#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gli s ILE 2 N 0.00 3.32 -0.24 1.12 1.01 -0.85 -4.81 121.20 120.75 3gli s ILE 2 Ca 0.00 0.28 -0.25 0.00 0.00 0.00 0.00 60.65 60.68 3gli s ILE 2 Cb 0.00 -3.57 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 3gli s ILE 2 CO 0.00 -0.45 0.84 -0.13 0.00 0.00 0.00 174.94 175.20 3gli s ARG 3 N 6.53 4.20 0.15 2.79 0.52 -1.26 -0.98 118.95 130.89 3gli s ARG 3 Ca 0.81 0.98 0.08 0.00 -0.52 0.00 0.00 55.73 57.07 3gli s ARG 3 Cb -0.20 -3.64 -0.04 0.00 0.52 0.00 0.00 34.95 31.59 3gli s ARG 3 CO 0.29 -0.51 -0.16 -0.51 0.02 0.00 0.00 175.30 174.43 3gli s LEU 4 N 2.81 2.44 0.00 2.53 1.43 0.10 -4.98 118.68 123.00 3gli s LEU 4 Ca 0.36 -0.86 -0.06 0.00 -1.03 0.00 0.00 54.13 52.54 3gli s LEU 4 Cb -0.15 -0.72 -0.05 0.00 0.03 0.00 0.00 46.19 45.30 3gli s LEU 4 CO 0.08 -0.09 0.25 -0.31 0.23 0.00 0.00 176.35 176.51 3gli s TYR 5 N -2.17 3.57 0.37 0.29 2.02 -1.26 -0.71 117.35 119.46 3gli s TYR 5 Ca 0.14 0.53 0.10 0.00 -0.37 0.00 0.00 57.07 57.47 3gli s TYR 5 Cb -0.05 -1.96 0.85 0.00 -0.40 0.00 0.00 41.96 40.40 3gli s TYR 5 CO 0.05 0.62 1.88 -1.35 -1.57 0.00 0.00 175.55 175.18 3gli h PRO 6 N 3.99 0.63 0.17 -1.71 0.11 -1.96 0.15 132.00 133.38 3gli h PRO 6 Ca -0.50 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.59 3gli h PRO 6 Cb 1.20 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 3gli h PRO 6 CO 0.66 0.42 -0.29 1.05 -0.21 0.00 0.00 178.00 179.63 3gli h GLU 7 N 0.65 -0.52 -0.07 1.05 4.11 -1.94 -2.59 114.58 115.27 3gli h GLU 7 Ca 0.43 0.04 0.02 0.00 0.07 0.00 0.00 59.36 59.92 3gli h GLU 7 Cb 0.73 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.10 3gli h GLU 7 CO -0.19 -0.35 0.07 1.96 0.07 0.00 0.00 179.01 180.57 3gli h GLN 8 N -0.54 0.00 -0.75 1.06 4.20 -1.13 -3.25 115.11 114.70 3gli h GLN 8 Ca 0.02 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.83 3gli h GLN 8 Cb 0.55 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.25 3gli h GLN 8 CO -0.14 0.00 0.38 1.25 -0.67 0.00 0.00 178.83 179.64 3gli h LEU 9 N 0.00 0.48 -0.92 1.46 5.85 -0.94 -2.88 115.31 118.37 3gli h LEU 9 Ca 0.03 0.07 0.16 0.00 0.84 0.00 0.00 57.88 58.98 3gli h LEU 9 Cb 0.17 -0.01 -0.10 0.00 0.37 0.00 0.00 40.66 41.08 3gli h LEU 9 CO -0.00 0.26 0.51 0.03 -0.34 0.00 0.00 178.44 178.91 3gli h ARG 10 N 0.62 0.69 -0.19 1.25 2.47 -1.70 -0.68 114.38 116.84 3gli h ARG 10 Ca 0.38 -0.04 -0.11 0.00 -1.26 0.00 0.00 59.98 58.94 3gli h ARG 10 Cb 0.42 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.59 3gli h ARG 10 CO -0.29 0.46 -0.33 0.00 0.56 0.00 0.00 179.97 180.37 3gli h ALA 11 N 1.58 0.29 0.00 0.04 0.00 -1.77 -3.19 119.26 116.22 3gli h ALA 11 Ca 0.50 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3gli h ALA 11 Cb 0.71 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3gli h ALA 11 CO -0.36 0.33 -0.27 0.37 0.00 0.00 0.00 179.25 179.33 3gli h GLN 12 N 0.21 0.00 0.00 0.00 5.75 -1.30 -2.78 115.11 117.00 3gli h GLN 12 Ca 0.01 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 3gli h GLN 12 Cb 0.91 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.46 3gli h GLN 12 CO 0.07 0.27 -0.09 -0.07 -2.65 0.00 0.00 178.83 176.37 3gli h LEU 13 N 0.00 0.00 0.19 -2.39 3.38 -1.20 -3.27 115.31 112.02 3gli h LEU 13 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 3gli h LEU 13 Cb 0.54 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.30 3gli h LEU 13 CO 0.04 0.09 -1.72 0.78 0.09 0.00 0.00 178.44 177.71 3gli h ASN 14 N 0.00 0.62 -0.21 -0.43 2.35 -1.49 -3.35 115.58 113.07 3gli h ASN 14 Ca -0.00 -0.94 0.04 0.00 -0.55 0.00 0.00 56.30 54.86 3gli h ASN 14 Cb 0.98 -0.20 -0.07 0.00 0.05 0.00 0.00 38.32 39.07 3gli h ASN 14 CO 0.01 1.78 -0.49 -0.33 -1.65 0.00 0.00 177.43 176.75 3gli h GLU 15 N 0.08 -0.48 -1.87 0.81 4.39 -1.56 -3.44 114.58 112.52 3gli h GLU 15 Ca -0.34 0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.44 3gli h GLU 15 Cb 2.08 0.11 -0.23 0.00 -0.10 0.00 0.00 28.75 30.61 3gli h GLU 15 CO 0.17 -0.32 0.12 0.20 -1.16 0.00 0.00 179.01 178.03 3gli s GLY 16 N -2.44 -0.46 0.62 -3.84 0.00 -1.23 -5.15 107.32 94.82 3gli s GLY 16 Ca -0.15 2.63 -0.16 0.00 0.00 0.00 0.00 44.72 47.03 3gli s GLY 16 CO 0.63 2.47 1.12 1.08 0.00 0.00 0.00 173.10 178.40 3gli s LEU 17 N 1.57 3.50 0.17 0.66 1.02 -1.26 -4.67 118.68 119.67 3gli s LEU 17 Ca -0.10 2.06 0.06 0.00 0.02 0.00 0.00 54.13 56.17 3gli s LEU 17 Cb -0.05 -4.56 -0.05 0.00 0.02 0.00 0.00 46.19 41.56 3gli s LEU 17 CO -0.19 -1.51 -0.12 -0.13 0.02 0.00 0.00 176.35 174.42 3gli s ARG 18 N -3.84 1.17 0.22 1.70 0.52 -1.26 -5.06 118.95 112.39 3gli s ARG 18 Ca 0.69 -1.50 -0.09 0.00 -0.52 0.00 0.00 55.73 54.31 3gli s ARG 18 Cb -0.22 -0.83 0.23 0.00 0.52 0.00 0.00 34.95 34.66 3gli s ARG 18 CO 0.37 0.12 1.84 0.00 0.02 0.00 0.00 175.30 177.65 3gli h ALA 19 N 2.71 0.97 -3.16 2.13 0.00 -1.89 -3.41 119.26 116.62 3gli h ALA 19 Ca -0.37 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 53.86 3gli h ALA 19 Cb 1.20 -0.20 -0.31 0.00 0.00 0.00 0.00 17.79 18.48 3gli h ALA 19 CO 0.63 0.19 -0.81 0.00 0.00 0.00 0.00 179.25 179.25 3gli s ALA 20 N -6.10 2.46 -0.29 0.00 0.00 -1.26 -2.17 121.76 114.40 3gli s ALA 20 Ca -0.13 -1.09 -0.04 0.00 0.00 0.00 0.00 51.96 50.70 3gli s ALA 20 Cb 0.16 -1.23 0.03 0.00 0.00 0.00 0.00 23.12 22.08 3gli s ALA 20 CO 0.77 -0.11 0.03 0.71 0.00 0.00 0.00 175.76 177.16 3gli s TYR 21 N 0.94 3.16 -0.58 0.00 2.02 0.51 -0.98 117.35 122.43 3gli s TYR 21 Ca -0.03 -1.40 -0.12 0.00 -0.37 0.00 0.00 57.07 55.15 3gli s TYR 21 Cb -0.15 -2.17 0.15 0.00 -0.40 0.00 0.00 41.96 39.39 3gli s TYR 21 CO -0.03 -0.69 0.50 -0.51 -1.57 0.00 0.00 175.55 173.25 3gli s LEU 22 N 1.38 6.07 -0.82 -1.29 1.43 0.54 -1.14 118.68 124.84 3gli s LEU 22 Ca -0.00 -2.10 -0.19 0.00 -1.03 0.00 0.00 54.13 50.81 3gli s LEU 22 Cb -0.18 -2.11 0.13 0.00 0.03 0.00 0.00 46.19 44.06 3gli s LEU 22 CO -0.00 -0.71 0.99 -0.76 0.23 0.00 0.00 176.35 176.10 3gli s LEU 23 N 1.10 5.26 -0.05 1.79 1.43 0.22 -1.11 118.68 127.32 3gli s LEU 23 Ca 0.08 -1.89 -0.01 0.00 -1.03 0.00 0.00 54.13 51.27 3gli s LEU 23 Cb -0.24 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.58 3gli s LEU 23 CO -0.01 -1.06 0.04 -0.76 0.23 0.00 0.00 176.35 174.79 3gli s LEU 24 N 2.52 3.76 0.00 1.79 1.43 -1.03 -1.90 118.68 125.25 3gli s LEU 24 Ca 0.26 0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 3gli s LEU 24 Cb -0.10 -2.02 0.00 0.00 0.03 0.00 0.00 46.19 44.10 3gli s LEU 24 CO -0.04 0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.48 3gli n GLY 25 N 1.71 -1.75 0.00 -3.19 0.00 0.50 -0.76 105.19 101.70 3gli n GLY 25 Ca -0.16 -1.48 0.02 0.00 0.00 0.00 0.00 46.02 44.39 3gli n GLY 25 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3gli n ASN 26 N 3.00 3.13 -4.73 1.61 0.23 -0.79 -3.43 115.26 114.28 3gli n ASN 26 Ca 0.00 -0.15 -0.38 0.00 -0.53 0.00 0.00 54.58 53.52 3gli n ASN 26 Cb 0.00 1.12 -0.06 0.00 -2.08 0.00 0.00 39.78 38.76 3gli n ASN 26 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3gli s ASP 27 N -2.14 6.72 0.19 0.53 -1.08 0.53 -4.91 116.67 116.52 3gli s ASP 27 Ca -0.01 0.86 0.04 0.00 -0.52 0.00 0.00 52.55 52.93 3gli s ASP 27 Cb 0.02 -2.29 0.09 0.00 -1.46 0.00 0.00 42.92 39.28 3gli s ASP 27 CO 0.15 0.02 1.44 -0.65 0.52 0.00 0.00 175.17 176.66 3gli h PRO 28 N 6.52 0.17 0.07 4.34 0.11 -1.95 -2.42 132.00 138.83 3gli h PRO 28 Ca -0.42 -0.16 -0.24 0.00 0.11 0.00 0.00 66.00 65.29 3gli h PRO 28 Cb 1.18 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3gli h PRO 28 CO 0.74 0.87 -1.14 1.25 -0.21 0.00 0.00 178.00 179.52 3gli h LEU 29 N 0.10 0.22 -0.28 2.35 5.85 -1.96 -2.50 115.31 119.09 3gli h LEU 29 Ca -0.03 -0.24 -0.19 0.00 0.84 0.00 0.00 57.88 58.26 3gli h LEU 29 Cb 1.37 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.33 3gli h LEU 29 CO 0.12 1.19 -0.57 -0.07 -0.34 0.00 0.00 178.44 178.77 3gli h LEU 30 N 0.04 0.99 0.29 2.25 3.38 -1.90 -2.51 115.31 117.86 3gli h LEU 30 Ca -0.08 -0.54 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 3gli h LEU 30 Cb 1.88 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.35 3gli h LEU 30 CO 0.17 1.34 -0.14 -0.07 0.09 0.00 0.00 178.44 179.83 3gli h LEU 31 N 0.67 -0.33 -0.27 1.67 3.38 -1.47 -0.97 115.31 117.99 3gli h LEU 31 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3gli h LEU 31 Cb 1.18 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 3gli h LEU 31 CO 0.13 -0.23 0.06 1.56 0.09 0.00 0.00 178.44 180.05 3gli h GLN 32 N -0.40 0.43 -0.05 1.13 1.08 -1.52 0.12 115.11 115.90 3gli h GLN 32 Ca -0.04 -0.11 -0.03 0.00 -1.45 0.00 0.00 58.65 57.02 3gli h GLN 32 Cb 0.31 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 3gli h GLN 32 CO 0.07 0.53 -0.12 0.93 -0.95 0.00 0.00 178.83 179.29 3gli h GLU 33 N 0.26 0.08 0.15 1.46 5.08 -1.45 0.36 114.58 120.53 3gli h GLU 33 Ca 0.08 -0.01 -0.31 0.00 -1.00 0.00 0.00 59.36 58.12 3gli h GLU 33 Cb 0.29 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3gli h GLU 33 CO 0.00 0.21 -1.53 0.77 -1.00 0.00 0.00 179.01 177.46 3gli h SER 34 N 0.08 0.49 0.49 1.42 0.02 -0.99 -2.28 113.55 112.78 3gli h SER 34 Ca 0.02 -0.64 -0.09 0.00 -0.84 0.00 0.00 61.79 60.23 3gli h SER 34 Cb 0.26 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 3gli h SER 34 CO 0.02 1.53 -0.45 -0.61 -1.14 0.00 0.00 176.83 176.17 3gli h GLN 35 N 0.09 0.00 0.00 3.45 4.15 -0.36 -2.70 115.11 119.74 3gli h GLN 35 Ca -0.25 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.11 3gli h GLN 35 Cb 2.04 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.72 3gli h GLN 35 CO 0.18 0.45 -1.13 -0.44 -1.93 0.00 0.00 178.83 175.97 3gli h ASP 36 N 0.00 0.00 0.22 -0.69 3.32 -0.40 -2.37 116.42 116.50 3gli h ASP 36 Ca -0.00 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 3gli h ASP 36 Cb 0.82 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 3gli h ASP 36 CO 0.06 0.22 -0.40 0.00 -1.72 0.00 0.00 179.24 177.40 3gli h ALA 37 N 1.78 1.12 0.00 3.45 0.00 -1.32 -2.56 119.26 121.74 3gli h ALA 37 Ca -0.06 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.39 3gli h ALA 37 Cb 1.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3gli h ALA 37 CO 0.02 0.58 -0.34 0.28 0.00 0.00 0.00 179.25 179.79 3gli h VAL 38 N 0.20 1.51 -0.93 0.00 2.07 -1.53 -3.10 116.25 114.47 3gli h VAL 38 Ca 0.02 -2.26 0.24 0.00 0.82 0.00 0.00 66.70 65.51 3gli h VAL 38 Cb 0.80 2.99 -0.06 0.00 -1.52 0.00 0.00 31.29 33.49 3gli h VAL 38 CO 0.06 0.51 0.64 0.03 0.02 0.00 0.00 177.57 178.83 3gli h ARG 39 N -1.00 0.24 -0.14 1.57 2.47 -1.52 0.96 114.38 116.96 3gli h ARG 39 Ca -0.09 -0.01 -0.08 0.00 -1.26 0.00 0.00 59.98 58.53 3gli h ARG 39 Cb 1.05 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 29.32 3gli h ARG 39 CO -0.06 0.16 -0.24 0.37 0.56 0.00 0.00 179.97 180.77 3gli h GLN 40 N 0.24 0.41 -0.00 0.04 4.15 -1.58 -2.79 115.11 115.59 3gli h GLN 40 Ca 0.48 -0.25 0.00 0.00 0.77 0.00 0.00 58.65 59.65 3gli h GLN 40 Cb 1.46 0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.17 3gli h GLN 40 CO -0.13 0.84 -0.04 0.28 -1.93 0.00 0.00 178.83 177.86 3gli n VAL 41 N -4.46 0.00 -0.08 2.39 0.31 -0.69 -2.67 118.33 113.13 3gli n VAL 41 Ca -0.07 -0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.12 3gli n VAL 41 Cb 0.43 -0.43 -0.12 0.00 -0.91 0.00 0.00 33.84 32.81 3gli n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gli h ALA 42 N 3.09 0.05 -0.83 3.52 0.00 -0.86 -3.17 119.26 121.06 3gli h ALA 42 Ca 0.00 -0.61 0.05 0.00 0.00 0.00 0.00 54.91 54.35 3gli h ALA 42 Cb 0.46 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 3gli h ALA 42 CO 0.00 0.14 0.51 0.00 0.00 0.00 0.00 179.25 179.91 3gli h ALA 43 N -0.15 1.12 -0.46 0.00 0.00 -1.55 -1.63 119.26 116.58 3gli h ALA 43 Ca -0.07 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.89 3gli h ALA 43 Cb 1.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3gli h ALA 43 CO -0.04 0.28 0.31 0.00 0.00 0.00 0.00 179.25 179.80 3gli h ALA 44 N 1.38 1.94 -0.51 0.00 0.00 -1.65 -1.16 119.26 119.26 3gli h ALA 44 Ca 0.35 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 55.05 3gli h ALA 44 Cb 0.12 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 17.70 3gli h ALA 44 CO -0.15 -0.02 0.25 1.04 0.00 0.00 0.00 179.25 180.36 3gli n GLN 45 N -4.47 2.35 -0.38 0.00 1.13 -0.78 -4.84 117.38 110.38 3gli n GLN 45 Ca 0.06 -1.84 0.00 0.00 -1.94 0.00 0.00 57.00 53.28 3gli n GLN 45 Cb 0.25 -1.80 0.00 0.00 0.11 0.00 0.00 30.24 28.80 3gli n GLN 45 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3gli n GLY 46 N -0.17 0.79 3.60 1.08 0.00 -0.46 -4.98 105.19 105.04 3gli n GLY 46 Ca 0.29 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3gli n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gli s PHE 47 N -2.00 3.20 -0.05 1.61 0.40 -0.68 -3.85 117.98 116.61 3gli s PHE 47 Ca 0.00 0.57 -0.05 0.00 -0.60 0.00 0.00 56.93 56.85 3gli s PHE 47 Cb 0.00 -3.06 -0.02 0.00 0.51 0.00 0.00 43.02 40.45 3gli s PHE 47 CO 0.00 -0.52 -0.11 -0.85 0.70 0.00 0.00 175.22 174.44 3gli n GLU 48 N 5.97 0.16 -1.59 0.44 0.28 -0.63 -3.78 120.64 121.48 3gli n GLU 48 Ca -0.00 0.06 -0.44 0.00 -0.16 0.00 0.00 57.16 56.62 3gli n GLU 48 Cb 0.49 -0.73 -0.04 0.00 1.43 0.00 0.00 31.44 32.59 3gli n GLU 48 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3gli n GLU 49 N -3.14 2.00 -3.98 3.44 1.02 -1.24 -4.87 120.64 113.88 3gli n GLU 49 Ca -0.04 0.59 -0.34 0.00 -0.02 0.00 0.00 57.16 57.35 3gli n GLU 49 Cb 0.16 -3.10 -0.14 0.00 -0.02 0.00 0.00 31.44 28.33 3gli n GLU 49 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3gli s HIS 50 N 7.54 3.27 -0.17 -0.32 3.76 -1.26 -0.63 115.29 127.48 3gli s HIS 50 Ca 1.00 -2.08 -0.03 0.00 -0.15 0.00 0.00 55.06 53.80 3gli s HIS 50 Cb -0.42 -2.05 -0.01 0.00 1.11 0.00 0.00 32.58 31.21 3gli s HIS 50 CO 0.38 -0.84 -0.07 -1.01 -0.85 0.00 0.00 174.74 172.35 3gli s HIS 51 N 1.18 2.92 0.10 1.40 3.76 -0.10 -4.97 115.29 119.58 3gli s HIS 51 Ca -0.07 -0.69 0.06 0.00 -0.15 0.00 0.00 55.06 54.21 3gli s HIS 51 Cb -0.20 -1.98 -0.04 0.00 1.11 0.00 0.00 32.58 31.47 3gli s HIS 51 CO -0.03 -0.31 -0.04 0.95 -0.85 0.00 0.00 174.74 174.46 3gli s THR 52 N 0.83 3.78 -0.17 1.30 -4.23 -1.26 -0.74 115.64 115.14 3gli s THR 52 Ca -0.02 -1.10 -0.11 0.00 -1.18 0.00 0.00 61.69 59.28 3gli s THR 52 Cb -0.15 -2.79 0.06 0.00 1.34 0.00 0.00 72.50 70.96 3gli s THR 52 CO 0.01 0.11 0.43 0.12 -0.54 0.00 0.00 174.62 174.76 3gli s PHE 53 N -1.28 -0.59 -0.30 3.99 5.36 -0.92 -4.95 117.98 119.28 3gli s PHE 53 Ca 0.24 1.30 -0.07 0.00 -0.96 0.00 0.00 56.93 57.44 3gli s PHE 53 Cb -0.11 0.26 0.01 0.00 -0.34 0.00 0.00 43.02 42.83 3gli s PHE 53 CO 0.17 -0.32 0.10 -1.54 -1.46 0.00 0.00 175.22 172.16 3gli s SER 54 N 1.11 5.22 -0.62 6.13 1.04 -1.26 -1.37 113.70 123.95 3gli s SER 54 Ca -0.07 -0.74 -0.23 0.00 0.48 0.00 0.00 55.95 55.39 3gli s SER 54 Cb -0.07 -1.90 0.06 0.00 0.10 0.00 0.00 66.02 64.21 3gli s SER 54 CO -0.10 -0.21 0.96 -0.63 0.98 0.00 0.00 173.24 174.24 3gli s ILE 55 N 1.51 4.33 0.53 -1.02 1.01 -0.01 -4.83 121.20 122.72 3gli s ILE 55 Ca 0.02 -0.13 0.04 0.00 0.00 0.00 0.00 60.65 60.58 3gli s ILE 55 Cb -0.17 -4.64 0.04 0.00 0.01 0.00 0.00 42.46 37.70 3gli s ILE 55 CO 0.03 -1.35 0.74 -1.81 0.00 0.00 0.00 174.94 172.55 3gli s ASP 56 N 3.39 5.26 0.03 3.58 1.11 -1.26 -2.71 116.67 126.07 3gli s ASP 56 Ca 0.25 -0.26 0.04 0.00 0.18 0.00 0.00 52.55 52.76 3gli s ASP 56 Cb -0.15 -0.59 0.19 0.00 1.07 0.00 0.00 42.92 43.44 3gli s ASP 56 CO 0.13 -1.13 1.13 -2.65 1.18 0.00 0.00 175.17 173.82 3gli n PRO 57 N -2.24 0.01 -0.07 8.23 -0.02 -1.26 -3.34 135.00 136.31 3gli n PRO 57 Ca 0.10 0.48 -0.13 0.00 -2.02 0.00 0.00 63.50 61.92 3gli n PRO 57 Cb 0.60 -1.54 -0.06 0.00 -0.02 0.00 0.00 33.50 32.48 3gli n PRO 57 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 3gli h ASN 58 N 0.00 0.56 -0.54 2.55 4.21 -1.96 -3.44 115.58 116.96 3gli h ASN 58 Ca 0.00 -0.49 -0.66 0.00 1.21 0.00 0.00 56.30 56.36 3gli h ASN 58 Cb 0.04 -0.16 -0.04 0.00 -1.12 0.00 0.00 38.32 37.04 3gli h ASN 58 CO 0.00 0.94 1.46 0.41 -1.29 0.00 0.00 177.43 178.94 3gli n THR 59 N -4.40 0.07 -0.14 2.81 -1.04 -1.21 -4.92 114.28 105.44 3gli n THR 59 Ca -0.05 -0.16 -0.09 0.00 -2.04 0.00 0.00 64.05 61.71 3gli n THR 59 Cb 0.43 -1.11 0.08 0.00 -1.82 0.00 0.00 70.33 67.91 3gli n THR 59 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3gli n ASP 60 N 9.53 -2.29 -0.18 8.00 9.92 -1.26 -4.80 116.55 135.48 3gli n ASP 60 Ca 0.50 -0.25 0.14 0.00 -0.53 0.00 0.00 54.79 54.66 3gli n ASP 60 Cb 0.12 -0.34 0.60 0.00 -0.64 0.00 0.00 41.12 40.86 3gli n ASP 60 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 3gli n TRP 61 N -3.64 0.00 0.02 1.24 7.02 -1.26 -3.35 117.44 117.47 3gli n TRP 61 Ca 0.04 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.50 3gli n TRP 61 Cb 0.17 -0.13 -0.09 0.00 -2.42 0.00 0.00 31.31 28.84 3gli n TRP 61 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 3gli h ASN 62 N 0.86 0.00 0.92 -0.99 2.35 -1.97 -3.21 115.58 113.54 3gli h ASN 62 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3gli h ASN 62 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 3gli h ASN 62 CO 0.00 0.68 -0.89 0.00 -1.65 0.00 0.00 177.43 175.56 3gli h ALA 63 N 1.32 0.51 0.00 -0.83 0.00 -1.88 -3.08 119.26 115.30 3gli h ALA 63 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3gli h ALA 63 Cb 1.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.47 3gli h ALA 63 CO 0.05 0.00 -0.77 1.51 0.00 0.00 0.00 179.25 180.04 3gli n ILE 64 N -2.46 0.12 1.18 0.00 3.06 -1.21 -3.97 119.36 116.08 3gli n ILE 64 Ca 0.01 -0.14 0.12 0.00 -2.50 0.00 0.00 62.75 60.25 3gli n ILE 64 Cb 0.51 0.25 0.29 0.00 0.54 0.00 0.00 39.64 41.22 3gli n ILE 64 CO 0.00 0.00 0.00 0.33 -2.50 0.00 0.00 176.55 174.38 3gli n PHE 65 N -1.78 0.00 0.90 9.51 7.35 -1.21 -3.13 117.46 129.10 3gli n PHE 65 Ca 0.04 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.83 3gli n PHE 65 Cb 0.39 -0.10 -0.09 0.00 0.35 0.00 0.00 39.48 40.03 3gli n PHE 65 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 3gli n SER 66 N -0.60 0.86 -0.01 -2.13 3.41 -1.16 -3.93 113.62 110.07 3gli n SER 66 Ca 0.11 -0.82 -0.18 0.00 -0.26 0.00 0.00 58.87 57.72 3gli n SER 66 Cb 0.37 1.00 -0.14 0.00 -0.26 0.00 0.00 64.21 65.18 3gli n SER 66 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3gli n LEU 67 N -1.58 2.19 0.14 1.04 4.77 -1.23 -2.67 117.00 119.66 3gli n LEU 67 Ca 0.03 0.24 0.02 0.00 -0.03 0.00 0.00 56.01 56.27 3gli n LEU 67 Cb 0.35 -0.78 0.11 0.00 -2.33 0.00 0.00 43.42 40.78 3gli n LEU 67 CO 0.42 0.74 0.49 0.00 -1.33 0.00 0.00 177.39 177.71 3gli h GLN 69 N 0.00 0.00 -0.31 0.00 5.75 -1.71 -3.34 115.11 115.49 3gli h GLN 69 Ca -0.01 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.58 3gli h GLN 69 Cb 1.27 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.81 3gli h GLN 69 CO 0.07 0.21 0.28 0.00 -2.65 0.00 0.00 178.83 176.74 3gli h ALA 70 N 1.79 2.09 -2.97 3.38 0.00 -1.27 -3.37 119.26 118.91 3gli h ALA 70 Ca -0.00 -0.01 -0.71 0.00 0.00 0.00 0.00 54.91 54.19 3gli h ALA 70 Cb 0.93 0.02 -0.32 0.00 0.00 0.00 0.00 17.79 18.42 3gli h ALA 70 CO 0.03 -0.44 -0.50 0.00 0.00 0.00 0.00 179.25 178.34 3gli s MET 71 N -4.79 2.25 -0.03 0.00 0.23 -1.26 -5.05 119.30 110.65 3gli s MET 71 Ca -0.05 -1.72 0.01 0.00 -1.03 0.00 0.00 55.69 52.91 3gli s MET 71 Cb 0.17 -3.68 0.02 0.00 -1.53 0.00 0.00 34.83 29.80 3gli s MET 71 CO 0.62 -1.06 -0.04 0.45 -2.03 0.00 0.00 175.02 172.96 3gli s SER 72 N 2.07 0.78 0.12 -1.18 0.15 -1.26 -5.08 113.70 109.29 3gli s SER 72 Ca 0.06 -0.10 -0.09 0.00 0.70 0.00 0.00 55.95 56.52 3gli s SER 72 Cb -0.24 -0.35 -0.06 0.00 -1.71 0.00 0.00 66.02 63.67 3gli s SER 72 CO -0.02 -0.04 0.42 -0.76 1.20 0.00 0.00 173.24 174.03 3gli s LEU 73 N 0.77 4.30 -0.37 3.45 1.02 -1.26 -3.63 118.68 122.97 3gli s LEU 73 Ca -0.10 0.76 -0.13 0.00 0.02 0.00 0.00 54.13 54.68 3gli s LEU 73 Cb -0.13 -3.16 0.00 0.00 0.02 0.00 0.00 46.19 42.92 3gli s LEU 73 CO -0.00 0.11 0.25 0.72 0.02 0.00 0.00 176.35 177.45 3gli s PHE 74 N -1.52 3.23 -0.11 0.29 -0.12 -1.26 -5.19 117.98 113.30 3gli s PHE 74 Ca 0.37 -0.45 -0.02 0.00 -0.05 0.00 0.00 56.93 56.77 3gli s PHE 74 Cb -0.13 -2.50 -0.03 0.00 -0.63 0.00 0.00 43.02 39.73 3gli s PHE 74 CO 0.20 -0.48 -0.00 0.00 -0.05 0.00 0.00 175.22 174.89 3gli s ALA 75 N 1.68 3.23 0.10 1.99 0.00 -1.24 -5.07 121.76 122.45 3gli s ALA 75 Ca 0.05 -0.81 -0.36 0.00 0.00 0.00 0.00 51.96 50.84 3gli s ALA 75 Cb -0.18 -1.52 -0.16 0.00 0.00 0.00 0.00 23.12 21.26 3gli s ALA 75 CO 0.10 0.49 1.39 -1.13 0.00 0.00 0.00 175.76 176.60 3gli n SER 76 N 2.52 1.96 -4.59 0.00 3.41 -1.26 -4.70 113.62 110.95 3gli n SER 76 Ca -0.18 1.11 -0.59 0.00 -0.26 0.00 0.00 58.87 58.95 3gli n SER 76 Cb 0.53 -1.24 -0.08 0.00 -0.26 0.00 0.00 64.21 63.16 3gli n SER 76 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3gli n ARG 77 N 2.72 0.38 -4.79 4.33 1.74 -1.25 -4.63 116.66 115.16 3gli n ARG 77 Ca 0.18 0.14 -0.27 0.00 -0.77 0.00 0.00 57.85 57.13 3gli n ARG 77 Cb 0.21 -1.69 -0.17 0.00 -1.02 0.00 0.00 32.46 29.80 3gli n ARG 77 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3gli s GLN 78 N 1.08 2.04 -0.41 5.56 -2.07 0.09 -1.61 119.66 124.35 3gli s GLN 78 Ca 0.93 -0.57 -0.16 0.00 -1.82 0.00 0.00 55.36 53.74 3gli s GLN 78 Cb -1.22 -1.65 0.02 0.00 -1.09 0.00 0.00 33.01 29.06 3gli s GLN 78 CO 0.61 0.11 0.38 0.99 -1.32 0.00 0.00 175.29 176.06 3gli s THR 79 N 0.45 5.15 -0.21 3.63 2.01 0.20 -2.24 115.64 124.63 3gli s THR 79 Ca -0.13 -0.40 -0.17 0.00 0.31 0.00 0.00 61.69 61.30 3gli s THR 79 Cb -0.15 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 3gli s THR 79 CO 0.05 -0.34 0.43 -0.22 -0.69 0.00 0.00 174.62 173.85 3gli s LEU 80 N 1.97 4.14 -0.10 4.42 2.96 -0.61 -0.92 118.68 130.54 3gli s LEU 80 Ca 0.10 0.53 -0.01 0.00 -0.22 0.00 0.00 54.13 54.53 3gli s LEU 80 Cb -0.18 -2.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.92 3gli s LEU 80 CO 0.12 -0.13 -0.05 -0.22 -1.32 0.00 0.00 176.35 174.75 3gli s LEU 81 N 1.52 3.22 -0.18 -0.68 2.96 0.08 -1.56 118.68 124.04 3gli s LEU 81 Ca 0.20 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 3gli s LEU 81 Cb -0.15 -1.73 0.04 0.00 0.50 0.00 0.00 46.19 44.85 3gli s LEU 81 CO 0.09 0.29 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.58 3gli s LEU 82 N -0.40 1.95 0.27 -0.68 1.43 -0.01 -2.18 118.68 119.07 3gli s LEU 82 Ca 0.06 -0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 52.26 3gli s LEU 82 Cb -0.12 -1.07 -0.08 0.00 0.03 0.00 0.00 46.19 44.95 3gli s LEU 82 CO 0.02 -0.17 0.62 -0.76 0.23 0.00 0.00 176.35 176.30 3gli s LEU 83 N 1.52 4.11 0.21 1.79 1.43 -0.47 -2.03 118.68 125.24 3gli s LEU 83 Ca -0.00 1.04 0.06 0.00 -1.03 0.00 0.00 54.13 54.20 3gli s LEU 83 Cb -0.16 -3.83 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 3gli s LEU 83 CO -0.08 -0.14 0.19 -0.76 0.23 0.00 0.00 176.35 175.79 3gli s LEU 84 N -2.95 3.87 0.71 1.79 1.02 -0.82 -0.83 118.68 121.47 3gli s LEU 84 Ca 0.50 -0.16 -0.11 0.00 0.02 0.00 0.00 54.13 54.38 3gli s LEU 84 Cb -0.11 -2.44 0.02 0.00 0.02 0.00 0.00 46.19 43.68 3gli s LEU 84 CO 0.21 0.01 1.07 -2.84 0.02 0.00 0.00 176.35 174.81 3gli s PRO 85 N -3.51 2.81 0.25 1.29 0.02 -1.10 -4.83 135.00 129.93 3gli s PRO 85 Ca 0.32 0.90 -0.04 0.00 0.02 0.00 0.00 61.00 62.21 3gli s PRO 85 Cb -0.09 -1.98 0.48 0.00 0.02 0.00 0.00 34.50 32.93 3gli s PRO 85 CO 0.25 -1.18 1.72 0.93 -0.33 0.00 0.00 177.00 178.39 3gli h GLU 86 N -0.77 0.39 0.00 5.54 4.39 -2.00 -1.68 114.58 120.45 3gli h GLU 86 Ca -0.44 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.23 3gli h GLU 86 Cb 1.22 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 3gli h GLU 86 CO 0.57 0.26 0.00 -0.91 -1.16 0.00 0.00 179.01 177.77 3gli h ASN 87 N 0.40 0.00 0.00 1.42 4.21 -1.98 -3.46 115.58 116.18 3gli h ASN 87 Ca 0.43 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.94 3gli h ASN 87 Cb 0.68 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.88 3gli h ASN 87 CO -0.43 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.32 3gli n GLY 88 N -0.29 0.35 3.55 2.83 0.00 -0.63 -4.81 105.19 106.20 3gli n GLY 88 Ca -0.00 -1.37 -0.40 0.00 0.00 0.00 0.00 46.02 44.25 3gli n GLY 88 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gli s PRO 89 N 0.00 3.31 0.75 1.61 0.02 -1.26 -4.39 135.00 135.03 3gli s PRO 89 Ca 0.00 -0.56 -0.11 0.00 0.02 0.00 0.00 61.00 60.35 3gli s PRO 89 Cb 0.00 -4.70 0.04 0.00 0.02 0.00 0.00 34.50 29.86 3gli s PRO 89 CO 0.00 -2.24 1.08 0.54 -0.33 0.00 0.00 177.00 176.05 3gli s ASN 90 N 4.58 4.87 0.50 2.53 2.20 -1.26 -4.51 114.94 123.85 3gli s ASN 90 Ca 0.42 1.50 0.29 0.00 -0.94 0.00 0.00 52.86 54.13 3gli s ASN 90 Cb -0.05 -2.29 1.39 0.00 -2.00 0.00 0.00 41.25 38.30 3gli s ASN 90 CO 0.05 -1.75 1.84 0.00 -2.94 0.00 0.00 177.10 174.30 3gli h ALA 91 N -0.94 2.74 -0.34 3.54 0.00 -1.97 1.49 119.26 123.80 3gli h ALA 91 Ca -0.45 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.27 3gli h ALA 91 Cb 1.24 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 3gli h ALA 91 CO 0.57 -1.05 -0.46 0.00 0.00 0.00 0.00 179.25 178.32 3gli h ALA 92 N 1.53 0.54 0.00 0.00 0.00 -2.01 -3.32 119.26 116.00 3gli h ALA 92 Ca 0.49 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3gli h ALA 92 Cb 1.76 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3gli h ALA 92 CO -0.07 0.68 -0.79 -0.89 0.00 0.00 0.00 179.25 178.17 3gli n ILE 93 N -4.03 0.00 0.29 0.00 5.41 -0.27 -3.83 119.36 116.93 3gli n ILE 93 Ca -0.03 -0.14 0.18 0.00 1.00 0.00 0.00 62.75 63.76 3gli n ILE 93 Cb 0.58 0.96 0.83 0.00 -0.71 0.00 0.00 39.64 41.30 3gli n ILE 93 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 3gli h ASN 94 N 0.00 0.00 0.17 4.38 -0.73 0.19 -2.45 115.58 117.14 3gli h ASN 94 Ca 0.00 0.00 -0.35 0.00 1.87 0.00 0.00 56.30 57.82 3gli h ASN 94 Cb 0.39 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 38.94 3gli h ASN 94 CO 0.00 0.02 -2.05 -0.62 -0.37 0.00 0.00 177.43 174.41 3gli n GLU 95 N -3.15 0.71 -0.29 6.67 1.02 -1.25 -3.69 120.64 120.65 3gli n GLU 95 Ca -0.01 0.23 -0.01 0.00 -0.02 0.00 0.00 57.16 57.36 3gli n GLU 95 Cb 0.24 -1.68 0.18 0.00 -0.02 0.00 0.00 31.44 30.16 3gli n GLU 95 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3gli h GLN 96 N 0.04 1.15 0.60 3.49 4.20 -1.64 -3.08 115.11 119.86 3gli h GLN 96 Ca -0.43 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.18 3gli h GLN 96 Cb 2.02 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 29.54 3gli h GLN 96 CO 0.05 0.76 -0.34 -0.07 -0.67 0.00 0.00 178.83 178.56 3gli h LEU 97 N 1.18 -0.85 -0.74 1.46 3.38 -1.59 -2.62 115.31 115.52 3gli h LEU 97 Ca 0.32 0.04 0.19 0.00 0.09 0.00 0.00 57.88 58.52 3gli h LEU 97 Cb -0.13 0.24 -0.14 0.00 0.09 0.00 0.00 40.66 40.73 3gli h LEU 97 CO -0.07 -0.55 -0.03 0.18 0.09 0.00 0.00 178.44 178.06 3gli n LEU 98 N -5.49 -0.13 0.14 1.67 4.77 -1.17 0.27 117.00 117.07 3gli n LEU 98 Ca -0.13 1.27 0.13 0.00 -0.03 0.00 0.00 56.01 57.25 3gli n LEU 98 Cb 0.38 -0.44 0.65 0.00 -2.33 0.00 0.00 43.42 41.67 3gli n LEU 98 CO 0.35 -1.27 1.12 0.74 -1.33 0.00 0.00 177.39 177.00 3gli h THR 99 N 0.00 0.90 0.00 -5.08 2.02 -1.43 -2.62 112.91 106.70 3gli h THR 99 Ca 0.43 -0.01 -0.23 0.00 0.77 0.00 0.00 66.41 67.37 3gli h THR 99 Cb 0.84 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 68.08 3gli h THR 99 CO -0.72 0.00 -1.57 0.18 0.37 0.00 0.00 175.52 173.79 3gli n LEU 100 N -4.47 0.85 0.20 2.58 4.77 0.14 -4.26 117.00 116.81 3gli n LEU 100 Ca 0.02 0.39 0.18 0.00 -0.03 0.00 0.00 56.01 56.57 3gli n LEU 100 Cb 0.30 0.12 0.82 0.00 -2.33 0.00 0.00 43.42 42.33 3gli n LEU 100 CO 0.35 0.26 1.16 0.71 -1.33 0.00 0.00 177.39 178.54 3gli h THR 101 N 0.00 0.34 0.00 -5.08 1.35 -1.08 -1.78 112.91 106.65 3gli h THR 101 Ca -0.22 0.00 -0.28 0.00 -0.55 0.00 0.00 66.41 65.35 3gli h THR 101 Cb 1.79 0.76 -0.05 0.00 -1.73 0.00 0.00 68.15 68.92 3gli h THR 101 CO 0.06 0.00 -1.75 0.61 -0.25 0.00 0.00 175.52 174.19 3gli n GLY 102 N -1.38 -1.03 3.57 5.82 0.00 -1.26 -4.65 105.19 106.27 3gli n GLY 102 Ca 0.03 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 3gli n GLY 102 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gli s LEU 103 N -5.96 3.64 -0.30 0.99 1.43 -0.67 -4.93 118.68 112.87 3gli s LEU 103 Ca -0.05 -2.06 -0.00 0.00 -1.03 0.00 0.00 54.13 50.99 3gli s LEU 103 Cb 0.08 -2.58 0.10 0.00 0.03 0.00 0.00 46.19 43.82 3gli s LEU 103 CO 0.82 -1.54 0.08 -0.76 0.23 0.00 0.00 176.35 175.18 3gli s LEU 104 N 5.45 2.60 0.58 1.79 1.43 -1.26 -5.00 118.68 124.27 3gli s LEU 104 Ca 0.55 -1.65 0.09 0.00 -1.03 0.00 0.00 54.13 52.09 3gli s LEU 104 Cb 0.02 -0.99 0.08 0.00 0.03 0.00 0.00 46.19 45.34 3gli s LEU 104 CO 0.04 -0.39 0.75 -1.00 0.23 0.00 0.00 176.35 175.98 3gli s HIS 105 N 1.50 1.36 -0.86 0.29 3.76 -1.26 -4.99 115.29 115.10 3gli s HIS 105 Ca 0.08 -0.76 0.26 0.00 -0.15 0.00 0.00 55.06 54.49 3gli s HIS 105 Cb -0.18 -2.16 0.62 0.00 1.11 0.00 0.00 32.58 31.97 3gli s HIS 105 CO -0.21 -1.11 1.51 -0.25 -0.85 0.00 0.00 174.74 173.84 3gli n ASP 106 N -2.20 0.50 0.05 1.40 9.92 -1.26 -4.10 116.55 120.86 3gli n ASP 106 Ca 0.14 0.09 -0.06 0.00 -0.53 0.00 0.00 54.79 54.43 3gli n ASP 106 Cb 0.62 -0.02 -0.11 0.00 -0.64 0.00 0.00 41.12 40.98 3gli n ASP 106 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 3gli h ASP 107 N 0.00 0.00 -3.27 -2.24 3.32 -1.94 -3.45 116.42 108.84 3gli h ASP 107 Ca 0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 3gli h ASP 107 Cb 0.60 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 39.85 3gli h ASP 107 CO 0.00 0.93 -0.78 -0.76 -1.72 0.00 0.00 179.24 176.90 3gli s LEU 108 N -6.52 2.57 -0.24 1.55 2.01 -1.26 -0.73 118.68 116.06 3gli s LEU 108 Ca 0.00 -0.47 -0.04 0.00 0.01 0.00 0.00 54.13 53.63 3gli s LEU 108 Cb 0.09 -1.61 -0.00 0.00 0.01 0.00 0.00 46.19 44.68 3gli s LEU 108 CO 0.81 0.04 -0.01 -0.22 1.01 0.00 0.00 176.35 177.98 3gli s LEU 109 N 1.10 3.17 -0.02 1.79 2.96 -0.95 -4.24 118.68 122.49 3gli s LEU 109 Ca 0.00 -0.52 -0.25 0.00 -0.22 0.00 0.00 54.13 53.14 3gli s LEU 109 Cb -0.14 -1.77 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 3gli s LEU 109 CO -0.04 -0.07 0.75 -0.22 -1.32 0.00 0.00 176.35 175.45 3gli s LEU 110 N 1.47 4.37 -0.01 -0.68 2.96 -0.92 -1.57 118.68 124.29 3gli s LEU 110 Ca 0.04 1.33 0.02 0.00 -0.22 0.00 0.00 54.13 55.30 3gli s LEU 110 Cb -0.15 -3.18 -0.00 0.00 0.50 0.00 0.00 46.19 43.35 3gli s LEU 110 CO -0.02 -0.08 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.24 3gli s ILE 111 N 0.51 0.49 -0.04 6.68 1.01 -0.60 -0.36 121.20 128.89 3gli s ILE 111 Ca 0.39 -0.25 -0.00 0.00 0.00 0.00 0.00 60.65 60.80 3gli s ILE 111 Cb -0.19 -0.42 0.03 0.00 0.01 0.00 0.00 42.46 41.88 3gli s ILE 111 CO 0.21 0.15 -0.00 -0.69 0.00 0.00 0.00 174.94 174.60 3gli s VAL 112 N -0.04 0.23 -0.16 2.92 1.01 -0.29 -0.83 120.40 123.24 3gli s VAL 112 Ca 0.01 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.09 3gli s VAL 112 Cb -0.04 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 36.02 3gli s VAL 112 CO -0.00 0.18 -0.18 -0.60 0.00 0.00 0.00 175.10 174.50 3gli s ARG 113 N 1.28 2.69 0.09 2.72 3.52 -0.86 0.71 118.95 129.10 3gli s ARG 113 Ca -0.06 -0.71 -0.15 0.00 -0.13 0.00 0.00 55.73 54.68 3gli s ARG 113 Cb -0.13 -2.36 0.05 0.00 -1.56 0.00 0.00 34.95 30.95 3gli s ARG 113 CO -0.02 -0.21 0.72 0.41 -0.81 0.00 0.00 175.30 175.38 3gli n GLY 114 N 4.65 0.74 0.00 8.12 0.00 -0.80 -1.94 105.19 115.96 3gli n GLY 114 Ca -0.19 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.78 3gli n GLY 114 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gli n ASN 115 N -0.99 -0.34 -4.84 1.61 3.02 -1.22 -0.37 115.26 112.13 3gli n ASN 115 Ca -0.00 -0.16 -0.34 0.00 -0.03 0.00 0.00 54.58 54.05 3gli n ASN 115 Cb 0.38 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.49 3gli n ASN 115 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 3gli s LYS 116 N -0.98 4.08 0.10 3.52 -2.85 -1.26 -3.26 119.74 119.08 3gli s LYS 116 Ca 0.00 0.68 -0.01 0.00 -1.00 0.00 0.00 55.97 55.64 3gli s LYS 116 Cb 0.00 -2.69 -0.04 0.00 -2.06 0.00 0.00 37.83 33.03 3gli s LYS 116 CO 0.00 0.31 0.27 -0.51 0.10 0.00 0.00 175.35 175.52 3gli s LEU 117 N -2.44 4.32 0.48 2.77 1.43 -1.26 -4.90 118.68 119.09 3gli s LEU 117 Ca 0.47 0.37 -0.24 0.00 -1.03 0.00 0.00 54.13 53.70 3gli s LEU 117 Cb -0.13 -3.08 -0.07 0.00 0.03 0.00 0.00 46.19 42.94 3gli s LEU 117 CO 0.19 0.12 1.34 -0.94 0.23 0.00 0.00 176.35 177.30 3gli s SER 118 N -2.56 5.73 0.42 2.29 1.04 -1.26 -4.78 113.70 114.58 3gli s SER 118 Ca 0.37 2.73 0.19 0.00 0.48 0.00 0.00 55.95 59.72 3gli s SER 118 Cb -0.13 -2.64 1.11 0.00 0.10 0.00 0.00 66.02 64.47 3gli s SER 118 CO 0.27 -1.25 1.82 0.11 0.98 0.00 0.00 173.24 175.16 3gli h LYS 119 N 1.99 0.37 -0.11 4.02 1.57 -1.99 -0.38 116.57 122.05 3gli h LYS 119 Ca -0.50 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.07 3gli h LYS 119 Cb 1.27 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 3gli h LYS 119 CO 0.60 0.25 -0.69 0.00 -0.57 0.00 0.00 179.45 179.03 3gli h ALA 120 N 1.60 0.59 -0.16 3.86 0.00 -1.97 -1.19 119.26 121.99 3gli h ALA 120 Ca 0.53 -0.58 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3gli h ALA 120 Cb 1.37 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.07 3gli h ALA 120 CO -0.22 0.74 -0.04 1.96 0.00 0.00 0.00 179.25 181.68 3gli h GLN 121 N 0.33 -0.01 0.25 0.00 1.08 -1.46 -2.91 115.11 112.40 3gli h GLN 121 Ca -0.02 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.18 3gli h GLN 121 Cb 1.27 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.66 3gli h GLN 121 CO 0.12 -0.01 -0.48 0.93 -0.95 0.00 0.00 178.83 178.45 3gli h GLU 122 N -0.01 -0.77 -0.15 1.46 5.08 -1.06 -2.79 114.58 116.35 3gli h GLU 122 Ca 0.08 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3gli h GLU 122 Cb 0.13 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.55 3gli h GLU 122 CO -0.17 -0.51 0.00 0.09 -1.00 0.00 0.00 179.01 177.42 3gli n ASN 123 N -5.50 0.15 -4.67 1.42 3.02 -0.47 -4.48 115.26 104.72 3gli n ASN 123 Ca -0.09 -1.49 -0.42 0.00 -0.03 0.00 0.00 54.58 52.54 3gli n ASN 123 Cb 0.42 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.49 3gli n ASN 123 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gli s ALA 124 N -1.80 3.63 0.00 5.41 0.00 -1.05 -4.83 121.76 123.11 3gli s ALA 124 Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.07 3gli s ALA 124 Cb 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 23.12 19.37 3gli s ALA 124 CO 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 175.76 174.41 3gli n ALA 125 N 6.76 0.00 -0.33 0.00 0.00 -1.26 -0.22 120.51 125.46 3gli n ALA 125 Ca 0.17 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.85 3gli n ALA 125 Cb 0.42 0.00 0.47 0.00 0.00 0.00 0.00 19.45 20.33 3gli n ALA 125 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 3gli h TRP 126 N 0.00 0.82 -0.05 0.00 5.08 -1.91 -0.95 115.95 118.95 3gli h TRP 126 Ca 0.00 0.04 -0.00 0.00 1.08 0.00 0.00 58.89 60.01 3gli h TRP 126 Cb 0.00 -0.20 -0.00 0.00 -3.00 0.00 0.00 29.16 25.96 3gli h TRP 126 CO 0.00 -0.23 0.02 0.35 -1.28 0.00 0.00 178.44 177.30 3gli h PHE 127 N 0.25 0.08 0.00 0.12 3.57 -0.85 -2.01 116.94 118.11 3gli h PHE 127 Ca 0.73 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 62.22 3gli h PHE 127 Cb 1.69 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.40 3gli h PHE 127 CO -0.05 0.21 0.00 1.15 -2.23 0.00 0.00 178.31 177.38 3gli h THR 128 N -0.07 0.00 0.05 4.41 2.02 -1.28 -1.37 112.91 116.67 3gli h THR 128 Ca 0.02 -0.58 -0.26 0.00 0.77 0.00 0.00 66.41 66.36 3gli h THR 128 Cb 0.16 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.08 3gli h THR 128 CO -0.00 0.00 -1.28 0.00 0.37 0.00 0.00 175.52 174.61 3gli h ALA 129 N 2.22 0.34 -0.93 6.16 0.00 -1.32 -3.08 119.26 122.66 3gli h ALA 129 Ca 0.00 -1.04 -0.01 0.00 0.00 0.00 0.00 54.91 53.87 3gli h ALA 129 Cb 0.69 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 3gli h ALA 129 CO 0.00 1.22 0.55 -0.07 0.00 0.00 0.00 179.25 180.95 3gli h LEU 130 N 0.03 1.12 -0.00 0.00 3.38 -1.09 -3.40 115.31 115.35 3gli h LEU 130 Ca -0.13 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.77 3gli h LEU 130 Cb 1.91 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.37 3gli h LEU 130 CO 0.15 0.87 -0.00 0.00 0.09 0.00 0.00 178.44 179.54 3gli n ALA 131 N -2.40 -0.00 0.24 1.53 0.00 -0.54 -0.43 120.51 118.90 3gli n ALA 131 Ca 0.10 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.63 3gli n ALA 131 Cb 0.07 0.01 0.60 0.00 0.00 0.00 0.00 19.45 20.12 3gli n ALA 131 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 3gli h ASN 132 N 0.00 0.00 0.17 0.00 -1.24 -1.79 0.81 115.58 113.54 3gli h ASN 132 Ca 0.00 0.00 -0.19 0.00 0.71 0.00 0.00 56.30 56.82 3gli h ASN 132 Cb 0.00 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.05 3gli h ASN 132 CO -0.00 0.15 -0.75 0.03 -1.29 0.00 0.00 177.43 175.57 3gli h ARG 133 N 0.00 0.49 -6.50 6.67 3.08 -1.04 -3.41 114.38 113.67 3gli h ARG 133 Ca -0.00 -0.41 -0.53 0.00 0.07 0.00 0.00 59.98 59.11 3gli h ARG 133 Cb 0.31 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 3gli h ARG 133 CO 0.02 1.04 0.08 -1.54 -1.07 0.00 0.00 179.97 178.50 3gli s SER 134 N -7.01 7.06 -0.13 7.04 1.04 -0.51 -3.55 113.70 117.66 3gli s SER 134 Ca -0.07 1.39 -0.05 0.00 0.48 0.00 0.00 55.95 57.70 3gli s SER 134 Cb 0.10 -2.41 -0.04 0.00 0.10 0.00 0.00 66.02 63.78 3gli s SER 134 CO 0.86 0.08 0.06 -0.69 0.98 0.00 0.00 173.24 174.53 3gli s VAL 135 N -1.44 4.84 -0.07 5.02 1.01 -0.15 -2.01 120.40 127.60 3gli s VAL 135 Ca 0.40 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 62.37 3gli s VAL 135 Cb -0.17 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.11 3gli s VAL 135 CO 0.21 0.57 -0.15 -1.58 0.00 0.00 0.00 175.10 174.15 3gli s GLN 136 N -0.54 1.95 -0.08 2.72 0.74 -0.15 -0.34 119.66 123.96 3gli s GLN 136 Ca 0.11 -0.51 -0.00 0.00 0.05 0.00 0.00 55.36 55.00 3gli s GLN 136 Cb -0.12 -1.58 -0.03 0.00 1.10 0.00 0.00 33.01 32.38 3gli s GLN 136 CO 0.02 0.07 -0.05 0.08 -0.55 0.00 0.00 175.29 174.86 3gli s VAL 137 N 0.56 3.90 -0.35 1.34 1.01 -0.27 0.01 120.40 126.61 3gli s VAL 137 Ca -0.15 -0.40 -0.19 0.00 0.00 0.00 0.00 61.98 61.24 3gli s VAL 137 Cb -0.16 -2.61 -0.00 0.00 0.00 0.00 0.00 36.38 33.61 3gli s VAL 137 CO 0.05 0.60 0.57 -0.89 0.00 0.00 0.00 175.10 175.43 3gli s THR 138 N -0.79 4.96 -0.34 3.92 2.01 0.12 -2.48 115.64 123.03 3gli s THR 138 Ca 0.12 0.48 0.06 0.00 0.31 0.00 0.00 61.69 62.66 3gli s THR 138 Cb -0.11 -4.02 0.46 0.00 0.01 0.00 0.00 72.50 68.84 3gli s THR 138 CO 0.02 -0.25 1.34 0.00 -0.69 0.00 0.00 174.62 175.03 3gli s GLN 140 N -3.59 4.37 0.88 0.00 -1.52 -1.26 -0.35 119.66 118.19 3gli s GLN 140 Ca 0.52 1.56 -0.13 0.00 -1.95 0.00 0.00 55.36 55.35 3gli s GLN 140 Cb 0.42 -3.56 0.03 0.00 -0.22 0.00 0.00 33.01 29.68 3gli s GLN 140 CO 0.02 -0.42 0.56 2.41 -0.25 0.00 0.00 175.29 177.61 3gli n THR 141 N 4.64 0.67 -2.96 -0.19 -1.04 -1.26 -4.90 114.28 109.24 3gli n THR 141 Ca 0.10 -0.24 -0.35 0.00 -2.04 0.00 0.00 64.05 61.52 3gli n THR 141 Cb 0.47 -0.73 -0.06 0.00 -1.82 0.00 0.00 70.33 68.19 3gli n THR 141 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3gli s PRO 142 N -3.51 4.32 0.48 -2.82 0.02 -1.26 -5.06 135.00 127.17 3gli s PRO 142 Ca 0.61 1.03 0.02 0.00 0.02 0.00 0.00 61.00 62.68 3gli s PRO 142 Cb -0.26 -2.69 0.01 0.00 0.02 0.00 0.00 34.50 31.58 3gli s PRO 142 CO 0.63 0.27 0.70 -1.21 -0.33 0.00 0.00 177.00 177.05 3gli s GLU 143 N -2.31 2.82 0.42 5.54 0.41 -1.26 -4.71 118.70 119.61 3gli s GLU 143 Ca 0.50 -0.71 0.35 0.00 -0.41 0.00 0.00 54.97 54.70 3gli s GLU 143 Cb -0.15 -2.56 1.34 0.00 -1.78 0.00 0.00 34.13 30.97 3gli s GLU 143 CO 0.20 -0.44 1.27 0.94 -0.49 0.00 0.00 175.26 176.74 3gli n GLN 144 N -2.15 -0.01 -0.06 1.61 7.27 -1.26 0.17 117.38 122.95 3gli n GLN 144 Ca 0.05 0.94 -0.05 0.00 0.07 0.00 0.00 57.00 58.01 3gli n GLN 144 Cb 0.59 -2.03 -0.04 0.00 2.41 0.00 0.00 30.24 31.16 3gli n GLN 144 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3gli h ALA 145 N 1.01 0.01 0.00 1.69 0.00 -2.03 -3.36 119.26 116.57 3gli h ALA 145 Ca 0.75 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3gli h ALA 145 Cb 2.78 0.06 0.00 0.00 0.00 0.00 0.00 17.79 20.63 3gli h ALA 145 CO -0.16 0.06 0.00 1.96 0.00 0.00 0.00 179.25 181.11 3gli h GLN 146 N -1.00 0.00 0.33 0.00 4.20 -0.63 -3.38 115.11 114.62 3gli h GLN 146 Ca -0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3gli h GLN 146 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 3gli h GLN 146 CO -0.01 0.00 -0.16 1.25 -0.67 0.00 0.00 178.83 179.24 3gli h LEU 147 N 0.00 -0.38 -1.34 1.46 5.85 -1.47 -3.27 115.31 116.17 3gli h LEU 147 Ca 0.00 0.01 0.34 0.00 0.84 0.00 0.00 57.88 59.07 3gli h LEU 147 Cb 0.26 0.10 -0.11 0.00 0.37 0.00 0.00 40.66 41.27 3gli h LEU 147 CO 0.00 -0.13 0.73 -0.65 -0.34 0.00 0.00 178.44 178.05 3gli h PRO 148 N -0.72 0.25 -0.42 5.25 0.11 -1.81 0.68 132.00 135.35 3gli h PRO 148 Ca -0.05 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.12 3gli h PRO 148 Cb 0.34 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 31.33 3gli h PRO 148 CO 0.07 0.17 0.05 -0.09 -0.21 0.00 0.00 178.00 178.00 3gli h ARG 149 N 0.26 0.17 0.00 1.05 2.43 -1.83 -1.34 114.38 115.12 3gli h ARG 149 Ca 0.70 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.78 3gli h ARG 149 Cb 1.96 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 31.46 3gli h ARG 149 CO -0.38 0.11 -0.37 2.35 -1.51 0.00 0.00 179.97 180.17 3gli h TRP 150 N 0.18 0.00 0.47 2.20 7.01 0.28 -1.94 115.95 124.15 3gli h TRP 150 Ca 0.21 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.18 3gli h TRP 150 Cb 0.27 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.33 3gli h TRP 150 CO -0.23 0.37 -0.22 0.28 -2.79 0.00 0.00 178.44 175.84 3gli h VAL 151 N 0.00 0.48 0.00 2.65 2.07 -0.66 -2.19 116.25 118.61 3gli h VAL 151 Ca -0.00 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 3gli h VAL 151 Cb 0.72 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3gli h VAL 151 CO 0.05 0.06 -0.07 0.00 0.02 0.00 0.00 177.57 177.63 3gli h ALA 152 N -0.44 1.32 -0.01 1.67 0.00 -1.15 0.26 119.26 120.91 3gli h ALA 152 Ca -0.06 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 3gli h ALA 152 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3gli h ALA 152 CO 0.11 0.08 -0.25 0.00 0.00 0.00 0.00 179.25 179.19 3gli h ALA 153 N 1.93 0.05 0.00 0.00 0.00 -1.34 -1.71 119.26 118.19 3gli h ALA 153 Ca -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 3gli h ALA 153 Cb 0.21 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3gli h ALA 153 CO 0.01 0.09 -0.09 -0.09 0.00 0.00 0.00 179.25 179.17 3gli h ARG 154 N -0.44 0.00 -0.08 0.00 2.43 -1.09 -2.18 114.38 113.01 3gli h ARG 154 Ca -0.03 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 3gli h ARG 154 Cb 0.98 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3gli h ARG 154 CO 0.05 0.09 -0.05 0.00 -1.51 0.00 0.00 179.97 178.55 3gli h ALA 155 N 1.91 0.12 0.00 2.80 0.00 -0.43 -2.55 119.26 121.11 3gli h ALA 155 Ca -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3gli h ALA 155 Cb 0.69 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3gli h ALA 155 CO 0.01 -0.11 0.00 0.87 0.00 0.00 0.00 179.25 180.02 3gli h LYS 156 N -0.20 0.00 0.01 0.00 1.57 -1.26 -1.97 116.57 114.71 3gli h LYS 156 Ca 0.02 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.61 3gli h LYS 156 Cb 0.51 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 3gli h LYS 156 CO 0.01 0.00 -0.87 0.37 -0.57 0.00 0.00 179.45 178.39 3gli h GLN 157 N 0.00 0.06 -0.52 3.15 4.15 -1.25 -2.78 115.11 117.92 3gli h GLN 157 Ca 0.00 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.34 3gli h GLN 157 Cb 0.54 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.25 3gli h GLN 157 CO 0.00 0.89 0.00 1.28 -1.93 0.00 0.00 178.83 179.07 3gli n LEU 158 N -3.56 2.22 -0.39 -2.39 4.77 -0.95 -4.91 117.00 111.78 3gli n LEU 158 Ca -0.02 -1.12 -0.01 0.00 -0.03 0.00 0.00 56.01 54.84 3gli n LEU 158 Cb 0.82 -0.36 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3gli n LEU 158 CO 0.46 0.42 -0.01 -0.46 -1.33 0.00 0.00 177.39 176.47 3gli n ASN 159 N 0.36 -0.82 -4.83 -1.43 0.23 -0.94 -4.94 115.26 102.89 3gli n ASN 159 Ca 0.11 0.03 -0.32 0.00 -0.53 0.00 0.00 54.58 53.86 3gli n ASN 159 Cb 0.42 -0.99 -0.02 0.00 -2.08 0.00 0.00 39.78 37.11 3gli n ASN 159 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3gli s LEU 160 N -0.87 3.61 -0.26 -4.53 1.43 -0.78 -4.93 118.68 112.35 3gli s LEU 160 Ca 0.00 1.66 -0.06 0.00 -1.03 0.00 0.00 54.13 54.70 3gli s LEU 160 Cb 0.00 -4.52 -0.01 0.00 0.03 0.00 0.00 46.19 41.69 3gli s LEU 160 CO 0.00 -0.76 0.05 -1.61 0.23 0.00 0.00 176.35 174.26 3gli s GLU 161 N -4.00 3.40 -0.13 1.70 2.02 0.19 -3.90 118.70 117.98 3gli s GLU 161 Ca 0.61 -0.64 -0.09 0.00 0.02 0.00 0.00 54.97 54.87 3gli s GLU 161 Cb -0.12 -3.27 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 3gli s GLU 161 CO 0.32 -0.28 0.17 -0.51 0.02 0.00 0.00 175.26 174.99 3gli s LEU 162 N 1.54 4.34 0.43 1.80 1.43 -1.26 -1.41 118.68 125.55 3gli s LEU 162 Ca 0.05 0.45 -0.22 0.00 -1.03 0.00 0.00 54.13 53.39 3gli s LEU 162 Cb -0.16 -2.15 -0.10 0.00 0.03 0.00 0.00 46.19 43.82 3gli s LEU 162 CO 0.02 0.31 1.00 -1.81 0.23 0.00 0.00 176.35 176.10 3gli s ASP 163 N -0.54 6.72 0.32 2.29 1.11 -1.24 -4.89 116.67 120.45 3gli s ASP 163 Ca 0.14 1.86 0.11 0.00 0.18 0.00 0.00 52.55 54.84 3gli s ASP 163 Cb -0.12 -2.56 0.96 0.00 1.07 0.00 0.00 42.92 42.27 3gli s ASP 163 CO 0.03 -0.51 1.67 0.44 1.18 0.00 0.00 175.17 177.98 3gli h ASP 164 N 2.02 0.42 -0.35 0.27 3.32 -1.98 -0.26 116.42 119.86 3gli h ASP 164 Ca -0.49 0.18 -0.04 0.00 0.02 0.00 0.00 57.03 56.70 3gli h ASP 164 Cb 1.20 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.89 3gli h ASP 164 CO 0.61 -0.10 0.05 0.00 -1.72 0.00 0.00 179.24 178.08 3gli h ALA 165 N 1.81 0.47 0.01 3.45 0.00 -1.96 -2.57 119.26 120.46 3gli h ALA 165 Ca 0.67 -0.21 -0.25 0.00 0.00 0.00 0.00 54.91 55.12 3gli h ALA 165 Cb 1.45 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.12 3gli h ALA 165 CO -0.59 0.19 -1.01 0.00 0.00 0.00 0.00 179.25 177.83 3gli h ALA 166 N 0.90 0.23 -0.51 0.00 0.00 -1.60 -3.11 119.26 115.16 3gli h ALA 166 Ca 0.11 -0.71 0.10 0.00 0.00 0.00 0.00 54.91 54.40 3gli h ALA 166 Cb 0.38 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.11 3gli h ALA 166 CO 0.01 0.75 0.02 -0.97 0.00 0.00 0.00 179.25 179.06 3gli h ASN 167 N 0.31 -0.17 -0.80 0.00 -0.73 -1.08 0.77 115.58 113.88 3gli h ASN 167 Ca -0.11 0.12 0.15 0.00 1.87 0.00 0.00 56.30 58.32 3gli h ASN 167 Cb 1.66 0.20 -0.10 0.00 0.27 0.00 0.00 38.32 40.35 3gli h ASN 167 CO 0.19 -0.06 0.36 1.56 -0.37 0.00 0.00 177.43 179.11 3gli h GLN 168 N 0.14 0.50 0.02 6.67 4.20 -1.45 -1.28 115.11 123.91 3gli h GLN 168 Ca 0.26 -0.03 -0.22 0.00 0.06 0.00 0.00 58.65 58.71 3gli h GLN 168 Cb 0.39 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 3gli h GLN 168 CO -0.41 0.33 -0.97 0.28 -0.67 0.00 0.00 178.83 177.39 3gli h VAL 169 N 0.51 1.45 -0.36 -0.54 2.07 -1.03 -2.28 116.25 116.07 3gli h VAL 169 Ca 0.44 -2.60 -0.06 0.00 0.82 0.00 0.00 66.70 65.30 3gli h VAL 169 Cb 0.67 2.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 3gli h VAL 169 CO -0.39 0.77 -0.01 -0.07 0.02 0.00 0.00 177.57 177.88 3gli h LEU 170 N 0.17 0.63 -1.29 2.57 3.38 -0.67 -2.83 115.31 117.26 3gli h LEU 170 Ca -0.08 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 3gli h LEU 170 Cb 1.62 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.19 3gli h LEU 170 CO 0.16 0.79 -0.11 0.00 0.09 0.00 0.00 178.44 179.37 3gli h TYR 172 N 0.32 0.54 0.00 0.00 3.20 -1.37 -2.56 116.97 117.10 3gli h TYR 172 Ca 0.06 -0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 3gli h TYR 172 Cb 0.40 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 3gli h TYR 172 CO 0.01 0.60 -0.28 0.00 -1.64 0.00 0.00 178.16 176.85 3gli n TYR 174 N -3.25 0.00 -1.39 0.00 4.02 -0.55 -1.44 117.16 114.54 3gli n TYR 174 Ca 0.02 -0.07 -0.53 0.00 -0.01 0.00 0.00 57.90 57.30 3gli n TYR 174 Cb 0.58 -0.01 -0.07 0.00 -0.02 0.00 0.00 39.34 39.82 3gli n TYR 174 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 3gli n GLU 175 N -0.07 0.00 -0.75 -0.72 2.13 -0.97 -0.53 120.64 119.73 3gli n GLU 175 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3gli n GLU 175 Cb 0.14 -1.32 0.00 0.00 0.27 0.00 0.00 31.44 30.53 3gli n GLU 175 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3gli n GLY 176 N 1.50 1.46 2.33 8.31 0.00 -1.26 -2.16 105.19 115.37 3gli n GLY 176 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 3gli n GLY 176 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3gli n ASN 177 N 0.00 -0.33 -0.19 1.61 5.15 0.31 -4.43 115.26 117.38 3gli n ASN 177 Ca 0.00 -2.49 0.03 0.00 -0.60 0.00 0.00 54.58 51.52 3gli n ASN 177 Cb 0.00 -0.54 0.29 0.00 -0.53 0.00 0.00 39.78 39.00 3gli n ASN 177 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3gli h LEU 178 N 5.07 0.78 -0.93 1.20 3.38 -1.91 -2.68 115.31 120.22 3gli h LEU 178 Ca 0.20 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.17 3gli h LEU 178 Cb 0.90 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 3gli h LEU 178 CO 0.40 0.55 0.62 0.25 0.09 0.00 0.00 178.44 180.34 3gli h LEU 179 N 0.91 1.06 -0.59 1.67 5.85 -1.94 0.25 115.31 122.52 3gli h LEU 179 Ca 0.28 -0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.85 3gli h LEU 179 Cb -0.01 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 3gli h LEU 179 CO -0.07 0.76 -0.24 0.00 -0.34 0.00 0.00 178.44 178.55 3gli h ALA 180 N 1.35 0.78 -0.05 1.25 0.00 -1.84 -1.88 119.26 118.87 3gli h ALA 180 Ca 0.35 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3gli h ALA 180 Cb -0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3gli h ALA 180 CO -0.08 0.65 -0.05 1.25 0.00 0.00 0.00 179.25 181.02 3gli h LEU 181 N 0.75 -0.14 0.33 0.00 5.85 -1.04 0.34 115.31 121.39 3gli h LEU 181 Ca 0.10 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3gli h LEU 181 Cb 0.78 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 3gli h LEU 181 CO 0.06 -0.07 -0.24 0.00 -0.34 0.00 0.00 178.44 177.86 3gli h ALA 182 N 0.98 -0.55 0.00 1.25 0.00 -0.42 -1.49 119.26 119.03 3gli h ALA 182 Ca 0.04 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3gli h ALA 182 Cb 0.11 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3gli h ALA 182 CO -0.08 -0.83 -0.02 1.96 0.00 0.00 0.00 179.25 180.28 3gli h GLN 183 N -0.56 0.00 0.26 0.00 4.20 -1.31 -1.11 115.11 116.59 3gli h GLN 183 Ca -0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3gli h GLN 183 Cb 0.48 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3gli h GLN 183 CO 0.01 0.02 -0.13 0.00 -0.67 0.00 0.00 178.83 178.06 3gli h ALA 184 N 1.98 -0.35 0.24 3.87 0.00 0.08 -0.15 119.26 124.93 3gli h ALA 184 Ca -0.00 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.79 3gli h ALA 184 Cb 0.05 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3gli h ALA 184 CO 0.00 -0.62 -0.43 -0.07 0.00 0.00 0.00 179.25 178.14 3gli h LEU 185 N -0.50 -1.22 -0.76 0.00 3.38 -0.52 0.33 115.31 116.02 3gli h LEU 185 Ca -0.04 0.12 0.17 0.00 0.09 0.00 0.00 57.88 58.23 3gli h LEU 185 Cb 0.37 0.44 -0.14 0.00 0.09 0.00 0.00 40.66 41.43 3gli h LEU 185 CO 0.06 -0.53 -0.05 -0.33 0.09 0.00 0.00 178.44 177.68 3gli h GLU 186 N -0.74 0.06 -0.76 1.13 5.08 -1.42 0.52 114.58 118.45 3gli h GLU 186 Ca -0.00 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3gli h GLU 186 Cb 0.71 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 3gli h GLU 186 CO -0.18 0.04 0.50 -0.09 -1.00 0.00 0.00 179.01 178.29 3gli h ARG 187 N 0.07 0.93 0.00 2.33 2.43 -0.07 -2.50 114.38 117.57 3gli h ARG 187 Ca 0.41 -0.06 -0.20 0.00 -0.81 0.00 0.00 59.98 59.32 3gli h ARG 187 Cb 0.70 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 3gli h ARG 187 CO -0.71 0.62 -0.87 -0.07 -1.51 0.00 0.00 179.97 177.43 3gli h LEU 188 N 0.96 0.27 -1.03 3.80 3.38 0.11 -2.13 115.31 120.67 3gli h LEU 188 Ca 0.30 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 3gli h LEU 188 Cb 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3gli h LEU 188 CO -0.08 1.01 -0.18 0.77 0.09 0.00 0.00 178.44 180.06 3gli h SER 189 N 0.12 0.00 0.99 -0.43 4.64 -0.79 0.28 113.55 118.35 3gli h SER 189 Ca -0.04 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.08 3gli h SER 189 Cb 1.49 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.55 3gli h SER 189 CO 0.13 0.18 -1.05 -0.07 -0.87 0.00 0.00 176.83 175.15 3gli h LEU 190 N 0.00 0.00 -0.22 5.97 3.38 -1.40 -3.30 115.31 119.74 3gli h LEU 190 Ca -0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 3gli h LEU 190 Cb 0.76 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.51 3gli h LEU 190 CO 0.02 0.86 -0.69 -0.07 0.09 0.00 0.00 178.44 178.65 3gli h LEU 191 N 0.00 0.95 -7.23 1.67 3.38 -0.67 -3.43 115.31 109.98 3gli h LEU 191 Ca -0.07 -0.58 -0.49 0.00 0.09 0.00 0.00 57.88 56.83 3gli h LEU 191 Cb 1.72 -0.28 -0.40 0.00 0.09 0.00 0.00 40.66 41.79 3gli h LEU 191 CO 0.10 1.38 -0.76 0.26 0.09 0.00 0.00 178.44 179.51 3gli s TRP 192 N -3.89 0.78 0.54 1.13 0.51 0.02 -4.98 118.94 113.04 3gli s TRP 192 Ca -0.10 -0.65 0.24 0.00 -2.12 0.00 0.00 56.10 53.47 3gli s TRP 192 Cb 0.09 -0.92 1.55 0.00 -0.81 0.00 0.00 33.47 33.39 3gli s TRP 192 CO 0.90 -0.56 2.19 -1.35 -0.51 0.00 0.00 176.95 177.62 3gli h PRO 193 N 8.30 0.00 -0.82 4.98 0.11 -1.84 -3.05 132.00 139.68 3gli h PRO 193 Ca -0.16 0.00 0.33 0.00 0.11 0.00 0.00 66.00 66.27 3gli h PRO 193 Cb 1.13 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.09 3gli h PRO 193 CO 0.32 0.03 0.38 -0.25 -0.21 0.00 0.00 178.00 178.26 3gli n ASP 194 N -4.09 0.23 0.00 -2.05 9.92 -1.26 -4.76 116.55 114.54 3gli n ASP 194 Ca -0.03 1.36 0.00 0.00 -0.53 0.00 0.00 54.79 55.60 3gli n ASP 194 Cb 0.11 -0.64 0.00 0.00 -0.64 0.00 0.00 41.12 39.95 3gli n ASP 194 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3gli n GLY 195 N -1.24 2.67 3.64 0.44 0.00 -1.15 -4.91 105.19 104.63 3gli n GLY 195 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.88 3gli n GLY 195 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gli s LYS 196 N -0.02 4.05 -0.55 1.61 -2.85 -1.26 -0.64 119.74 120.09 3gli s LYS 196 Ca 0.00 1.25 -0.05 0.00 -1.00 0.00 0.00 55.97 56.17 3gli s LYS 196 Cb 0.00 -3.78 0.14 0.00 -2.06 0.00 0.00 37.83 32.13 3gli s LYS 196 CO 0.00 -0.93 0.38 -0.51 0.10 0.00 0.00 175.35 174.39 3gli s LEU 197 N 3.85 5.44 0.71 2.77 1.43 -0.50 -4.96 118.68 127.42 3gli s LEU 197 Ca 0.51 -2.42 -0.14 0.00 -1.03 0.00 0.00 54.13 51.05 3gli s LEU 197 Cb -0.15 -1.90 0.03 0.00 0.03 0.00 0.00 46.19 44.19 3gli s LEU 197 CO 0.17 -0.50 1.14 0.42 0.23 0.00 0.00 176.35 177.81 3gli s THR 198 N 0.59 2.90 0.20 5.49 -4.23 -1.26 -3.61 115.64 115.71 3gli s THR 198 Ca 0.12 0.40 -0.10 0.00 -1.18 0.00 0.00 61.69 60.93 3gli s THR 198 Cb -0.21 -2.91 0.13 0.00 1.34 0.00 0.00 72.50 70.85 3gli s THR 198 CO -0.04 -0.27 1.80 0.25 -0.54 0.00 0.00 174.62 175.82 3gli h LEU 199 N -0.28 0.49 -0.96 4.79 5.85 -1.95 -1.64 115.31 121.61 3gli h LEU 199 Ca -0.47 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.18 3gli h LEU 199 Cb 1.26 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 3gli h LEU 199 CO 0.52 0.32 -0.46 1.55 -0.34 0.00 0.00 178.44 180.03 3gli h PRO 200 N 0.63 0.14 0.54 5.25 0.13 -1.98 -0.87 132.00 135.83 3gli h PRO 200 Ca 0.28 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 65.31 3gli h PRO 200 Cb 0.18 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.32 3gli h PRO 200 CO -0.18 0.57 -0.26 0.00 -0.23 0.00 0.00 178.00 177.90 3gli h ARG 201 N 0.11 -0.69 -0.85 0.86 3.08 -1.88 -3.28 114.38 111.73 3gli h ARG 201 Ca 0.01 0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.18 3gli h ARG 201 Cb 0.86 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 31.01 3gli h ARG 201 CO 0.07 -0.39 0.56 0.28 -1.07 0.00 0.00 179.97 179.41 3gli h VAL 202 N -1.03 1.01 -0.53 2.04 2.07 -1.31 -1.58 116.25 116.92 3gli h VAL 202 Ca -0.07 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.22 3gli h VAL 202 Cb 0.62 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 3gli h VAL 202 CO 0.12 0.16 0.36 -0.08 0.02 0.00 0.00 177.57 178.15 3gli h GLU 203 N 0.89 0.37 0.00 1.57 4.81 -1.22 -2.88 114.58 118.12 3gli h GLU 203 Ca 0.38 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.49 3gli h GLU 203 Cb 0.32 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 3gli h GLU 203 CO -0.15 0.25 -0.58 1.96 -0.73 0.00 0.00 179.01 179.76 3gli h GLN 204 N 0.38 0.00 -0.34 1.92 4.20 -1.34 -3.30 115.11 116.63 3gli h GLN 204 Ca 0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.95 3gli h GLN 204 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 3gli h GLN 204 CO -0.06 0.43 0.00 0.00 -0.67 0.00 0.00 178.83 178.53 3gli n ALA 205 N -2.23 3.17 -2.85 3.87 0.00 -1.09 -4.98 120.51 116.40 3gli n ALA 205 Ca 0.01 -2.18 -0.33 0.00 0.00 0.00 0.00 53.44 50.94 3gli n ALA 205 Cb 0.73 -0.80 -0.05 0.00 0.00 0.00 0.00 19.45 19.33 3gli n ALA 205 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3gli s VAL 206 N -2.74 5.37 0.15 0.00 1.01 -1.21 -5.04 120.40 117.95 3gli s VAL 206 Ca 0.45 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.41 3gli s VAL 206 Cb 0.35 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 3gli s VAL 206 CO 0.11 0.27 -0.18 0.54 0.00 0.00 0.00 175.10 175.85 3gli s ASN 207 N -2.03 2.57 -0.51 3.32 6.03 -1.26 -5.08 114.94 117.98 3gli s ASN 207 Ca 0.30 -0.84 -0.21 0.00 -1.03 0.00 0.00 52.86 51.08 3gli s ASN 207 Cb -0.13 -0.14 0.05 0.00 -3.03 0.00 0.00 41.25 38.00 3gli s ASN 207 CO 0.20 -0.05 0.72 -0.62 -2.03 0.00 0.00 177.10 175.33 3gli s ASP 208 N -2.59 6.28 -0.41 3.54 2.15 -1.26 -4.85 116.67 119.53 3gli s ASP 208 Ca 0.14 -0.65 0.08 0.00 0.43 0.00 0.00 52.55 52.56 3gli s ASP 208 Cb -0.06 -2.34 0.27 0.00 -0.30 0.00 0.00 42.92 40.49 3gli s ASP 208 CO 0.06 -0.97 0.66 0.00 -0.17 0.00 0.00 175.17 174.75 3gli n ALA 209 N 6.56 1.44 -2.60 3.66 0.00 -0.52 -5.08 120.51 123.98 3gli n ALA 209 Ca -0.03 -2.91 -0.36 0.00 0.00 0.00 0.00 53.44 50.14 3gli n ALA 209 Cb 0.46 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.91 3gli n ALA 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gli s ALA 210 N -0.95 3.74 -0.28 0.00 0.00 -1.20 -4.61 121.76 118.47 3gli s ALA 210 Ca 0.35 -0.38 -0.06 0.00 0.00 0.00 0.00 51.96 51.87 3gli s ALA 210 Cb 0.22 -2.26 0.01 0.00 0.00 0.00 0.00 23.12 21.09 3gli s ALA 210 CO -0.13 0.56 0.05 -1.58 0.00 0.00 0.00 175.76 174.66 3gli s HIS 211 N -1.29 3.13 0.29 0.00 2.46 -0.92 -4.90 115.29 114.06 3gli s HIS 211 Ca 0.29 -1.10 0.09 0.00 0.47 0.00 0.00 55.06 54.82 3gli s HIS 211 Cb -0.14 -2.21 -0.04 0.00 -0.13 0.00 0.00 32.58 30.05 3gli s HIS 211 CO 0.16 -0.61 0.04 -0.06 -2.47 0.00 0.00 174.74 171.81 3gli s PHE 212 N 1.46 2.70 0.40 3.88 0.40 -1.26 -4.34 117.98 121.23 3gli s PHE 212 Ca 0.02 -0.28 0.08 0.00 -0.60 0.00 0.00 56.93 56.15 3gli s PHE 212 Cb -0.17 -1.34 0.01 0.00 0.51 0.00 0.00 43.02 42.03 3gli s PHE 212 CO 0.01 0.53 0.55 0.95 0.70 0.00 0.00 175.22 177.96 3gli s THR 213 N -2.36 3.25 0.42 0.64 -4.23 -1.26 -4.96 115.64 107.14 3gli s THR 213 Ca 0.33 -0.99 0.12 0.00 -1.18 0.00 0.00 61.69 59.97 3gli s THR 213 Cb -0.05 -3.10 0.18 0.00 1.34 0.00 0.00 72.50 70.88 3gli s THR 213 CO 0.21 -0.04 1.97 -0.65 -0.54 0.00 0.00 174.62 175.57 3gli h PRO 214 N 0.69 0.13 -0.16 3.99 0.11 -2.00 -2.18 132.00 132.58 3gli h PRO 214 Ca -0.41 -0.02 0.05 0.00 0.11 0.00 0.00 66.00 65.72 3gli h PRO 214 Cb 1.27 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 3gli h PRO 214 CO 0.47 0.26 0.14 0.74 -0.21 0.00 0.00 178.00 179.40 3gli h PHE 215 N 0.12 0.00 0.00 0.65 -1.00 -1.98 0.27 116.94 115.01 3gli h PHE 215 Ca 0.03 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.80 3gli h PHE 215 Cb 0.31 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.86 3gli h PHE 215 CO 0.00 0.00 -0.01 0.45 -1.61 0.00 0.00 178.31 177.14 3gli h HIS 216 N 0.00 0.00 0.03 -0.55 3.86 -1.78 -2.07 115.15 114.64 3gli h HIS 216 Ca 0.08 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.96 3gli h HIS 216 Cb 0.35 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.78 3gli h HIS 216 CO 0.00 0.01 -1.83 1.87 0.86 0.00 0.00 177.93 178.84 3gli n TRP 217 N -3.13 0.79 -0.28 2.45 -0.00 0.93 -2.34 117.44 115.88 3gli n TRP 217 Ca -0.01 0.27 -0.05 0.00 -0.00 0.00 0.00 57.50 57.70 3gli n TRP 217 Cb 0.18 -1.09 0.09 0.00 -0.00 0.00 0.00 31.31 30.49 3gli n TRP 217 CO 0.00 0.00 0.00 -0.39 -0.00 0.00 0.00 177.69 177.30 3gli h VAL 218 N -0.61 1.26 -0.15 5.87 -1.51 -1.47 0.46 116.25 120.11 3gli h VAL 218 Ca -0.46 -0.80 0.02 0.00 -1.23 0.00 0.00 66.70 64.23 3gli h VAL 218 Cb 1.62 0.31 -0.02 0.00 -2.13 0.00 0.00 31.29 31.08 3gli h VAL 218 CO -0.16 0.33 0.04 0.44 -1.23 0.00 0.00 177.57 176.99 3gli h ASP 219 N 1.13 0.04 -0.35 4.19 3.32 -1.51 0.44 116.42 123.68 3gli h ASP 219 Ca 0.26 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.40 3gli h ASP 219 Cb 0.20 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.69 3gli h ASP 219 CO -0.02 0.05 -0.14 0.00 -1.72 0.00 0.00 179.24 177.40 3gli h ALA 220 N 1.09 0.15 0.50 3.45 0.00 -0.98 -1.79 119.26 121.69 3gli h ALA 220 Ca 0.06 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3gli h ALA 220 Cb 0.04 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3gli h ALA 220 CO -0.07 -0.51 -0.38 -0.07 0.00 0.00 0.00 179.25 178.21 3gli h LEU 221 N -0.07 -1.00 -1.69 0.00 3.38 -0.62 -2.53 115.31 112.79 3gli h LEU 221 Ca 0.17 0.07 0.47 0.00 0.09 0.00 0.00 57.88 58.69 3gli h LEU 221 Cb 0.34 0.31 -0.10 0.00 0.09 0.00 0.00 40.66 41.30 3gli h LEU 221 CO -0.40 -0.56 1.06 -0.07 0.09 0.00 0.00 178.44 178.55 3gli h LEU 222 N -0.87 0.13 -0.30 1.67 3.38 0.65 0.78 115.31 120.75 3gli h LEU 222 Ca -0.05 0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3gli h LEU 222 Cb 0.73 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3gli h LEU 222 CO 0.01 -0.09 -0.63 0.23 0.09 0.00 0.00 178.44 178.04 3gli n MET 223 N -4.36 0.40 -0.50 1.13 2.81 -0.75 -3.04 117.12 112.82 3gli n MET 223 Ca 0.38 -0.30 0.00 0.00 -1.81 0.00 0.00 57.70 55.98 3gli n MET 223 Cb 1.62 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 32.63 3gli n MET 223 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gli n GLY 224 N 1.46 1.24 3.58 3.03 0.00 0.27 -4.95 105.19 109.82 3gli n GLY 224 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3gli n GLY 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gli s LYS 225 N -0.29 3.22 -0.19 1.61 1.02 -1.06 -4.85 119.74 119.20 3gli s LYS 225 Ca 0.00 1.00 -0.03 0.00 0.02 0.00 0.00 55.97 56.95 3gli s LYS 225 Cb 0.00 -4.19 -0.21 0.00 -0.52 0.00 0.00 37.83 32.90 3gli s LYS 225 CO 0.00 -2.01 0.07 -1.13 -0.92 0.00 0.00 175.35 171.36 3gli n SER 226 N 10.44 2.05 0.08 2.83 3.41 -1.26 -2.74 113.62 128.43 3gli n SER 226 Ca 0.19 0.06 0.17 0.00 -0.26 0.00 0.00 58.87 59.04 3gli n SER 226 Cb 0.49 -0.66 0.70 0.00 -0.26 0.00 0.00 64.21 64.47 3gli n SER 226 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 3gli h LYS 227 N -0.01 0.00 0.46 4.33 3.64 -1.99 0.26 116.57 123.25 3gli h LYS 227 Ca -0.50 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 58.86 3gli h LYS 227 Cb 1.95 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.77 3gli h LYS 227 CO -0.01 0.00 -0.22 -0.09 -2.27 0.00 0.00 179.45 176.86 3gli h ARG 228 N 0.00 -0.59 -0.63 1.90 2.43 -1.97 -2.72 114.38 112.80 3gli h ARG 228 Ca 0.18 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.49 3gli h ARG 228 Cb 0.74 0.13 -0.12 0.00 -0.42 0.00 0.00 29.97 30.31 3gli h ARG 228 CO -0.00 -0.32 -0.37 0.00 -1.51 0.00 0.00 179.97 177.77 3gli h ALA 229 N -0.93 -0.11 -0.87 2.80 0.00 -0.59 0.31 119.26 119.88 3gli h ALA 229 Ca -0.06 0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.14 3gli h ALA 229 Cb 0.54 0.86 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 3gli h ALA 229 CO 0.10 -0.72 0.48 -0.07 0.00 0.00 0.00 179.25 179.05 3gli h LEU 230 N -0.17 0.64 0.76 0.00 3.38 -0.73 0.31 115.31 119.51 3gli h LEU 230 Ca 0.23 0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 3gli h LEU 230 Cb 0.56 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.28 3gli h LEU 230 CO -0.71 0.31 -0.37 -0.74 0.09 0.00 0.00 178.44 177.02 3gli h HIS 231 N 0.73 -0.95 -0.72 1.13 2.76 -0.16 -1.46 115.15 116.47 3gli h HIS 231 Ca 0.46 -0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.73 3gli h HIS 231 Cb 0.57 0.31 -0.13 0.00 1.55 0.00 0.00 27.41 29.71 3gli h HIS 231 CO -0.06 -0.58 -0.34 0.82 -1.30 0.00 0.00 177.93 176.47 3gli h ILE 232 N -1.13 0.12 0.00 6.26 2.04 -0.61 0.72 117.51 124.92 3gli h ILE 232 Ca -0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.76 3gli h ILE 232 Cb 0.80 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3gli h ILE 232 CO 0.17 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.50 3gli n LEU 233 N -5.45 0.00 -0.27 1.44 4.77 0.07 0.22 117.00 117.78 3gli n LEU 233 Ca 0.06 0.82 0.20 0.00 -0.03 0.00 0.00 56.01 57.06 3gli n LEU 233 Cb 0.37 -0.32 0.38 0.00 -2.33 0.00 0.00 43.42 41.52 3gli n LEU 233 CO -0.04 -0.32 0.77 1.67 -1.33 0.00 0.00 177.39 178.15 3gli n GLN 234 N -1.85 -0.06 -0.06 3.23 7.27 -0.55 0.14 117.38 125.49 3gli n GLN 234 Ca 0.00 1.16 -0.13 0.00 0.07 0.00 0.00 57.00 58.10 3gli n GLN 234 Cb 0.00 -1.98 -0.06 0.00 2.41 0.00 0.00 30.24 30.61 3gli n GLN 234 CO 0.00 0.00 0.00 1.96 0.07 0.00 0.00 177.06 179.09 3gli h GLN 235 N 0.00 0.44 0.00 3.69 1.08 -0.43 -2.92 115.11 116.97 3gli h GLN 235 Ca 0.61 -0.23 -0.00 0.00 -1.45 0.00 0.00 58.65 57.57 3gli h GLN 235 Cb 1.49 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.93 3gli h GLN 235 CO -0.68 0.80 -0.02 -0.07 -0.95 0.00 0.00 178.83 177.91 3gli h LEU 236 N 0.10 0.00 0.23 1.46 3.38 0.57 -1.39 115.31 119.65 3gli h LEU 236 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3gli h LEU 236 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3gli h LEU 236 CO 0.04 0.02 -0.11 -0.09 0.09 0.00 0.00 178.44 178.39 3gli h ARG 237 N 0.00 -0.29 -0.21 1.13 2.43 -1.26 -1.88 114.38 114.31 3gli h ARG 237 Ca -0.00 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.25 3gli h ARG 237 Cb 0.03 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3gli h ARG 237 CO 0.00 0.08 0.16 -0.07 -1.51 0.00 0.00 179.97 178.63 3gli h LEU 238 N -0.85 0.00 0.00 3.80 3.38 -1.09 2.57 115.31 123.12 3gli h LEU 238 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3gli h LEU 238 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3gli h LEU 238 CO 0.05 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.96 3gli n GLU 239 N -4.36 0.49 -2.88 1.13 1.02 -0.70 -4.95 120.64 110.40 3gli n GLU 239 Ca 0.02 0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.07 3gli n GLU 239 Cb 0.30 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.26 3gli n GLU 239 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gli n GLY 240 N 1.13 0.14 3.80 0.62 0.00 0.86 -5.01 105.19 106.72 3gli n GLY 240 Ca 0.15 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 3gli n GLY 240 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gli s SER 241 N -3.39 5.60 -0.09 1.61 0.01 -0.73 -4.96 113.70 111.75 3gli s SER 241 Ca 0.16 1.85 -0.30 0.00 1.31 0.00 0.00 55.95 58.97 3gli s SER 241 Cb -0.07 -2.54 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 3gli s SER 241 CO 0.36 -1.29 1.21 -1.61 0.41 0.00 0.00 173.24 172.32 3gli s GLU 242 N -4.12 4.32 0.30 12.44 0.41 -1.26 -4.89 118.70 125.89 3gli s GLU 242 Ca 0.64 1.66 -0.02 0.00 -0.41 0.00 0.00 54.97 56.84 3gli s GLU 242 Cb -0.17 -3.61 0.44 0.00 -1.78 0.00 0.00 34.13 29.00 3gli s GLU 242 CO 0.39 -0.51 1.94 -1.35 -0.49 0.00 0.00 175.26 175.23 3gli h PRO 243 N 7.64 1.03 -0.99 0.39 0.11 -1.98 0.78 132.00 138.98 3gli h PRO 243 Ca -0.32 -0.09 0.32 0.00 0.11 0.00 0.00 66.00 66.02 3gli h PRO 243 Cb 1.14 -0.22 -0.15 0.00 0.11 0.00 0.00 31.00 31.88 3gli h PRO 243 CO 0.90 0.73 0.51 0.28 -0.21 0.00 0.00 178.00 180.21 3gli h VAL 244 N 1.05 0.26 -0.44 3.15 2.07 -2.00 0.46 116.25 120.81 3gli h VAL 244 Ca 0.27 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.62 3gli h VAL 244 Cb -0.04 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.68 3gli h VAL 244 CO -0.05 0.05 -0.04 0.40 0.02 0.00 0.00 177.57 177.95 3gli h ILE 245 N 0.27 1.24 0.83 4.57 2.04 -1.23 -1.32 117.51 123.92 3gli h ILE 245 Ca 0.72 -1.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 3gli h ILE 245 Cb 1.65 0.95 0.01 0.00 -0.74 0.00 0.00 36.82 38.70 3gli h ILE 245 CO -0.64 0.36 -0.40 -0.07 0.00 0.00 0.00 178.15 177.40 3gli h LEU 246 N 0.69 -0.94 -0.92 1.44 3.38 -0.11 -2.67 115.31 116.17 3gli h LEU 246 Ca 0.13 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.24 3gli h LEU 246 Cb 0.49 0.24 -0.13 0.00 0.09 0.00 0.00 40.66 41.35 3gli h LEU 246 CO 0.02 -0.63 -0.48 -0.07 0.09 0.00 0.00 178.44 177.37 3gli h LEU 247 N -1.19 -1.76 -1.37 1.67 3.38 -0.84 -0.37 115.31 114.83 3gli h LEU 247 Ca -0.11 0.31 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 3gli h LEU 247 Cb 0.86 0.83 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 3gli h LEU 247 CO 0.19 -0.27 -0.28 0.03 0.09 0.00 0.00 178.44 178.19 3gli h ARG 248 N -0.05 0.06 0.13 1.13 2.47 -1.26 -0.07 114.38 116.80 3gli h ARG 248 Ca 0.24 -0.02 -0.29 0.00 -1.26 0.00 0.00 59.98 58.65 3gli h ARG 248 Cb 0.52 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.83 3gli h ARG 248 CO -0.91 0.33 -1.35 1.79 0.56 0.00 0.00 179.97 180.39 3gli h THR 249 N 0.05 1.38 -0.06 2.04 1.35 -0.93 -2.15 112.91 114.59 3gli h THR 249 Ca 0.01 -2.96 -0.00 0.00 -0.55 0.00 0.00 66.41 62.91 3gli h THR 249 Cb 0.52 2.90 -0.00 0.00 -1.73 0.00 0.00 68.15 69.84 3gli h THR 249 CO 0.04 0.86 0.04 0.25 -0.25 0.00 0.00 175.52 176.46 3gli h LEU 250 N 0.08 0.08 -0.54 3.87 5.85 -0.86 -2.98 115.31 120.81 3gli h LEU 250 Ca -0.18 -0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.58 3gli h LEU 250 Cb 2.00 -0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.91 3gli h LEU 250 CO 0.20 0.13 -0.16 -0.61 -0.34 0.00 0.00 178.44 177.66 3gli h GLN 251 N 0.02 -0.02 -0.78 1.25 4.15 -1.02 0.19 115.11 118.90 3gli h GLN 251 Ca 0.02 0.00 0.23 0.00 0.77 0.00 0.00 58.65 59.67 3gli h GLN 251 Cb 0.07 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 3gli h GLN 251 CO -0.00 -0.02 0.60 0.00 -1.93 0.00 0.00 178.83 177.48 3gli h ARG 252 N -0.02 0.00 0.00 1.69 3.08 -1.22 -1.43 114.38 116.48 3gli h ARG 252 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 3gli h ARG 252 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 3gli h ARG 252 CO -0.57 0.00 -0.40 0.93 -1.07 0.00 0.00 179.97 178.86 3gli h GLU 253 N 0.00 0.00 -0.97 0.04 4.39 -1.20 -3.27 114.58 113.57 3gli h GLU 253 Ca 0.37 0.00 0.18 0.00 0.34 0.00 0.00 59.36 60.25 3gli h GLU 253 Cb 1.56 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 30.04 3gli h GLU 253 CO -0.00 0.00 -0.27 -0.11 -1.16 0.00 0.00 179.01 177.46 3gli n LEU 254 N -4.34 -0.41 0.05 1.33 7.94 0.54 0.66 117.00 122.78 3gli n LEU 254 Ca -0.06 1.67 -0.01 0.00 -1.11 0.00 0.00 56.01 56.50 3gli n LEU 254 Cb 0.21 -0.48 0.26 0.00 0.53 0.00 0.00 43.42 43.95 3gli n LEU 254 CO 0.08 -1.58 0.78 -0.07 -1.11 0.00 0.00 177.39 175.50 3gli h LEU 255 N 0.00 0.37 -0.14 -1.96 3.38 -1.48 -0.82 115.31 114.66 3gli h LEU 255 Ca 0.43 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.28 3gli h LEU 255 Cb 0.68 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3gli h LEU 255 CO -0.99 0.61 0.03 0.25 0.09 0.00 0.00 178.44 178.43 3gli h LEU 256 N 0.34 0.22 -0.41 1.67 5.85 0.18 -2.01 115.31 121.15 3gli h LEU 256 Ca 0.06 -0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.61 3gli h LEU 256 Cb 0.58 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 41.46 3gli h LEU 256 CO 0.04 0.41 -0.32 -0.07 -0.34 0.00 0.00 178.44 178.16 3gli h LEU 257 N 0.02 -1.06 -0.34 2.25 3.38 -0.14 0.20 115.31 119.63 3gli h LEU 257 Ca 0.04 0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.28 3gli h LEU 257 Cb 0.28 0.50 -0.08 0.00 0.09 0.00 0.00 40.66 41.45 3gli h LEU 257 CO 0.00 -0.31 -0.25 0.58 0.09 0.00 0.00 178.44 178.54 3gli h VAL 258 N -0.24 0.35 -0.17 1.22 2.07 -1.07 0.17 116.25 118.57 3gli h VAL 258 Ca 0.18 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.62 3gli h VAL 258 Cb 0.53 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3gli h VAL 258 CO -0.54 0.00 -0.23 -1.13 0.02 0.00 0.00 177.57 175.69 3gli h ASN 259 N -0.22 0.29 0.39 0.57 -1.24 -0.55 -2.84 115.58 111.99 3gli h ASN 259 Ca 0.17 -0.09 -0.02 0.00 0.71 0.00 0.00 56.30 57.07 3gli h ASN 259 Cb 0.48 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.45 3gli h ASN 259 CO -0.46 0.53 -0.19 -0.07 -1.29 0.00 0.00 177.43 175.95 3gli h LEU 260 N 0.27 -0.45 -0.87 0.34 3.38 0.17 -2.56 115.31 115.60 3gli h LEU 260 Ca 0.05 -0.13 0.17 0.00 0.09 0.00 0.00 57.88 58.06 3gli h LEU 260 Cb 0.56 0.12 -0.16 0.00 0.09 0.00 0.00 40.66 41.26 3gli h LEU 260 CO 0.04 -0.04 -0.23 1.17 0.09 0.00 0.00 178.44 179.47 3gli n LYS 261 N -5.16 -0.09 0.32 1.13 3.00 0.52 0.10 118.16 117.97 3gli n LYS 261 Ca -0.09 1.35 -0.15 0.00 -0.00 0.00 0.00 58.31 59.41 3gli n LYS 261 Cb 0.28 -2.02 -0.08 0.00 0.00 0.00 0.00 35.03 33.22 3gli n LYS 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3gli h ARG 262 N 0.00 -0.78 0.00 1.64 3.08 -1.56 -3.06 114.38 113.70 3gli h ARG 262 Ca 0.40 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.51 3gli h ARG 262 Cb 0.62 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.85 3gli h ARG 262 CO -0.89 -0.47 0.08 1.96 -1.07 0.00 0.00 179.97 179.58 3gli h GLN 263 N -1.03 0.00 -0.72 0.04 4.20 -0.61 -2.70 115.11 114.28 3gli h GLN 263 Ca -0.08 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.66 3gli h GLN 263 Cb 0.68 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.41 3gli h GLN 263 CO 0.14 0.00 0.45 0.66 -0.67 0.00 0.00 178.83 179.41 3gli h SER 264 N 0.00 0.75 -0.53 1.46 4.64 -0.23 -2.47 113.55 117.17 3gli h SER 264 Ca 0.00 -0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.42 3gli h SER 264 Cb 0.15 -0.17 -0.11 0.00 -0.31 0.00 0.00 62.40 61.97 3gli h SER 264 CO 0.00 0.52 -0.27 0.00 -0.87 0.00 0.00 176.83 176.21 3gli h ALA 265 N 1.30 0.06 0.10 5.18 0.00 -1.62 -3.25 119.26 121.03 3gli h ALA 265 Ca 0.29 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 3gli h ALA 265 Cb 0.01 0.65 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3gli h ALA 265 CO -0.10 -0.61 -0.05 0.45 0.00 0.00 0.00 179.25 178.94 3gli h HIS 266 N -0.14 -0.13 -2.05 0.00 -0.00 -1.70 -3.47 115.15 107.67 3gli h HIS 266 Ca 0.23 -0.00 -0.60 0.00 -0.00 0.00 0.00 60.37 60.00 3gli h HIS 266 Cb 0.51 0.04 -0.13 0.00 -0.00 0.00 0.00 27.41 27.84 3gli h HIS 266 CO -0.56 0.38 -0.69 0.95 -0.00 0.00 0.00 177.93 178.01 3gli s THR 267 N -3.63 2.49 0.70 2.45 -4.23 -0.95 -5.12 115.64 107.35 3gli s THR 267 Ca -0.14 -2.20 -0.13 0.00 -1.18 0.00 0.00 61.69 58.03 3gli s THR 267 Cb 0.01 -2.58 0.02 0.00 1.34 0.00 0.00 72.50 71.29 3gli s THR 267 CO 0.56 -0.28 1.09 -2.16 -0.54 0.00 0.00 174.62 173.29 3gli s PRO 268 N -3.60 2.68 0.13 3.99 0.04 -1.26 -4.47 135.00 132.51 3gli s PRO 268 Ca 0.32 1.21 -0.28 0.00 0.04 0.00 0.00 61.00 62.29 3gli s PRO 268 Cb -0.01 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 3gli s PRO 268 CO 0.17 -1.32 1.59 1.25 0.04 0.00 0.00 177.00 178.74 3gli h LEU 269 N -0.48 -1.18 -0.99 -3.56 5.85 -1.96 -2.72 115.31 110.27 3gli h LEU 269 Ca -0.45 0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.49 3gli h LEU 269 Cb 1.23 0.48 -0.07 0.00 0.37 0.00 0.00 40.66 42.68 3gli h LEU 269 CO 0.54 -0.41 0.64 0.03 -0.34 0.00 0.00 178.44 178.89 3gli h ARG 270 N -0.48 1.13 -0.83 1.25 3.08 -1.99 -2.01 114.38 114.53 3gli h ARG 270 Ca 0.08 -0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.12 3gli h ARG 270 Cb 0.60 -0.25 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 3gli h ARG 270 CO -0.36 0.75 0.51 0.00 -1.07 0.00 0.00 179.97 179.80 3gli h ALA 271 N 1.44 1.14 -0.09 0.04 0.00 -1.86 -0.70 119.26 119.23 3gli h ALA 271 Ca 0.42 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.18 3gli h ALA 271 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3gli h ALA 271 CO -0.17 0.25 -0.60 -0.07 0.00 0.00 0.00 179.25 178.66 3gli h LEU 272 N 0.93 0.35 -1.12 0.00 3.38 -1.29 0.31 115.31 117.88 3gli h LEU 272 Ca 0.36 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 3gli h LEU 272 Cb 0.17 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 3gli h LEU 272 CO -0.17 0.87 -0.01 -0.26 0.09 0.00 0.00 178.44 178.95 3gli h PHE 273 N 0.23 0.63 0.03 1.13 0.04 -0.98 -1.96 116.94 116.05 3gli h PHE 273 Ca -0.01 -0.07 -0.00 0.00 2.80 0.00 0.00 57.97 60.69 3gli h PHE 273 Cb 1.12 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.09 3gli h PHE 273 CO 0.03 0.62 -0.02 -0.44 -0.60 0.00 0.00 178.31 177.90 3gli h ASP 274 N 0.57 -0.04 -0.70 2.17 3.32 -0.65 -1.07 116.42 120.03 3gli h ASP 274 Ca 0.12 -0.59 0.09 0.00 0.02 0.00 0.00 57.03 56.66 3gli h ASP 274 Cb 0.38 0.01 -0.11 0.00 0.22 0.00 0.00 39.33 39.83 3gli h ASP 274 CO 0.01 0.60 -0.50 0.11 -1.72 0.00 0.00 179.24 177.74 3gli h LYS 275 N -0.70 -0.17 -0.13 3.56 1.57 -0.26 -0.27 116.57 120.17 3gli h LYS 275 Ca -0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3gli h LYS 275 Cb 0.63 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.97 3gli h LYS 275 CO 0.01 -0.12 0.00 0.72 -0.57 0.00 0.00 179.45 179.49 3gli n HIS 276 N -5.37 0.17 -3.71 -1.35 8.25 -0.75 -4.92 115.22 107.55 3gli n HIS 276 Ca 0.02 -0.09 -0.22 0.00 -0.26 0.00 0.00 57.72 57.17 3gli n HIS 276 Cb 0.33 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.47 3gli n HIS 276 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3gli n ARG 277 N -0.10 -4.63 -2.46 -0.41 1.74 -0.11 -4.89 116.66 105.79 3gli n ARG 277 Ca 0.10 0.60 -0.42 0.00 -0.77 0.00 0.00 57.85 57.36 3gli n ARG 277 Cb 0.17 -5.11 -0.03 0.00 -1.02 0.00 0.00 32.46 26.47 3gli n ARG 277 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3gli s VAL 278 N -3.68 4.28 0.14 1.55 1.01 -0.45 -4.96 120.40 118.29 3gli s VAL 278 Ca 0.02 1.58 -0.32 0.00 0.00 0.00 0.00 61.98 63.27 3gli s VAL 278 Cb -0.01 -4.02 -0.18 0.00 0.00 0.00 0.00 36.38 32.18 3gli s VAL 278 CO 0.82 -0.04 0.76 0.79 0.00 0.00 0.00 175.10 177.42 3gli n TRP 279 N 5.61 0.06 0.03 5.22 7.02 -1.26 -4.77 117.44 129.36 3gli n TRP 279 Ca 0.12 0.96 -0.10 0.00 -1.02 0.00 0.00 57.50 57.46 3gli n TRP 279 Cb 0.46 -2.04 -0.04 0.00 -2.42 0.00 0.00 31.31 27.27 3gli n TRP 279 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 3gli h GLN 280 N 1.83 -0.18 -0.98 -0.99 1.08 -1.98 -2.63 115.11 111.24 3gli h GLN 280 Ca -0.37 0.01 0.07 0.00 -1.45 0.00 0.00 58.65 56.92 3gli h GLN 280 Cb 1.43 0.04 -0.07 0.00 -0.05 0.00 0.00 27.48 28.83 3gli h GLN 280 CO 0.61 -0.12 0.63 -2.95 -0.95 0.00 0.00 178.83 176.05 3gli h ASN 281 N -0.19 1.00 -0.85 1.46 7.08 -2.05 -2.16 115.58 119.88 3gli h ASN 281 Ca 0.06 0.01 -0.00 0.00 -3.08 0.00 0.00 56.30 53.29 3gli h ASN 281 Cb 0.28 -0.20 -0.04 0.00 -2.08 0.00 0.00 38.32 36.27 3gli h ASN 281 CO -0.17 0.63 0.52 0.03 -2.08 0.00 0.00 177.43 176.37 3gli h ARG 282 N 1.13 1.15 -0.97 4.14 2.47 -1.83 -3.32 114.38 117.15 3gli h ARG 282 Ca 0.43 -0.10 0.20 0.00 -1.26 0.00 0.00 59.98 59.25 3gli h ARG 282 Cb 0.19 -0.24 -0.11 0.00 -1.65 0.00 0.00 29.97 28.16 3gli h ARG 282 CO -0.17 0.80 0.56 0.00 0.56 0.00 0.00 179.97 181.73 3gli h ARG 283 N 1.17 0.64 0.24 0.04 3.08 -1.10 0.17 114.38 118.63 3gli h ARG 283 Ca 0.31 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 3gli h ARG 283 Cb -0.06 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.85 3gli h ARG 283 CO -0.06 0.43 -0.11 0.78 -1.07 0.00 0.00 179.97 179.93 3gli h GLY 284 N 0.66 -0.33 0.44 0.04 0.00 -1.73 -2.27 103.07 99.88 3gli h GLY 284 Ca 0.58 0.12 0.15 0.00 0.00 0.00 0.00 47.33 48.18 3gli h GLY 284 CO -0.42 -0.12 0.60 1.98 0.00 0.00 0.00 176.54 178.58 3gli h MET 285 N -0.46 0.75 -0.22 4.80 1.85 -0.93 -2.41 114.93 118.30 3gli h MET 285 Ca -0.03 -0.05 -0.04 0.00 -0.61 0.00 0.00 59.70 58.98 3gli h MET 285 Cb 0.35 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 32.20 3gli h MET 285 CO 0.05 0.50 -0.01 0.52 -0.40 0.00 0.00 176.91 177.57 3gli h MET 286 N 0.77 0.40 -0.21 0.39 2.07 -0.90 -2.72 114.93 114.74 3gli h MET 286 Ca 0.48 -0.13 0.03 0.00 -2.07 0.00 0.00 59.70 58.01 3gli h MET 286 Cb 0.71 -0.03 -0.06 0.00 -1.87 0.00 0.00 31.60 30.34 3gli h MET 286 CO -0.25 0.59 -0.44 0.78 1.07 0.00 0.00 176.91 178.66 3gli h GLY 287 N 0.16 -1.19 -0.71 8.32 0.00 -0.93 0.13 103.07 108.84 3gli h GLY 287 Ca 0.06 0.71 0.15 0.00 0.00 0.00 0.00 47.33 48.25 3gli h GLY 287 CO 0.01 -0.26 -0.28 -2.09 0.00 0.00 0.00 176.54 173.92 3gli h GLU 288 N -0.40 -0.04 0.25 4.80 4.57 -1.38 0.41 114.58 122.79 3gli h GLU 288 Ca 0.04 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.23 3gli h GLU 288 Cb 0.52 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.08 3gli h GLU 288 CO -0.41 -0.02 -0.35 0.00 -1.18 0.00 0.00 179.01 177.04 3gli h ALA 289 N 1.55 -0.69 -0.55 2.92 0.00 -1.10 -1.71 119.26 119.68 3gli h ALA 289 Ca 0.35 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.28 3gli h ALA 289 Cb 0.60 0.54 -0.09 0.00 0.00 0.00 0.00 17.79 18.84 3gli h ALA 289 CO -0.86 -0.93 -0.03 -0.07 0.00 0.00 0.00 179.25 177.35 3gli h LEU 290 N -0.66 -0.31 -2.35 0.00 3.38 0.24 0.11 115.31 115.72 3gli h LEU 290 Ca -0.00 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3gli h LEU 290 Cb 0.64 0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 3gli h LEU 290 CO -0.13 -0.11 -0.04 0.78 0.09 0.00 0.00 178.44 179.03 3gli h ASN 291 N 0.08 0.00 0.35 -0.43 2.35 -0.37 -3.12 115.58 114.45 3gli h ASN 291 Ca 0.28 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.71 3gli h ASN 291 Cb 0.43 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.75 3gli h ASN 291 CO -0.49 0.04 -1.88 -1.14 -1.65 0.00 0.00 177.43 172.31 3gli n ARG 292 N -3.55 0.66 -4.11 0.81 0.63 0.28 -4.93 116.66 106.45 3gli n ARG 292 Ca -0.02 0.24 -0.36 0.00 -0.92 0.00 0.00 57.85 56.79 3gli n ARG 292 Cb 0.14 -1.73 -0.08 0.00 0.45 0.00 0.00 32.46 31.24 3gli n ARG 292 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3gli s LEU 293 N -6.13 3.93 0.50 6.15 1.43 -0.56 -4.42 118.68 119.58 3gli s LEU 293 Ca -0.09 0.25 -0.19 0.00 -1.03 0.00 0.00 54.13 53.07 3gli s LEU 293 Cb 0.07 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.27 3gli s LEU 293 CO 0.81 0.34 1.02 -0.94 0.23 0.00 0.00 176.35 177.81 3gli s SER 294 N -0.65 6.40 0.48 2.29 1.04 -1.26 -4.88 113.70 117.12 3gli s SER 294 Ca 0.12 1.82 0.22 0.00 0.48 0.00 0.00 55.95 58.59 3gli s SER 294 Cb -0.12 -2.55 1.19 0.00 0.10 0.00 0.00 66.02 64.64 3gli s SER 294 CO 0.02 -0.74 1.62 -0.61 0.98 0.00 0.00 173.24 174.52 3gli h GLN 295 N 1.38 0.00 0.01 4.02 4.15 -1.96 -1.28 115.11 121.42 3gli h GLN 295 Ca -0.49 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 58.67 3gli h GLN 295 Cb 1.21 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.86 3gli h GLN 295 CO 0.59 0.00 -1.43 2.41 -1.93 0.00 0.00 178.83 178.48 3gli n THR 296 N -2.45 1.56 -0.31 2.39 -1.04 -1.26 -2.81 114.28 110.36 3gli n THR 296 Ca -0.01 -0.12 0.20 0.00 -2.04 0.00 0.00 64.05 62.08 3gli n THR 296 Cb 0.31 -2.00 0.47 0.00 -1.82 0.00 0.00 70.33 67.29 3gli n THR 296 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 3gli h GLN 297 N -0.88 0.46 0.50 -2.82 4.20 -1.74 0.34 115.11 115.17 3gli h GLN 297 Ca -0.38 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.28 3gli h GLN 297 Cb 1.41 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 29.09 3gli h GLN 297 CO -0.19 0.30 -0.24 -0.07 -0.67 0.00 0.00 178.83 177.96 3gli h LEU 298 N 0.47 -0.57 -1.38 1.46 3.38 -1.40 0.44 115.31 117.72 3gli h LEU 298 Ca 0.57 -0.07 0.43 0.00 0.09 0.00 0.00 57.88 58.91 3gli h LEU 298 Cb 1.32 0.15 -0.13 0.00 0.09 0.00 0.00 40.66 42.08 3gli h LEU 298 CO -0.29 -0.23 0.84 -0.09 0.09 0.00 0.00 178.44 178.75 3gli h ARG 299 N -0.95 0.08 0.02 1.13 2.43 -0.88 0.10 114.38 116.31 3gli h ARG 299 Ca -0.07 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3gli h ARG 299 Cb 0.61 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3gli h ARG 299 CO 0.11 0.05 -0.01 1.96 -1.51 0.00 0.00 179.97 180.58 3gli h GLN 300 N 0.08 -0.02 -0.52 0.20 4.20 0.03 -2.45 115.11 116.62 3gli h GLN 300 Ca 0.82 0.00 0.06 0.00 0.06 0.00 0.00 58.65 59.59 3gli h GLN 300 Cb 2.56 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 30.26 3gli h GLN 300 CO -0.44 0.71 -0.56 0.00 -0.67 0.00 0.00 178.83 177.87 3gli h ALA 301 N 0.10 -0.73 -0.85 3.87 0.00 0.99 0.45 119.26 123.09 3gli h ALA 301 Ca -0.00 0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.12 3gli h ALA 301 Cb 0.74 1.18 -0.12 0.00 0.00 0.00 0.00 17.79 19.59 3gli h ALA 301 CO 0.00 -1.02 0.35 0.28 0.00 0.00 0.00 179.25 178.86 3gli h VAL 302 N -0.31 0.52 -0.11 0.00 2.07 -0.95 0.17 116.25 117.64 3gli h VAL 302 Ca 0.09 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 3gli h VAL 302 Cb 0.55 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.40 3gli h VAL 302 CO -0.66 0.07 0.02 -0.61 0.02 0.00 0.00 177.57 176.41 3gli h GLN 303 N 0.40 0.18 -0.01 1.57 4.15 -0.42 -1.60 115.11 119.39 3gli h GLN 303 Ca 0.51 -0.05 -0.02 0.00 0.77 0.00 0.00 58.65 59.86 3gli h GLN 303 Cb 0.91 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.58 3gli h GLN 303 CO -0.50 0.39 -0.11 1.25 -1.93 0.00 0.00 178.83 177.93 3gli h LEU 304 N -0.05 0.01 -0.65 -2.39 5.85 0.11 -0.27 115.31 117.92 3gli h LEU 304 Ca 0.03 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 3gli h LEU 304 Cb 0.30 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3gli h LEU 304 CO 0.00 0.13 -0.57 0.25 -0.34 0.00 0.00 178.44 177.91 3gli h LEU 305 N 0.02 0.35 -0.25 2.25 5.85 -0.48 -2.41 115.31 120.63 3gli h LEU 305 Ca 0.00 -0.19 -0.15 0.00 0.84 0.00 0.00 57.88 58.38 3gli h LEU 305 Cb 0.21 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.14 3gli h LEU 305 CO 0.01 0.84 -0.44 0.74 -0.34 0.00 0.00 178.44 179.26 3gli h THR 306 N 0.24 1.30 -0.88 1.05 2.02 -0.45 -2.48 112.91 113.71 3gli h THR 306 Ca -0.00 -1.64 0.10 0.00 0.77 0.00 0.00 66.41 65.64 3gli h THR 306 Cb 1.07 1.74 -0.08 0.00 -1.74 0.00 0.00 68.15 69.14 3gli h THR 306 CO 0.09 0.52 0.52 0.03 0.37 0.00 0.00 175.52 177.06 3gli h ARG 307 N 0.46 0.84 -0.10 6.66 3.08 -0.89 -2.43 114.38 122.00 3gli h ARG 307 Ca 0.01 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.93 3gli h ARG 307 Cb 1.04 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.90 3gli h ARG 307 CO 0.10 0.55 -0.29 1.79 -1.07 0.00 0.00 179.97 181.06 3gli h THR 308 N 0.86 1.40 -0.44 2.04 1.35 -1.38 -1.64 112.91 115.09 3gli h THR 308 Ca 0.42 -1.62 0.07 0.00 -0.55 0.00 0.00 66.41 64.74 3gli h THR 308 Cb 0.38 2.18 -0.09 0.00 -1.73 0.00 0.00 68.15 68.89 3gli h THR 308 CO -0.25 0.47 -0.43 -0.08 -0.25 0.00 0.00 175.52 174.98 3gli h GLU 309 N -0.08 -0.29 0.45 4.72 4.57 -1.25 0.72 114.58 123.41 3gli h GLU 309 Ca -0.01 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 3gli h GLU 309 Cb 0.90 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.56 3gli h GLU 309 CO 0.06 -0.19 -0.26 -0.07 -1.18 0.00 0.00 179.01 177.36 3gli h LEU 310 N -0.30 -0.66 -1.17 1.64 3.38 -1.48 0.14 115.31 116.87 3gli h LEU 310 Ca 0.15 0.04 0.34 0.00 0.09 0.00 0.00 57.88 58.49 3gli h LEU 310 Cb 0.58 0.19 -0.13 0.00 0.09 0.00 0.00 40.66 41.38 3gli h LEU 310 CO -0.60 -0.42 0.66 0.74 0.09 0.00 0.00 178.44 178.90 3gli h THR 311 N -0.68 0.30 0.04 0.22 2.02 -0.77 -0.08 112.91 113.96 3gli h THR 311 Ca -0.05 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 3gli h THR 311 Cb 0.55 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 3gli h THR 311 CO 0.06 0.05 -0.02 0.25 0.37 0.00 0.00 175.52 176.23 3gli h LEU 312 N 0.28 -0.05 -1.55 2.58 5.85 0.22 -1.58 115.31 121.06 3gli h LEU 312 Ca 0.73 -0.56 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3gli h LEU 312 Cb 1.87 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.91 3gli h LEU 312 CO -0.50 0.56 -0.20 0.29 -0.34 0.00 0.00 178.44 178.25 3gli n LYS 313 N -4.82 1.87 0.00 1.25 5.02 0.31 -3.19 118.16 118.59 3gli n LYS 313 Ca -0.09 -1.55 0.00 0.00 -2.02 0.00 0.00 58.31 54.65 3gli n LYS 313 Cb 0.30 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 3gli n LYS 313 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gli n GLN 314 N 0.79 0.00 -0.04 1.97 10.64 -0.09 -4.79 117.38 125.86 3gli n GLN 314 Ca 0.12 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.41 3gli n GLN 314 Cb 0.55 -0.65 0.48 0.00 -0.86 0.00 0.00 30.24 29.75 3gli n GLN 314 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 3gli n ASP 315 N -2.43 1.37 -3.95 2.61 10.43 -1.08 -4.93 116.55 118.58 3gli n ASP 315 Ca 0.00 -1.56 -0.31 0.00 2.57 0.00 0.00 54.79 55.49 3gli n ASP 315 Cb 0.34 -0.05 -0.05 0.00 1.84 0.00 0.00 41.12 43.20 3gli n ASP 315 CO 0.00 0.00 0.00 -1.22 -1.07 0.00 0.00 177.20 174.91 3gli n TYR 316 N 0.10 -1.45 -2.18 1.24 4.02 -1.01 -4.83 117.16 113.05 3gli n TYR 316 Ca 0.18 0.52 -0.35 0.00 -0.01 0.00 0.00 57.90 58.23 3gli n TYR 316 Cb 0.31 -1.82 0.01 0.00 -0.02 0.00 0.00 39.34 37.82 3gli n TYR 316 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3gli s GLY 317 N -2.92 2.62 -0.07 2.72 0.00 -0.63 -4.96 107.32 104.08 3gli s GLY 317 Ca 0.60 0.84 -0.22 0.00 0.00 0.00 0.00 44.72 45.95 3gli s GLY 317 CO 0.74 1.20 0.80 1.46 0.00 0.00 0.00 173.10 177.30 3gli h GLN 318 N 1.06 0.25 -0.28 2.90 7.50 -1.89 -3.38 115.11 121.27 3gli h GLN 318 Ca -0.50 -0.43 0.03 0.00 0.50 0.00 0.00 58.65 58.26 3gli h GLN 318 Cb 1.27 0.16 -0.04 0.00 0.05 0.00 0.00 27.48 28.92 3gli h GLN 318 CO 0.56 1.20 -0.15 0.43 -1.50 0.00 0.00 178.83 179.38 3gli n SER 319 N -4.15 -0.27 0.00 1.46 7.64 -1.26 -3.71 113.62 113.33 3gli n SER 319 Ca -0.16 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.22 3gli n SER 319 Cb 0.80 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.92 3gli n SER 319 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3gli n VAL 320 N -4.37 0.00 -0.07 0.44 0.31 -1.26 0.50 118.33 113.88 3gli n VAL 320 Ca 0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.23 3gli n VAL 320 Cb 0.08 0.00 -0.05 0.00 -0.91 0.00 0.00 33.84 32.97 3gli n VAL 320 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 3gli h TRP 321 N 0.00 0.40 -0.55 3.52 4.06 -1.95 -2.82 115.95 118.62 3gli h TRP 321 Ca 0.00 -0.07 0.07 0.00 2.06 0.00 0.00 58.89 60.95 3gli h TRP 321 Cb 0.00 -0.11 -0.06 0.00 -1.00 0.00 0.00 29.16 28.00 3gli h TRP 321 CO 0.00 0.55 0.24 0.00 -3.56 0.00 0.00 178.44 175.67 3gli h ALA 322 N 0.80 0.70 0.00 1.49 0.00 -0.25 -1.02 119.26 120.98 3gli h ALA 322 Ca 0.06 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3gli h ALA 322 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3gli h ALA 322 CO 0.01 -0.14 0.05 0.93 0.00 0.00 0.00 179.25 180.10 3gli h GLU 323 N 0.45 0.00 0.03 0.00 5.08 -1.53 -0.13 114.58 118.48 3gli h GLU 323 Ca 0.26 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.25 3gli h GLU 323 Cb 0.24 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 3gli h GLU 323 CO -0.23 0.00 -2.25 1.28 -1.00 0.00 0.00 179.01 176.81 3gli n LEU 324 N -2.58 1.91 -0.25 1.33 4.77 -0.48 -2.80 117.00 118.90 3gli n LEU 324 Ca -0.02 0.04 0.05 0.00 -0.03 0.00 0.00 56.01 56.05 3gli n LEU 324 Cb 0.10 -0.47 0.18 0.00 -2.33 0.00 0.00 43.42 40.90 3gli n LEU 324 CO 0.13 0.74 0.96 -0.33 -1.33 0.00 0.00 177.39 177.57 3gli h GLU 325 N 0.02 0.32 0.27 3.23 5.08 -0.10 0.16 114.58 123.56 3gli h GLU 325 Ca -0.50 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 3gli h GLU 325 Cb 2.03 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.21 3gli h GLU 325 CO 0.00 0.21 -0.13 0.78 -1.00 0.00 0.00 179.01 178.87 3gli h GLY 326 N 0.33 -0.38 -0.82 -3.84 0.00 -1.53 -2.61 103.07 94.21 3gli h GLY 326 Ca 0.41 0.14 0.32 0.00 0.00 0.00 0.00 47.33 48.20 3gli h GLY 326 CO -0.46 -0.14 0.48 -0.10 0.00 0.00 0.00 176.54 176.32 3gli n LEU 327 N -3.28 0.22 0.11 3.11 7.94 -1.08 -0.39 117.00 123.62 3gli n LEU 327 Ca -0.05 1.13 -0.04 0.00 -1.11 0.00 0.00 56.01 55.94 3gli n LEU 327 Cb 0.14 -0.55 -0.02 0.00 0.53 0.00 0.00 43.42 43.52 3gli n LEU 327 CO 0.11 -1.25 0.46 0.28 -1.11 0.00 0.00 177.39 175.88 3gli h SER 328 N 0.00 -0.23 -0.89 1.96 0.02 -0.59 -3.03 113.55 110.79 3gli h SER 328 Ca 0.62 0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.70 3gli h SER 328 Cb 1.77 0.06 -0.14 0.00 0.14 0.00 0.00 62.40 64.24 3gli h SER 328 CO -0.48 -0.16 -0.39 0.18 -1.14 0.00 0.00 176.83 174.85 3gli n LEU 329 N -2.79 -0.67 -0.30 5.07 4.77 0.47 -1.03 117.00 122.53 3gli n LEU 329 Ca -0.03 1.57 0.13 0.00 -0.03 0.00 0.00 56.01 57.64 3gli n LEU 329 Cb 0.11 -0.32 0.29 0.00 -2.33 0.00 0.00 43.42 41.17 3gli n LEU 329 CO 0.08 -1.37 0.97 0.25 -1.33 0.00 0.00 177.39 175.99 3gli h LEU 330 N 0.00 0.10 -2.69 2.23 5.85 -1.03 0.02 115.31 119.79 3gli h LEU 330 Ca 0.27 0.18 0.00 0.00 0.84 0.00 0.00 57.88 59.17 3gli h LEU 330 Cb 0.49 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.74 3gli h LEU 330 CO -0.88 -0.10 0.00 0.18 -0.34 0.00 0.00 178.44 177.30 3gli n LEU 331 N -5.17 4.47 -2.82 2.25 4.77 -0.20 -3.88 117.00 116.42 3gli n LEU 331 Ca 0.21 -2.06 -0.11 0.00 -0.03 0.00 0.00 56.01 54.02 3gli n LEU 331 Cb 0.66 -0.90 0.06 0.00 -2.33 0.00 0.00 43.42 40.91 3gli n LEU 331 CO 0.09 0.82 0.18 0.00 -1.33 0.00 0.00 177.39 177.15 3gli s HIS 333 N -0.86 -0.07 0.00 0.00 3.76 -1.25 -5.04 115.29 111.83 3gli s HIS 333 Ca 0.27 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.92 3gli s HIS 333 Cb 0.35 0.14 0.00 0.00 1.11 0.00 0.00 32.58 34.18 3gli s HIS 333 CO -0.05 -0.63 0.18 1.17 -0.85 0.00 0.00 174.74 174.55