca 0.20 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.84 2x1c h GLU 273 Cb 0.35 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 2x1c h GLU 273 CO 0.00 0.65 0.26 0.35 -1.16 0.00 0.00 179.01 179.11 2x1c h PHE 274 N 0.98 0.53 -0.68 4.33 3.57 -0.95 -1.32 116.94 123.40 2x1c h PHE 274 Ca 0.26 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.71 2x1c h PHE 274 Cb -0.08 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.45 2x1c h PHE 274 CO -0.02 0.36 0.22 -0.07 -2.23 0.00 0.00 178.31 176.57 2x1c h LEU 275 N 0.55 0.97 -1.58 0.59 3.38 -0.74 -2.48 115.31 116.00 2x1c h LEU 275 Ca 0.15 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2x1c h LEU 275 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 2x1c h LEU 275 CO -0.03 0.91 -0.20 -0.07 0.09 0.00 0.00 178.44 179.14 2x1c h LEU 276 N 0.98 0.01 -0.97 1.67 3.38 -0.87 -1.70 115.31 117.82 2x1c h LEU 276 Ca 0.22 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.28 2x1c h LEU 276 Cb 0.28 -0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.95 2x1c h LEU 276 CO -0.01 0.21 0.61 0.44 0.09 0.00 0.00 178.44 179.78 2x1c h ASP 277 N 0.01 0.92 -0.40 -0.43 3.32 -0.76 -2.79 116.42 116.30 2x1c h ASP 277 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2x1c h ASP 277 Cb 0.36 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2x1c h ASP 277 CO 0.03 0.54 0.00 0.61 -1.72 0.00 0.00 179.24 178.70 2x1c n GLY 278 N -1.35 1.71 3.70 2.75 0.00 -0.91 -4.96 105.19 106.13 2x1c n GLY 278 Ca 0.16 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 2x1c n GLY 278 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2x1c s PHE 279 N -1.48 2.99 -2.05 1.61 5.36 -0.69 -4.94 117.98 118.79 2x1c s PHE 279 Ca 0.39 0.88 0.29 0.00 -0.96 0.00 0.00 56.93 57.54 2x1c s PHE 279 Cb 0.23 -3.65 1.38 0.00 -0.34 0.00 0.00 43.02 40.63 2x1c s PHE 279 CO 0.32 -2.36 1.93 -0.40 -1.46 0.00 0.00 175.22 173.25 2x1c n ASP 280 N 4.88 0.68 0.00 6.13 5.68 -1.26 -4.94 116.55 127.72 2x1c n ASP 280 Ca 0.12 -1.03 0.00 0.00 -0.50 0.00 0.00 54.79 53.38 2x1c n ASP 280 Cb 0.43 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 2x1c n ASP 280 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x1c n GLY 281 N 1.16 2.18 3.79 6.12 0.00 -1.26 -5.06 105.19 112.12 2x1c n GLY 281 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 2x1c n GLY 281 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2x1c s THR 282 N -2.47 3.65 0.29 2.61 -4.23 -1.26 -4.90 115.64 109.33 2x1c s THR 282 Ca 0.00 1.16 0.03 0.00 -1.18 0.00 0.00 61.69 61.69 2x1c s THR 282 Cb 0.00 -3.54 0.29 0.00 1.34 0.00 0.00 72.50 70.58 2x1c s THR 282 CO 0.00 -0.10 1.82 0.11 -0.54 0.00 0.00 174.62 175.92 2x1c h LYS 283 N 2.03 0.91 -0.21 3.99 1.57 -1.99 -0.36 116.57 122.52 2x1c h LYS 283 Ca -0.49 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.23 2x1c h LYS 283 Cb 1.22 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 2x1c h LYS 283 CO 0.61 0.60 0.10 0.37 -0.57 0.00 0.00 179.45 180.56 2x1c h GLN 284 N 0.94 0.30 -0.35 3.15 4.15 -2.00 -1.61 115.11 119.69 2x1c h GLN 284 Ca 0.51 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.81 2x1c h GLN 284 Cb 0.58 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.20 2x1c h GLN 284 CO -0.29 0.31 -0.14 0.00 -1.93 0.00 0.00 178.83 176.78 2x1c h ALA 285 N 0.97 1.11 -0.36 3.38 0.00 -1.85 -2.85 119.26 119.66 2x1c h ALA 285 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2x1c h ALA 285 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2x1c h ALA 285 CO -0.01 0.55 0.23 0.35 0.00 0.00 0.00 179.25 180.38 2x1c h PHE 286 N 0.56 0.46 -0.74 0.00 3.57 -0.85 -2.68 116.94 117.27 2x1c h PHE 286 Ca 0.10 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.63 2x1c h PHE 286 Cb 0.57 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 2x1c h PHE 286 CO 0.02 0.30 0.49 0.00 -2.23 0.00 0.00 178.31 176.89 2x1c h ALA 287 N 1.12 1.53 0.00 2.41 0.00 -1.17 -2.69 119.26 120.46 2x1c h ALA 287 Ca 0.13 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2x1c h ALA 287 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2x1c h ALA 287 CO -0.03 0.41 -0.29 1.96 0.00 0.00 0.00 179.25 181.30 2x1c h GLN 288 N 0.94 0.00 -0.84 0.00 4.20 -1.25 -3.01 115.11 115.15 2x1c h GLN 288 Ca 0.29 0.00 0.11 0.00 0.06 0.00 0.00 58.65 59.11 2x1c h GLN 288 Cb -0.01 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.71 2x1c h GLN 288 CO -0.07 0.29 0.55 -0.07 -0.67 0.00 0.00 178.83 178.85 2x1c h LEU 289 N 0.00 0.67 -0.03 1.46 3.38 -1.22 -1.84 115.31 117.73 2x1c h LEU 289 Ca -0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2x1c h LEU 289 Cb 0.78 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2x1c h LEU 289 CO 0.04 0.38 0.00 0.79 0.09 0.00 0.00 178.44 179.74 2x1c n TRP 290 N -4.53 0.08 -0.03 1.13 7.02 -1.13 -2.41 117.44 117.57 2x1c n TRP 290 Ca 0.15 0.03 0.11 0.00 -1.02 0.00 0.00 57.50 56.77 2x1c n TRP 290 Cb 0.38 -0.54 0.29 0.00 -2.42 0.00 0.00 31.31 29.01 2x1c n TRP 290 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2x1c n ALA 291 N -1.53 2.40 -1.87 6.99 0.00 -0.69 -3.99 120.51 121.82 2x1c n ALA 291 Ca 0.05 -1.13 -0.42 0.00 0.00 0.00 0.00 53.44 51.95 2x1c n ALA 291 Cb 0.26 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 18.74 2x1c n ALA 291 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2x1c s ASP 292 N -1.07 6.59 -0.14 0.00 2.15 -1.01 -4.71 116.67 118.47 2x1c s ASP 292 Ca 0.43 2.71 0.18 0.00 0.43 0.00 0.00 52.55 56.30 2x1c s ASP 292 Cb 0.23 -2.62 0.33 0.00 -0.30 0.00 0.00 42.92 40.56 2x1c s ASP 292 CO 0.30 -0.77 1.19 -0.62 -0.17 0.00 0.00 175.17 175.11 2x1c n GLU 293 N 2.68 1.51 -1.94 4.34 1.02 -1.26 -1.69 120.64 125.30 2x1c n GLU 293 Ca 0.09 -2.66 -0.41 0.00 -0.02 0.00 0.00 57.16 54.16 2x1c n GLU 293 Cb 0.39 -1.55 -0.02 0.00 -0.02 0.00 0.00 31.44 30.24 2x1c n GLU 293 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2x1c s ASP 294 N -2.78 6.56 -1.42 1.62 2.15 -1.26 -1.67 116.67 119.88 2x1c s ASP 294 Ca 0.34 2.76 0.00 0.00 0.43 0.00 0.00 52.55 56.08 2x1c s ASP 294 Cb 0.29 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 40.29 2x1c s ASP 294 CO 0.03 -0.77 0.00 -3.20 -0.17 0.00 0.00 175.17 171.06 2x1c n ASN 295 N 2.22 -4.61 -4.51 -0.34 5.15 -1.26 -4.17 115.26 107.74 2x1c n ASN 295 Ca 0.07 0.24 -0.47 0.00 -0.60 0.00 0.00 54.58 53.82 2x1c n ASN 295 Cb 0.39 -3.49 -0.03 0.00 -0.53 0.00 0.00 39.78 36.13 2x1c n ASN 295 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2x1c n TYR 296 N -3.03 0.54 1.41 1.20 4.19 -0.67 -1.23 117.16 119.58 2x1c n TYR 296 Ca -0.15 0.82 0.14 0.00 3.31 0.00 0.00 57.90 62.02 2x1c n TYR 296 Cb 0.52 -2.13 0.62 0.00 0.49 0.00 0.00 39.34 38.84 2x1c n TYR 296 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2x1c n PRO 297 N 1.01 0.68 -0.23 2.98 -0.04 -1.26 -4.85 135.00 133.28 2x1c n PRO 297 Ca 0.14 -0.22 -0.01 0.00 -0.04 0.00 0.00 63.50 63.37 2x1c n PRO 297 Cb 0.27 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.31 2x1c n PRO 297 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2x1c n PHE 298 N -0.97 0.56 -1.67 0.54 3.72 -0.37 -1.46 117.46 117.83 2x1c n PHE 298 Ca 0.15 -0.41 -0.29 0.00 -0.05 0.00 0.00 57.45 56.84 2x1c n PHE 298 Cb 0.27 -0.28 0.10 0.00 -0.94 0.00 0.00 39.48 38.64 2x1c n PHE 298 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2x1c s SER 299 N 0.08 4.31 0.26 4.37 1.04 -1.20 -4.87 113.70 117.69 2x1c s SER 299 Ca 0.13 1.06 -0.03 0.00 0.48 0.00 0.00 55.95 57.59 2x1c s SER 299 Cb 0.10 -1.71 0.55 0.00 0.10 0.00 0.00 66.02 65.07 2x1c s SER 299 CO 0.03 -2.06 1.65 0.40 0.98 0.00 0.00 173.24 174.25 2x1c h ILE 300 N -1.15 0.38 -2.75 -1.02 2.04 -1.78 -2.68 117.51 110.55 2x1c h ILE 300 Ca -0.48 -0.07 -0.70 0.00 1.00 0.00 0.00 64.86 64.62 2x1c h ILE 300 Cb 1.30 0.17 -0.19 0.00 -0.74 0.00 0.00 36.82 37.36 2x1c h ILE 300 CO 0.62 0.04 0.53 0.00 0.00 0.00 0.00 178.15 179.34 2x1c s ARG 302 N 2.53 4.48 0.02 0.00 3.52 -1.01 -4.81 118.95 123.69 2x1c s ARG 302 Ca 0.24 1.39 0.07 0.00 -0.13 0.00 0.00 55.73 57.30 2x1c s ARG 302 Cb -0.12 -2.74 -0.02 0.00 -1.56 0.00 0.00 34.95 30.51 2x1c s ARG 302 CO -0.03 0.17 -0.21 0.00 -0.81 0.00 0.00 175.30 174.42 2x1c s ALA 303 N -1.62 1.79 0.07 6.12 0.00 -0.53 -1.37 121.76 126.21 2x1c s ALA 303 Ca 0.52 -1.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.15 2x1c s ALA 303 Cb -0.20 -0.39 -0.06 0.00 0.00 0.00 0.00 23.12 22.48 2x1c s ALA 303 CO 0.25 0.42 1.22 -0.47 0.00 0.00 0.00 175.76 177.17 2x1c s TYR 304 N -0.70 3.42 -0.21 0.00 5.04 -1.12 -4.65 117.35 119.12 2x1c s TYR 304 Ca 0.08 1.27 -0.04 0.00 -2.44 0.00 0.00 57.07 55.94 2x1c s TYR 304 Cb -0.09 -3.44 0.10 0.00 0.35 0.00 0.00 41.96 38.88 2x1c s TYR 304 CO 0.01 -1.38 0.26 -2.00 -1.34 0.00 0.00 175.55 171.10 2x1c s GLU 305 N 1.06 0.23 0.17 4.97 2.12 -0.30 -4.98 118.70 121.98 2x1c s GLU 305 Ca 0.59 0.29 -0.32 0.00 0.36 0.00 0.00 54.97 55.89 2x1c s GLU 305 Cb -0.30 -1.02 -0.12 0.00 0.26 0.00 0.00 34.13 32.95 2x1c s GLU 305 CO 0.29 -0.65 1.75 -1.91 -0.54 0.00 0.00 175.26 174.20 2x1c n GLU 306 N 5.33 2.70 -0.23 4.30 4.07 -1.26 -0.55 120.64 135.00 2x1c n GLU 306 Ca -0.05 0.98 0.00 0.00 -0.06 0.00 0.00 57.16 58.03 2x1c n GLU 306 Cb 0.50 -2.83 0.00 0.00 -0.06 0.00 0.00 31.44 29.05 2x1c n GLU 306 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2x1c n GLY 307 N 3.99 1.00 1.57 8.31 0.00 -1.26 -4.81 105.19 113.99 2x1c n GLY 307 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2x1c n GLY 307 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x1c n LYS 308 N -2.00 0.00 -3.69 1.61 5.02 -0.19 -5.08 118.16 113.83 2x1c n LYS 308 Ca 0.00 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 56.03 2x1c n LYS 308 Cb 0.00 -0.21 -0.17 0.00 -0.02 0.00 0.00 35.03 34.63 2x1c n LYS 308 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2x1c s SER 309 N -4.99 2.36 0.34 4.39 0.15 0.29 -4.98 113.70 111.25 2x1c s SER 309 Ca 0.00 -0.56 0.18 0.00 0.70 0.00 0.00 55.95 56.27 2x1c s SER 309 Cb 0.00 -0.41 0.26 0.00 -1.71 0.00 0.00 66.02 64.15 2x1c s SER 309 CO 0.00 -0.30 1.54 0.03 1.20 0.00 0.00 173.24 175.71 2x1c h ARG 310 N 8.33 0.00 -5.57 5.44 3.08 -1.87 -0.78 114.38 123.02 2x1c h ARG 310 Ca -0.16 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.26 2x1c h ARG 310 Cb 1.13 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.09 2x1c h ARG 310 CO 0.29 0.36 -0.44 0.20 -1.07 0.00 0.00 179.97 179.31 2x1c s GLY 311 N -4.38 2.69 0.14 0.04 0.00 -1.26 -4.54 107.32 100.00 2x1c s GLY 311 Ca 0.04 -0.98 -0.15 0.00 0.00 0.00 0.00 44.72 43.63 2x1c s GLY 311 CO 0.71 -2.07 0.40 0.00 0.00 0.00 0.00 173.10 172.15 2x1c s ALA 312 N -2.80 -0.82 -0.03 3.20 0.00 -0.43 -2.80 121.76 118.08 2x1c s ALA 312 Ca 0.21 -0.18 -0.30 0.00 0.00 0.00 0.00 51.96 51.70 2x1c s ALA 312 Cb 0.01 0.73 -0.06 0.00 0.00 0.00 0.00 23.12 23.80 2x1c s ALA 312 CO 0.13 -0.67 1.56 0.99 0.00 0.00 0.00 175.76 177.77 2x1c s THR 313 N -3.83 3.57 -0.11 0.00 2.01 -0.47 -1.67 115.64 115.14 2x1c s THR 313 Ca 0.05 0.82 0.18 0.00 0.31 0.00 0.00 61.69 63.05 2x1c s THR 313 Cb 0.02 -3.53 -0.26 0.00 0.01 0.00 0.00 72.50 68.74 2x1c s THR 313 CO -0.09 -0.04 0.23 0.18 -0.69 0.00 0.00 174.62 174.20 2x1c n LEU 314 N 6.42 0.00 -3.49 4.42 4.77 0.24 -3.40 117.00 125.97 2x1c n LEU 314 Ca 0.16 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 2x1c n LEU 314 Cb 0.43 0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.72 2x1c n LEU 314 CO 0.61 0.23 0.33 0.72 -1.33 0.00 0.00 177.39 177.96 2x1c s PHE 315 N -2.86 -0.43 -0.02 -1.77 -0.12 -1.21 -0.42 117.98 111.16 2x1c s PHE 315 Ca -0.08 0.19 0.04 0.00 -0.05 0.00 0.00 56.93 57.03 2x1c s PHE 315 Cb 0.09 0.48 -0.01 0.00 -0.63 0.00 0.00 43.02 42.94 2x1c s PHE 315 CO 0.77 -0.82 -0.15 1.21 -0.05 0.00 0.00 175.22 176.18 2x1c s ASN 316 N -2.77 1.79 -0.01 1.98 3.84 -0.10 -1.56 114.94 118.11 2x1c s ASN 316 Ca 0.02 -0.28 0.03 0.00 0.21 0.00 0.00 52.86 52.84 2x1c s ASN 316 Cb -0.00 -0.27 -0.01 0.00 -0.55 0.00 0.00 41.25 40.42 2x1c s ASN 316 CO -0.12 0.17 -0.11 -0.51 -2.79 0.00 0.00 177.10 173.74 2x1c s ILE 317 N -0.24 0.86 -0.10 -5.21 2.07 -0.53 -1.01 121.20 117.05 2x1c s ILE 317 Ca 0.03 -0.45 0.01 0.00 -1.41 0.00 0.00 60.65 58.83 2x1c s ILE 317 Cb -0.07 -0.73 0.02 0.00 0.13 0.00 0.00 42.46 41.81 2x1c s ILE 317 CO -0.00 0.25 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.54 2x1c s ILE 318 N -0.15 1.16 -0.29 2.00 1.01 -0.25 -1.67 121.20 123.01 2x1c s ILE 318 Ca 0.02 -0.42 -0.14 0.00 0.00 0.00 0.00 60.65 60.11 2x1c s ILE 318 Cb -0.05 -1.11 -0.03 0.00 0.01 0.00 0.00 42.46 41.27 2x1c s ILE 318 CO -0.00 0.38 0.34 -0.31 0.00 0.00 0.00 174.94 175.35 2x1c s TYR 319 N 1.23 3.23 -0.79 3.97 2.02 0.24 -0.77 117.35 126.48 2x1c s TYR 319 Ca -0.04 0.27 -0.19 0.00 -0.37 0.00 0.00 57.07 56.75 2x1c s TYR 319 Cb -0.14 -2.56 0.13 0.00 -0.40 0.00 0.00 41.96 38.99 2x1c s TYR 319 CO -0.03 -0.26 0.95 0.34 -1.57 0.00 0.00 175.55 174.98 2x1c s ASP 320 N 1.68 6.47 0.32 2.29 -1.08 0.02 -2.43 116.67 123.94 2x1c s ASP 320 Ca 0.13 -1.82 -0.00 0.00 -0.52 0.00 0.00 52.55 50.33 2x1c s ASP 320 Cb -0.16 -2.35 0.52 0.00 -1.46 0.00 0.00 42.92 39.46 2x1c s ASP 320 CO 0.11 -1.07 1.95 0.45 0.52 0.00 0.00 175.17 177.13 2x1c h HIS 321 N 8.89 0.89 -0.73 -5.34 3.86 -1.75 -0.82 115.15 120.15 2x1c h HIS 321 Ca -0.03 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2x1c h HIS 321 Cb 1.05 -0.29 -0.04 0.00 1.06 0.00 0.00 27.41 29.19 2x1c h HIS 321 CO 1.04 0.60 0.49 0.00 0.86 0.00 0.00 177.93 180.92 2x1c h ALA 322 N 1.50 1.51 -0.01 2.45 0.00 -1.87 -3.03 119.26 119.81 2x1c h ALA 322 Ca 0.24 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2x1c h ALA 322 Cb -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2x1c h ALA 322 CO -0.04 0.44 -0.29 0.54 0.00 0.00 0.00 179.25 179.89 2x1c n ARG 323 N -4.44 1.59 -3.80 0.00 1.74 -0.96 -5.00 116.66 105.79 2x1c n ARG 323 Ca 0.08 -0.98 -0.26 0.00 -0.77 0.00 0.00 57.85 55.92 2x1c n ARG 323 Cb 0.07 -1.32 0.01 0.00 -1.02 0.00 0.00 32.46 30.20 2x1c n ARG 323 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2x1c n ARG 324 N 0.11 -3.05 -4.69 5.56 0.63 -0.35 -5.02 116.66 109.85 2x1c n ARG 324 Ca 0.08 0.48 -0.24 0.00 -0.92 0.00 0.00 57.85 57.25 2x1c n ARG 324 Cb 0.38 -4.59 -0.15 0.00 0.45 0.00 0.00 32.46 28.56 2x1c n ARG 324 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2x1c s GLU 325 N -6.20 1.31 -0.19 -0.14 2.02 -1.11 -4.52 118.70 109.86 2x1c s GLU 325 Ca 0.15 -0.72 0.01 0.00 0.02 0.00 0.00 54.97 54.43 2x1c s GLU 325 Cb -0.05 -1.31 0.02 0.00 0.10 0.00 0.00 34.13 32.89 2x1c s GLU 325 CO 0.86 0.35 -0.18 0.00 0.02 0.00 0.00 175.26 176.30 2x1c s ALA 326 N -0.58 2.38 -0.23 5.21 0.00 -0.61 -0.80 121.76 127.13 2x1c s ALA 326 Ca 0.06 -1.28 -0.14 0.00 0.00 0.00 0.00 51.96 50.60 2x1c s ALA 326 Cb -0.07 -1.25 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 2x1c s ALA 326 CO 0.00 -0.44 0.32 0.99 0.00 0.00 0.00 175.76 176.63 2x1c s THR 327 N 1.28 5.24 -0.12 0.00 2.01 0.05 -0.07 115.64 124.03 2x1c s THR 327 Ca 0.04 0.52 -0.01 0.00 0.31 0.00 0.00 61.69 62.54 2x1c s THR 327 Cb -0.14 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 2x1c s THR 327 CO -0.12 0.26 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.31 2x1c s VAL 328 N 1.38 3.54 -0.21 3.82 1.01 0.40 -1.09 120.40 129.26 2x1c s VAL 328 Ca 0.15 -0.50 0.01 0.00 0.00 0.00 0.00 61.98 61.64 2x1c s VAL 328 Cb -0.15 -2.51 0.03 0.00 0.00 0.00 0.00 36.38 33.75 2x1c s VAL 328 CO 0.07 0.53 -0.15 -0.13 0.00 0.00 0.00 175.10 175.42 2x1c s ARG 329 N 0.07 2.87 0.21 2.72 0.52 -0.18 -1.63 118.95 123.54 2x1c s ARG 329 Ca -0.02 -0.92 -0.28 0.00 -0.52 0.00 0.00 55.73 53.98 2x1c s ARG 329 Cb -0.14 -2.72 -0.09 0.00 0.52 0.00 0.00 34.95 32.53 2x1c s ARG 329 CO 0.03 -0.30 0.88 -1.17 0.02 0.00 0.00 175.30 174.77 2x1c s LEU 330 N 1.28 4.62 0.00 2.53 2.96 -0.21 -0.92 118.68 128.94 2x1c s LEU 330 Ca 0.02 1.83 0.00 0.00 -0.22 0.00 0.00 54.13 55.76 2x1c s LEU 330 Cb -0.15 -3.49 0.00 0.00 0.50 0.00 0.00 46.19 43.05 2x1c s LEU 330 CO -0.10 0.17 0.00 0.61 -1.32 0.00 0.00 176.35 175.71 2x1c n GLY 331 N 1.56 -0.78 3.71 7.98 0.00 0.45 0.08 105.19 118.18 2x1c n GLY 331 Ca -0.03 -1.31 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 2x1c n GLY 331 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x1c s ARG 332 N 0.00 4.42 0.64 1.61 0.52 -1.22 -3.57 118.95 121.35 2x1c s ARG 332 Ca 0.00 0.93 0.31 0.00 -0.52 0.00 0.00 55.73 56.44 2x1c s ARG 332 Cb 0.00 -3.47 1.68 0.00 0.52 0.00 0.00 34.95 33.68 2x1c s ARG 332 CO 0.00 -0.01 1.99 -1.35 0.02 0.00 0.00 175.30 175.95 2x1c h PRO 333 N 6.87 0.00 0.00 3.54 0.11 -1.89 0.65 132.00 141.28 2x1c h PRO 333 Ca -0.39 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.69 2x1c h PRO 333 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2x1c h PRO 333 CO 0.76 0.00 -0.12 1.79 -0.21 0.00 0.00 178.00 180.22 2x1c h THR 334 N 0.00 0.96 -0.49 -1.15 1.35 -1.86 -3.39 112.91 108.33 2x1c h THR 334 Ca 0.06 -0.44 -0.16 0.00 -0.55 0.00 0.00 66.41 65.32 2x1c h THR 334 Cb 0.69 1.24 -0.15 0.00 -1.73 0.00 0.00 68.15 68.20 2x1c h THR 334 CO -0.00 0.12 -0.44 -3.20 -0.25 0.00 0.00 175.52 171.75 2x1c n ASN 335 N -4.21 -2.99 -4.76 5.36 5.15 0.17 -5.15 115.26 108.84 2x1c n ASN 335 Ca -0.03 -2.88 -0.37 0.00 -0.60 0.00 0.00 54.58 50.71 2x1c n ASN 335 Cb 0.20 1.66 0.01 0.00 -0.53 0.00 0.00 39.78 41.12 2x1c n ASN 335 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 2x1c s PRO 336 N 0.77 3.48 0.23 1.20 0.02 -0.88 -4.45 135.00 135.36 2x1c s PRO 336 Ca 0.30 1.93 0.01 0.00 0.02 0.00 0.00 61.00 63.27 2x1c s PRO 336 Cb 0.11 -2.31 0.23 0.00 0.02 0.00 0.00 34.50 32.56 2x1c s PRO 336 CO -0.14 -0.83 1.57 -0.44 -0.33 0.00 0.00 177.00 176.83 2x1c h ASP 337 N 1.73 0.43 -5.00 2.53 3.32 -0.64 -3.47 116.42 115.33 2x1c h ASP 337 Ca -0.50 -0.22 0.04 0.00 0.02 0.00 0.00 57.03 56.37 2x1c h ASP 337 Cb 1.27 -0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.61 2x1c h ASP 337 CO 0.59 0.88 0.26 -1.83 -1.72 0.00 0.00 179.24 177.41 2x1c s GLU 338 N -3.97 1.45 -0.09 3.56 -1.05 -1.24 -4.98 118.70 112.38 2x1c s GLU 338 Ca -0.06 -0.68 -0.07 0.00 -0.15 0.00 0.00 54.97 54.02 2x1c s GLU 338 Cb 0.12 0.57 0.03 0.00 -0.44 0.00 0.00 34.13 34.41 2x1c s GLU 338 CO 0.81 -0.65 0.22 1.41 0.95 0.00 0.00 175.26 178.00 2x1c s MET 339 N -3.74 0.23 0.16 -4.83 1.75 -1.26 -1.04 119.30 110.56 2x1c s MET 339 Ca 0.06 0.37 -0.16 0.00 -1.25 0.00 0.00 55.69 54.71 2x1c s MET 339 Cb -0.03 0.03 0.03 0.00 2.84 0.00 0.00 34.83 37.70 2x1c s MET 339 CO -0.04 -0.08 0.43 -0.59 -0.65 0.00 0.00 175.02 174.10 2x1c s PHE 340 N 0.50 -0.10 -0.14 4.11 -0.12 -0.64 -5.01 117.98 116.58 2x1c s PHE 340 Ca -0.03 -0.24 0.01 0.00 -0.05 0.00 0.00 56.93 56.62 2x1c s PHE 340 Cb -0.05 0.27 -0.00 0.00 -0.63 0.00 0.00 43.02 42.61 2x1c s PHE 340 CO -0.03 -0.78 -0.16 0.08 -0.05 0.00 0.00 175.22 174.28 2x1c s VAL 341 N -3.85 2.64 -0.08 -2.49 1.01 -1.26 -0.45 120.40 115.92 2x1c s VAL 341 Ca 0.07 -0.79 -0.16 0.00 0.00 0.00 0.00 61.98 61.10 2x1c s VAL 341 Cb 0.01 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 2x1c s VAL 341 CO -0.07 0.53 0.41 -0.04 0.00 0.00 0.00 175.10 175.92 2x1c s MET 342 N 0.63 4.14 0.01 2.72 -1.94 0.91 -4.93 119.30 120.84 2x1c s MET 342 Ca -0.09 0.36 -0.03 0.00 -1.71 0.00 0.00 55.69 54.22 2x1c s MET 342 Cb -0.16 -3.34 -0.01 0.00 2.01 0.00 0.00 34.83 33.33 2x1c s MET 342 CO 0.03 0.41 0.04 1.03 -0.01 0.00 0.00 175.02 176.51 2x1c s ARG 343 N -0.15 0.38 -0.07 2.03 0.52 -1.26 -1.58 118.95 118.83 2x1c s ARG 343 Ca 0.23 -0.52 -0.20 0.00 -0.52 0.00 0.00 55.73 54.71 2x1c s ARG 343 Cb -0.15 0.15 -0.04 0.00 0.52 0.00 0.00 34.95 35.42 2x1c s ARG 343 CO 0.10 -0.08 0.58 -0.06 0.02 0.00 0.00 175.30 175.86 2x1c s PHE 344 N -1.43 3.59 0.54 -0.53 0.08 -1.26 -5.08 117.98 113.88 2x1c s PHE 344 Ca -0.15 1.09 0.09 0.00 0.12 0.00 0.00 56.93 58.08 2x1c s PHE 344 Cb -0.09 -2.64 0.07 0.00 -0.57 0.00 0.00 43.02 39.79 2x1c s PHE 344 CO 0.00 0.21 0.74 0.16 -0.10 0.00 0.00 175.22 176.23 2x1c s ASP 345 N 0.40 5.21 0.46 1.36 1.47 -1.26 -4.97 116.67 119.35 2x1c s ASP 345 Ca 0.31 -0.76 0.22 0.00 1.18 0.00 0.00 52.55 53.49 2x1c s ASP 345 Cb -0.17 0.10 1.13 0.00 -0.34 0.00 0.00 42.92 43.64 2x1c s ASP 345 CO 0.15 -1.22 1.96 -0.33 0.68 0.00 0.00 175.17 176.40 2x1c h GLU 346 N 0.28 0.00 -0.40 2.11 5.08 -1.99 -1.50 114.58 118.16 2x1c h GLU 346 Ca -0.32 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.93 2x1c h GLU 346 Cb 1.29 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2x1c h GLU 346 CO 0.42 0.21 -0.21 1.49 -1.00 0.00 0.00 179.01 179.92 2x1c h GLU 347 N 0.00 0.79 -1.00 2.33 4.57 -1.99 -0.23 114.58 119.05 2x1c h GLU 347 Ca -0.00 -0.31 0.03 0.00 -1.18 0.00 0.00 59.36 57.89 2x1c h GLU 347 Cb 0.48 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 28.98 2x1c h GLU 347 CO 0.03 0.93 0.66 -0.44 -1.18 0.00 0.00 179.01 179.01 2x1c h ASP 348 N 0.69 1.11 0.45 1.04 3.32 -1.67 -2.38 116.42 118.98 2x1c h ASP 348 Ca 0.10 -0.02 -0.21 0.00 0.02 0.00 0.00 57.03 56.92 2x1c h ASP 348 Cb 0.72 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 2x1c h ASP 348 CO 0.06 0.77 -0.90 -0.33 -1.72 0.00 0.00 179.24 177.12 2x1c h GLU 349 N 1.29 0.31 -0.63 3.56 5.08 -1.19 -2.98 114.58 120.02 2x1c h GLU 349 Ca 0.39 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2x1c h GLU 349 Cb -0.05 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2x1c h GLU 349 CO -0.11 1.03 0.37 -0.09 -1.00 0.00 0.00 179.01 179.21 2x1c h ARG 350 N 0.17 0.86 -0.51 2.33 2.43 -0.85 -2.01 114.38 116.81 2x1c h ARG 350 Ca -0.06 -0.08 0.01 0.00 -0.81 0.00 0.00 59.98 59.04 2x1c h ARG 350 Cb 1.53 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.87 2x1c h ARG 350 CO 0.15 0.63 0.32 1.03 -1.51 0.00 0.00 179.97 180.59 2x1c h SER 351 N 0.86 0.55 0.28 -3.80 0.87 -1.42 -1.78 113.55 109.09 2x1c h SER 351 Ca 0.23 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.75 2x1c h SER 351 Cb -0.01 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 61.82 2x1c h SER 351 CO -0.04 0.39 -0.12 0.00 -0.53 0.00 0.00 176.83 176.53 2x1c h ALA 352 N 1.20 1.40 0.00 6.23 0.00 -1.30 -1.17 119.26 125.62 2x1c h ALA 352 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2x1c h ALA 352 Cb -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2x1c h ALA 352 CO -0.06 0.15 -0.62 1.28 0.00 0.00 0.00 179.25 180.00 2x1c n LEU 353 N -3.81 0.58 -3.52 0.00 4.77 -0.79 -4.03 117.00 110.19 2x1c n LEU 353 Ca -0.02 -0.02 -0.20 0.00 -0.03 0.00 0.00 56.01 55.74 2x1c n LEU 353 Cb 0.22 -0.20 0.08 0.00 -2.33 0.00 0.00 43.42 41.19 2x1c n LEU 353 CO 0.31 0.11 0.16 -3.20 -1.33 0.00 0.00 177.39 173.44 2x1c n ASN 354 N -1.62 -3.87 -0.60 -1.43 5.15 -0.58 -4.81 115.26 107.50 2x1c n ASN 354 Ca 0.05 -0.60 0.07 0.00 -0.60 0.00 0.00 54.58 53.51 2x1c n ASN 354 Cb 0.36 -5.03 0.06 0.00 -0.53 0.00 0.00 39.78 34.64 2x1c n ASN 354 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66