#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rla s PRO 7 N 0.00 2.96 -0.09 1.64 0.05 -1.26 -1.98 135.00 136.32 1rla s PRO 7 Ca 0.00 -0.54 0.04 0.00 0.05 0.00 0.00 61.00 60.56 1rla s PRO 7 Cb 0.00 -2.79 -0.01 0.00 0.05 0.00 0.00 34.50 31.76 1rla s PRO 7 CO 0.00 0.64 -0.23 0.42 0.05 0.00 0.00 177.00 177.88 1rla s ILE 8 N -1.16 2.17 -0.19 0.56 -1.09 0.13 0.01 121.20 121.63 1rla s ILE 8 Ca 0.22 -1.00 0.01 0.00 -2.23 0.00 0.00 60.65 57.65 1rla s ILE 8 Cb -0.12 -1.82 0.03 0.00 -1.58 0.00 0.00 42.46 38.97 1rla s ILE 8 CO 0.13 0.56 -0.15 -0.70 -1.23 0.00 0.00 174.94 173.55 1rla s GLU 9 N 0.13 2.49 0.04 2.79 2.12 0.25 -0.52 118.70 126.00 1rla s GLU 9 Ca -0.12 -0.87 -0.24 0.00 0.36 0.00 0.00 54.97 54.10 1rla s GLU 9 Cb -0.16 -2.50 -0.05 0.00 0.26 0.00 0.00 34.13 31.68 1rla s GLU 9 CO 0.07 -0.33 0.73 0.42 -0.54 0.00 0.00 175.26 175.61 1rla s ILE 10 N 1.32 4.76 -0.13 -3.70 1.09 -0.33 -1.47 121.20 122.75 1rla s ILE 10 Ca 0.01 1.55 -0.01 0.00 -1.10 0.00 0.00 60.65 61.10 1rla s ILE 10 Cb -0.15 -4.08 0.04 0.00 -1.06 0.00 0.00 42.46 37.21 1rla s ILE 10 CO -0.10 0.38 -0.01 -0.63 -0.10 0.00 0.00 174.94 174.48 1rla s ILE 11 N -0.09 0.63 -0.07 2.92 1.01 -0.24 -0.52 121.20 124.84 1rla s ILE 11 Ca 0.37 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.56 1rla s ILE 11 Cb -0.20 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.35 1rla s ILE 11 CO 0.22 0.12 0.57 -0.83 0.00 0.00 0.00 174.94 175.03 1rla s GLY 12 N 1.85 2.53 -0.72 6.18 0.00 -0.88 -1.36 107.32 114.90 1rla s GLY 12 Ca 0.03 -0.03 0.04 0.00 0.00 0.00 0.00 44.72 44.76 1rla s GLY 12 CO -0.07 0.87 0.72 0.00 0.00 0.00 0.00 173.10 174.62 1rla n ALA 13 N 3.38 3.91 -1.59 3.20 0.00 0.49 -1.92 120.51 127.98 1rla n ALA 13 Ca -0.05 -4.68 -0.36 0.00 0.00 0.00 0.00 53.44 48.34 1rla n ALA 13 Cb 0.51 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.78 1rla n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1rla n PRO 14 N 1.39 1.56 -4.87 0.00 -0.04 -1.26 -3.46 135.00 128.31 1rla n PRO 14 Ca 0.26 -2.15 -0.26 0.00 -0.04 0.00 0.00 63.50 61.31 1rla n PRO 14 Cb 0.38 -3.30 -0.15 0.00 -0.04 0.00 0.00 33.50 30.39 1rla n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1rla s PHE 15 N 7.82 1.69 0.00 0.54 5.36 -1.26 -4.73 117.98 127.40 1rla s PHE 15 Ca 0.63 -0.33 0.00 0.00 -0.96 0.00 0.00 56.93 56.27 1rla s PHE 15 Cb 0.07 -1.08 0.00 0.00 -0.34 0.00 0.00 43.02 41.68 1rla s PHE 15 CO 0.13 -0.01 0.10 -1.13 -1.46 0.00 0.00 175.22 172.84 1rla n SER 16 N 2.52 0.20 0.00 6.13 3.41 -1.26 -1.73 113.62 122.88 1rla n SER 16 Ca -0.15 -0.81 0.03 0.00 -0.26 0.00 0.00 58.87 57.68 1rla n SER 16 Cb 0.53 0.05 0.15 0.00 -0.26 0.00 0.00 64.21 64.69 1rla n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1rla n LYS 17 N -0.05 0.05 0.05 4.33 4.01 -1.26 -2.07 118.16 123.21 1rla n LYS 17 Ca 0.00 0.31 0.10 0.00 -0.51 0.00 0.00 58.31 58.21 1rla n LYS 17 Cb 0.15 -1.50 0.43 0.00 -0.51 0.00 0.00 35.03 33.60 1rla n LYS 17 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1rla n GLY 18 N -0.79 -1.26 3.38 0.72 0.00 -1.26 -4.74 105.19 101.24 1rla n GLY 18 Ca 0.02 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1rla n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1rla s GLN 19 N -3.10 1.20 0.46 1.61 1.03 -0.88 -0.84 119.66 119.14 1rla s GLN 19 Ca 0.08 -1.08 0.25 0.00 0.04 0.00 0.00 55.36 54.65 1rla s GLN 19 Cb 0.12 0.41 1.00 0.00 0.03 0.00 0.00 33.01 34.57 1rla s GLN 19 CO 0.39 -0.46 1.86 -1.00 -2.54 0.00 0.00 175.29 173.54 1rla h PRO 20 N 2.46 0.00 -6.00 9.60 0.13 -1.88 -3.44 132.00 132.88 1rla h PRO 20 Ca -0.31 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.21 1rla h PRO 20 Cb 1.24 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.26 1rla h PRO 20 CO 0.46 0.19 0.50 1.03 -0.23 0.00 0.00 178.00 179.95 1rla s ARG 21 N -3.69 3.59 0.72 0.86 0.52 -1.26 -5.04 118.95 114.65 1rla s ARG 21 Ca 0.00 0.19 -0.13 0.00 -0.52 0.00 0.00 55.73 55.28 1rla s ARG 21 Cb 0.10 -3.89 0.03 0.00 0.52 0.00 0.00 34.95 31.71 1rla s ARG 21 CO 0.62 -1.09 1.10 0.20 0.02 0.00 0.00 175.30 176.15 1rla s GLY 22 N 2.11 1.93 0.00 -3.53 0.00 -1.26 -4.30 107.32 102.27 1rla s GLY 22 Ca 0.35 0.42 0.00 0.00 0.00 0.00 0.00 44.72 45.49 1rla s GLY 22 CO 0.23 0.78 0.00 0.61 0.00 0.00 0.00 173.10 174.71 1rla n GLY 23 N -0.81 2.02 0.28 0.20 0.00 -1.26 -4.90 105.19 100.72 1rla n GLY 23 Ca 0.10 -0.57 0.19 0.00 0.00 0.00 0.00 46.02 45.74 1rla n GLY 23 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1rla h VAL 24 N 0.00 0.00 0.00 1.61 -1.51 -1.80 0.66 116.25 115.21 1rla h VAL 24 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.45 1rla h VAL 24 Cb 0.00 0.82 -0.00 0.00 -2.13 0.00 0.00 31.29 29.97 1rla h VAL 24 CO 0.00 0.00 -0.11 1.05 -1.23 0.00 0.00 177.57 177.28 1rla h GLU 25 N 0.00 0.00 -0.00 5.19 9.09 -1.85 0.14 114.58 127.15 1rla h GLU 25 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1rla h GLU 25 Cb 0.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.12 1rla h GLU 25 CO 0.00 0.11 -0.00 1.63 0.05 0.00 0.00 179.01 180.80 1rla n LYS 26 N -3.32 0.24 0.04 1.06 5.02 0.22 -4.23 118.16 117.18 1rla n LYS 26 Ca -0.00 -0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.15 1rla n LYS 26 Cb 0.32 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.77 1rla n LYS 26 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1rla h GLY 27 N 5.00 -0.76 0.70 0.72 0.00 -1.39 -2.14 103.07 105.20 1rla h GLY 27 Ca 0.00 0.52 0.11 0.00 0.00 0.00 0.00 47.33 47.96 1rla h GLY 27 CO 0.00 -0.24 0.56 -2.55 0.00 0.00 0.00 176.54 174.31 1rla h PRO 28 N -0.55 0.77 0.11 4.80 0.11 -1.73 -2.06 132.00 133.46 1rla h PRO 28 Ca 0.06 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1rla h PRO 28 Cb 0.64 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1rla h PRO 28 CO -0.35 0.51 -0.05 0.00 -0.21 0.00 0.00 178.00 177.90 1rla h ALA 29 N 1.58 -0.15 -0.89 -0.75 0.00 -1.73 -1.31 119.26 116.00 1rla h ALA 29 Ca 0.41 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.27 1rla h ALA 29 Cb 0.50 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 1rla h ALA 29 CO -0.18 -0.50 0.58 0.00 0.00 0.00 0.00 179.25 179.16 1rla h ALA 30 N 0.54 1.49 -0.16 0.00 0.00 -1.03 0.32 119.26 120.43 1rla h ALA 30 Ca -0.02 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 1rla h ALA 30 Cb 0.27 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1rla h ALA 30 CO 0.03 0.39 -0.59 -0.07 0.00 0.00 0.00 179.25 179.01 1rla h LEU 31 N 1.05 0.58 -0.12 0.00 3.38 -1.24 -1.74 115.31 117.21 1rla h LEU 31 Ca 0.37 -0.32 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 1rla h LEU 31 Cb 0.14 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.73 1rla h LEU 31 CO -0.13 1.04 -0.68 0.03 0.09 0.00 0.00 178.44 178.79 1rla h ARG 32 N 0.39 0.67 -0.67 1.13 3.08 -0.58 -2.51 114.38 115.88 1rla h ARG 32 Ca -0.00 -0.56 0.10 0.00 0.07 0.00 0.00 59.98 59.59 1rla h ARG 32 Cb 1.13 0.12 -0.04 0.00 0.08 0.00 0.00 29.97 31.26 1rla h ARG 32 CO 0.11 1.18 0.44 -0.22 -1.07 0.00 0.00 179.97 180.41 1rla h LYS 33 N 0.34 0.51 0.00 0.04 1.63 -0.30 0.89 116.57 119.68 1rla h LYS 33 Ca -0.05 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1rla h LYS 33 Cb 1.32 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 1rla h LYS 33 CO 0.14 0.34 0.00 0.00 -3.45 0.00 0.00 179.45 176.47 1rla n ALA 34 N -2.49 2.52 -0.93 5.00 0.00 -0.66 -4.88 120.51 119.06 1rla n ALA 34 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1rla n ALA 34 Cb 0.36 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1rla n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rla n GLY 35 N 0.62 0.42 0.41 0.00 0.00 0.31 -4.98 105.19 101.97 1rla n GLY 35 Ca 0.08 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 1rla n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1rla h LEU 36 N 0.00 -1.36 -0.48 0.99 5.85 -1.55 -0.24 115.31 118.52 1rla h LEU 36 Ca 0.00 0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1rla h LEU 36 Cb 0.00 0.55 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 1rla h LEU 36 CO 0.00 -0.44 0.26 0.58 -0.34 0.00 0.00 178.44 178.50 1rla h VAL 37 N -0.52 1.00 -0.60 1.05 2.07 -1.84 -1.73 116.25 115.68 1rla h VAL 37 Ca 0.07 -0.18 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 1rla h VAL 37 Cb 0.64 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1rla h VAL 37 CO -0.39 0.09 -0.03 -0.33 0.02 0.00 0.00 177.57 176.94 1rla h GLU 38 N 0.52 1.07 -0.25 1.57 3.07 -1.86 -2.57 114.58 116.12 1rla h GLU 38 Ca 0.20 -0.36 -0.06 0.00 -0.50 0.00 0.00 59.36 58.65 1rla h GLU 38 Cb 0.08 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1rla h GLU 38 CO -0.12 1.06 -0.11 0.87 -1.40 0.00 0.00 179.01 179.31 1rla h LYS 39 N 0.97 0.42 -0.25 2.33 1.57 -0.81 -2.39 116.57 118.41 1rla h LYS 39 Ca 0.17 -0.11 -0.11 0.00 -1.87 0.00 0.00 60.65 58.73 1rla h LYS 39 Cb 0.59 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 1rla h LYS 39 CO 0.04 0.53 -0.29 -0.07 -0.57 0.00 0.00 179.45 179.08 1rla h LEU 40 N 0.39 0.50 -2.29 2.94 3.38 -1.09 -2.54 115.31 116.60 1rla h LEU 40 Ca 0.08 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1rla h LEU 40 Cb 0.43 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1rla h LEU 40 CO 0.02 0.78 -0.05 0.11 0.09 0.00 0.00 178.44 179.40 1rla h LYS 41 N 0.43 0.00 0.00 1.13 1.57 -1.03 -0.36 116.57 118.31 1rla h LYS 41 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1rla h LYS 41 Cb 0.73 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1rla h LYS 41 CO 0.06 0.05 0.00 0.93 -0.57 0.00 0.00 179.45 179.91 1rla h GLU 42 N 0.00 0.00 -7.77 3.15 5.08 -1.39 -3.45 114.58 110.20 1rla h GLU 42 Ca -0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 1rla h GLU 42 Cb 0.19 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.60 1rla h GLU 42 CO 0.01 0.00 0.40 0.95 -1.00 0.00 0.00 179.01 179.36 1rla s THR 43 N -3.32 2.01 -2.00 1.13 -4.23 -0.15 -4.94 115.64 104.14 1rla s THR 43 Ca 0.06 -0.05 0.13 0.00 -1.18 0.00 0.00 61.69 60.65 1rla s THR 43 Cb 0.09 -2.96 0.38 0.00 1.34 0.00 0.00 72.50 71.36 1rla s THR 43 CO 0.51 0.00 1.33 -1.84 -0.54 0.00 0.00 174.62 174.08 1rla n GLU 44 N -3.70 0.75 -3.76 3.99 0.28 -1.26 -4.83 120.64 112.11 1rla n GLU 44 Ca 0.15 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.92 1rla n GLU 44 Cb 0.59 -1.28 -0.02 0.00 1.43 0.00 0.00 31.44 32.16 1rla n GLU 44 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1rla s TYR 45 N -2.00 3.47 -0.20 -1.84 2.02 -1.26 -4.68 117.35 112.86 1rla s TYR 45 Ca 0.20 0.17 -0.15 0.00 -0.37 0.00 0.00 57.07 56.91 1rla s TYR 45 Cb 0.09 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.89 1rla s TYR 45 CO 0.15 0.35 0.38 -0.80 -1.57 0.00 0.00 175.55 174.07 1rla s ASN 46 N -3.74 6.42 -0.10 2.29 0.01 -0.84 -4.80 114.94 114.19 1rla s ASN 46 Ca 0.37 0.49 0.01 0.00 -0.71 0.00 0.00 52.86 53.01 1rla s ASN 46 Cb -0.10 -2.22 -0.02 0.00 0.41 0.00 0.00 41.25 39.32 1rla s ASN 46 CO 0.31 -0.06 -0.11 -0.69 -1.51 0.00 0.00 177.10 175.04 1rla s VAL 47 N 1.23 3.28 -0.06 1.60 1.01 -1.26 0.18 120.40 126.38 1rla s VAL 47 Ca 0.18 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1rla s VAL 47 Cb -0.15 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.90 1rla s VAL 47 CO 0.08 0.55 -0.04 -0.60 0.00 0.00 0.00 175.10 175.09 1rla s ARG 48 N -0.15 0.85 -0.32 2.72 3.52 0.33 -4.96 118.95 120.94 1rla s ARG 48 Ca 0.00 -0.06 -0.16 0.00 -0.13 0.00 0.00 55.73 55.38 1rla s ARG 48 Cb -0.13 -0.97 -0.02 0.00 -1.56 0.00 0.00 34.95 32.27 1rla s ARG 48 CO 0.03 -0.17 0.40 0.34 -0.81 0.00 0.00 175.30 175.10 1rla s ASP 49 N 1.31 6.24 0.00 -2.12 -1.08 -1.26 -1.18 116.67 118.58 1rla s ASP 49 Ca -0.05 -0.01 0.31 0.00 -0.52 0.00 0.00 52.55 52.28 1rla s ASP 49 Cb -0.14 -2.22 1.59 0.00 -1.46 0.00 0.00 42.92 40.69 1rla s ASP 49 CO -0.02 -0.33 2.08 1.57 0.52 0.00 0.00 175.17 178.99 1rla n HIS 50 N 5.46 0.00 -3.79 -5.34 -0.00 0.32 -4.93 115.22 106.94 1rla n HIS 50 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 1rla n HIS 50 Cb 0.50 -0.20 0.00 0.00 -0.00 0.00 0.00 29.99 30.28 1rla n HIS 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1rla n GLY 51 N 1.21 -2.12 3.88 1.57 0.00 -1.26 -4.89 105.19 103.59 1rla n GLY 51 Ca 0.17 -1.44 -0.35 0.00 0.00 0.00 0.00 46.02 44.40 1rla n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rla s ASP 52 N -3.91 6.50 0.24 1.61 1.01 -1.26 -2.08 116.67 118.78 1rla s ASP 52 Ca 0.00 0.57 -0.30 0.00 0.71 0.00 0.00 52.55 53.53 1rla s ASP 52 Cb 0.00 -2.09 -0.09 0.00 1.01 0.00 0.00 42.92 41.75 1rla s ASP 52 CO 0.00 0.26 0.94 -0.76 0.21 0.00 0.00 175.17 175.81 1rla s LEU 53 N -1.73 4.65 -0.32 1.23 1.43 -0.81 -4.93 118.68 118.19 1rla s LEU 53 Ca 0.27 1.94 -0.17 0.00 -1.03 0.00 0.00 54.13 55.14 1rla s LEU 53 Cb -0.13 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 1rla s LEU 53 CO 0.16 0.15 0.47 0.00 0.23 0.00 0.00 176.35 177.37 1rla s ALA 54 N -1.15 3.51 -0.26 4.21 0.00 -1.26 -4.64 121.76 122.17 1rla s ALA 54 Ca 0.41 -0.92 -0.15 0.00 0.00 0.00 0.00 51.96 51.30 1rla s ALA 54 Cb -0.26 -2.92 -0.04 0.00 0.00 0.00 0.00 23.12 19.90 1rla s ALA 54 CO 0.32 -1.02 0.37 -0.06 0.00 0.00 0.00 175.76 175.37 1rla s PHE 55 N 2.29 3.26 0.10 0.00 0.08 -1.26 -5.05 117.98 117.40 1rla s PHE 55 Ca 0.18 0.43 -0.31 0.00 0.12 0.00 0.00 56.93 57.35 1rla s PHE 55 Cb -0.16 -2.56 -0.07 0.00 -0.57 0.00 0.00 43.02 39.67 1rla s PHE 55 CO 0.12 -0.19 1.24 0.14 -0.10 0.00 0.00 175.22 176.42 1rla s VAL 56 N 1.94 3.78 -0.15 -0.44 -7.23 -1.26 -5.00 120.40 112.03 1rla s VAL 56 Ca 0.15 1.32 -0.23 0.00 -1.81 0.00 0.00 61.98 61.41 1rla s VAL 56 Cb -0.16 -3.85 -0.02 0.00 0.56 0.00 0.00 36.38 32.91 1rla s VAL 56 CO 0.09 0.13 0.72 -0.62 -0.31 0.00 0.00 175.10 175.11 1rla s ASP 57 N 0.85 6.85 -0.51 4.85 -1.08 -1.26 -4.84 116.67 121.54 1rla s ASP 57 Ca 0.59 1.04 -0.29 0.00 -0.52 0.00 0.00 52.55 53.37 1rla s ASP 57 Cb -0.32 -2.40 0.02 0.00 -1.46 0.00 0.00 42.92 38.77 1rla s ASP 57 CO 0.31 -0.28 1.26 -0.69 0.52 0.00 0.00 175.17 176.29 1rla s VAL 58 N 1.71 4.02 0.52 1.11 1.01 -1.26 -5.01 120.40 122.50 1rla s VAL 58 Ca 0.34 0.98 -0.20 0.00 0.00 0.00 0.00 61.98 63.10 1rla s VAL 58 Cb -0.16 -4.53 -0.06 0.00 0.00 0.00 0.00 36.38 31.63 1rla s VAL 58 CO 0.13 -1.08 1.16 -2.16 0.00 0.00 0.00 175.10 173.15 1rla s PRO 59 N 4.87 3.43 -1.22 2.72 0.04 -1.26 -3.41 135.00 140.17 1rla s PRO 59 Ca 0.50 1.70 -0.06 0.00 0.04 0.00 0.00 61.00 63.19 1rla s PRO 59 Cb -0.09 -2.12 0.01 0.00 0.04 0.00 0.00 34.50 32.33 1rla s PRO 59 CO 0.29 -0.81 1.05 -1.71 0.04 0.00 0.00 177.00 175.86 1rla n ASN 60 N -1.08 -4.98 -4.40 6.66 5.15 -1.26 -4.91 115.26 110.44 1rla n ASN 60 Ca 0.11 -0.52 -0.43 0.00 -0.60 0.00 0.00 54.58 53.14 1rla n ASN 60 Cb 0.50 -4.71 0.00 0.00 -0.53 0.00 0.00 39.78 35.03 1rla n ASN 60 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1rla n ASP 61 N -2.75 4.87 -4.77 1.20 2.03 -1.22 -4.98 116.55 110.93 1rla n ASP 61 Ca -0.07 -2.93 -0.39 0.00 0.52 0.00 0.00 54.79 51.92 1rla n ASP 61 Cb 0.58 -1.68 -0.02 0.00 -0.72 0.00 0.00 41.12 39.28 1rla n ASP 61 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1rla s SER 62 N 3.58 6.51 0.44 1.67 1.04 -1.26 -4.52 113.70 121.16 1rla s SER 62 Ca 0.50 2.44 -0.25 0.00 0.48 0.00 0.00 55.95 59.12 1rla s SER 62 Cb 0.04 -2.62 -0.08 0.00 0.10 0.00 0.00 66.02 63.46 1rla s SER 62 CO 0.04 -0.69 1.30 -2.16 0.98 0.00 0.00 173.24 172.71 1rla s PRO 63 N -2.22 3.79 -0.68 4.02 0.04 -1.26 -4.72 135.00 133.98 1rla s PRO 63 Ca 0.56 2.14 -0.18 0.00 0.04 0.00 0.00 61.00 63.56 1rla s PRO 63 Cb -0.33 -2.63 0.13 0.00 0.04 0.00 0.00 34.50 31.71 1rla s PRO 63 CO 0.42 -0.63 0.78 0.12 0.04 0.00 0.00 177.00 177.72 1rla s PHE 64 N -1.30 3.14 0.00 0.56 5.36 0.31 -4.84 117.98 121.21 1rla s PHE 64 Ca 0.60 -1.19 0.00 0.00 -0.96 0.00 0.00 56.93 55.38 1rla s PHE 64 Cb -0.38 -4.02 0.00 0.00 -0.34 0.00 0.00 43.02 38.28 1rla s PHE 64 CO 0.47 -1.28 0.00 1.04 -1.46 0.00 0.00 175.22 174.00 1rla n GLN 65 N 5.99 0.00 -0.03 10.12 6.02 -1.26 -1.81 117.38 136.41 1rla n GLN 65 Ca -0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.94 1rla n GLN 65 Cb 0.44 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.65 1rla n GLN 65 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1rla n ILE 66 N 0.00 0.46 -1.65 5.09 5.41 -1.26 -5.03 119.36 122.38 1rla n ILE 66 Ca 0.00 -0.26 -0.51 0.00 1.00 0.00 0.00 62.75 62.98 1rla n ILE 66 Cb 0.00 -0.82 -0.06 0.00 -0.71 0.00 0.00 39.64 38.05 1rla n ILE 66 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1rla n VAL 67 N -2.35 0.45 -3.52 1.39 0.31 -0.75 -3.67 118.33 110.19 1rla n VAL 67 Ca -0.12 -0.13 -0.33 0.00 -0.01 0.00 0.00 64.34 63.76 1rla n VAL 67 Cb 0.70 -1.71 -0.05 0.00 -0.91 0.00 0.00 33.84 31.88 1rla n VAL 67 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1rla s LYS 68 N 4.35 3.77 -1.57 5.55 1.02 -0.80 -0.53 119.74 131.53 1rla s LYS 68 Ca 0.97 0.18 -0.17 0.00 0.02 0.00 0.00 55.97 56.97 1rla s LYS 68 Cb -0.80 -2.84 0.15 0.00 -0.52 0.00 0.00 37.83 33.82 1rla s LYS 68 CO 0.54 0.45 0.66 0.09 -0.92 0.00 0.00 175.35 176.17 1rla n ASN 69 N 0.36 -3.00 -0.13 2.83 3.02 -1.26 -4.71 115.26 112.37 1rla n ASN 69 Ca -0.04 -0.86 -0.04 0.00 -0.03 0.00 0.00 54.58 53.61 1rla n ASN 69 Cb 0.52 -2.49 0.02 0.00 -0.61 0.00 0.00 39.78 37.23 1rla n ASN 69 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1rla h PRO 70 N -1.19 0.01 -0.48 3.52 0.13 -1.83 -1.46 132.00 130.70 1rla h PRO 70 Ca -0.53 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.56 1rla h PRO 70 Cb 1.35 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 1rla h PRO 70 CO 0.72 0.01 0.14 0.00 -0.23 0.00 0.00 178.00 178.64 1rla h ARG 71 N 0.01 0.75 -0.63 0.86 3.08 -1.85 0.12 114.38 116.72 1rla h ARG 71 Ca 0.21 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1rla h ARG 71 Cb 0.32 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 1rla h ARG 71 CO -0.43 0.71 0.21 0.77 -1.07 0.00 0.00 179.97 180.16 1rla h SER 72 N 0.64 0.90 -0.18 7.04 0.02 -1.79 -0.22 113.55 119.95 1rla h SER 72 Ca 0.15 -0.20 -0.08 0.00 -0.84 0.00 0.00 61.79 60.83 1rla h SER 72 Cb 0.29 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 1rla h SER 72 CO -0.00 0.85 -0.21 0.58 -1.14 0.00 0.00 176.83 176.91 1rla h VAL 73 N 0.89 1.34 -0.90 2.27 2.07 -1.18 -2.27 116.25 118.48 1rla h VAL 73 Ca 0.20 -1.39 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 1rla h VAL 73 Cb 0.26 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.83 1rla h VAL 73 CO -0.01 0.42 0.48 1.23 0.02 0.00 0.00 177.57 179.70 1rla h GLY 74 N 0.10 1.35 0.68 2.17 0.00 -0.63 -1.54 103.07 105.20 1rla h GLY 74 Ca 0.02 -0.63 -0.05 0.00 0.00 0.00 0.00 47.33 46.68 1rla h GLY 74 CO 0.05 0.60 -0.12 1.70 0.00 0.00 0.00 176.54 178.77 1rla h LYS 75 N 1.26 0.26 -0.74 4.80 1.63 -1.07 -1.24 116.57 121.47 1rla h LYS 75 Ca 0.31 -0.14 0.05 0.00 -0.85 0.00 0.00 60.65 60.02 1rla h LYS 75 Cb 0.05 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.64 1rla h LYS 75 CO -0.05 0.69 0.49 0.00 -3.45 0.00 0.00 179.45 177.13 1rla h ALA 76 N 0.57 1.62 -0.11 5.00 0.00 -1.29 -1.45 119.26 123.61 1rla h ALA 76 Ca 0.02 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1rla h ALA 76 Cb 0.64 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1rla h ALA 76 CO 0.03 0.28 -0.65 -0.91 0.00 0.00 0.00 179.25 177.99 1rla h ASN 77 N 0.84 0.51 -0.36 0.00 2.35 -1.21 -1.89 115.58 115.83 1rla h ASN 77 Ca 0.31 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1rla h ASN 77 Cb 0.15 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1rla h ASN 77 CO -0.10 1.03 0.09 -0.08 -1.65 0.00 0.00 177.43 176.72 1rla h GLU 78 N 0.32 0.57 -0.36 0.81 4.81 -0.51 -1.02 114.58 119.20 1rla h GLU 78 Ca -0.02 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1rla h GLU 78 Cb 1.21 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 1rla h GLU 78 CO 0.11 0.61 0.19 0.37 -0.73 0.00 0.00 179.01 179.57 1rla h GLN 79 N 0.43 0.51 -0.57 1.92 4.15 -1.28 -2.40 115.11 117.87 1rla h GLN 79 Ca 0.11 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.46 1rla h GLN 79 Cb 0.30 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 27.86 1rla h GLN 79 CO 0.00 0.44 0.34 1.25 -1.93 0.00 0.00 178.83 178.93 1rla h LEU 80 N 0.45 0.69 -1.29 -2.39 5.85 -1.21 -2.40 115.31 115.01 1rla h LEU 80 Ca 0.13 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1rla h LEU 80 Cb 0.08 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1rla h LEU 80 CO -0.02 0.55 0.49 0.00 -0.34 0.00 0.00 178.44 179.13 1rla h ALA 81 N 1.17 1.54 -0.20 1.25 0.00 -1.03 -0.48 119.26 121.51 1rla h ALA 81 Ca 0.20 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1rla h ALA 81 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1rla h ALA 81 CO -0.04 0.39 0.05 0.00 0.00 0.00 0.00 179.25 179.64 1rla h ALA 82 N 1.56 0.26 -0.57 0.00 0.00 -0.96 -0.40 119.26 119.15 1rla h ALA 82 Ca 0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1rla h ALA 82 Cb 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1rla h ALA 82 CO -0.08 -0.09 0.26 0.28 0.00 0.00 0.00 179.25 179.61 1rla h VAL 83 N 0.14 1.21 -0.40 0.00 2.07 -1.07 -2.10 116.25 116.10 1rla h VAL 83 Ca 0.06 -0.63 -0.09 0.00 0.82 0.00 0.00 66.70 66.86 1rla h VAL 83 Cb 0.27 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1rla h VAL 83 CO 0.00 0.25 -0.09 0.58 0.02 0.00 0.00 177.57 178.33 1rla h VAL 84 N 0.78 1.27 -0.88 2.57 2.07 -0.97 -1.77 116.25 119.32 1rla h VAL 84 Ca 0.19 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.55 1rla h VAL 84 Cb 0.15 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1rla h VAL 84 CO -0.02 0.39 0.58 0.00 0.02 0.00 0.00 177.57 178.54 1rla h ALA 85 N 0.84 1.38 0.18 1.67 0.00 -0.98 -0.40 119.26 121.95 1rla h ALA 85 Ca 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1rla h ALA 85 Cb 0.61 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1rla h ALA 85 CO 0.04 0.58 -0.10 1.49 0.00 0.00 0.00 179.25 181.26 1rla h GLU 86 N 1.19 -0.25 -0.38 0.00 4.57 -1.00 -0.35 114.58 118.35 1rla h GLU 86 Ca 0.32 0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.40 1rla h GLU 86 Cb -0.14 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 1rla h GLU 86 CO -0.07 -0.17 -0.25 1.79 -1.18 0.00 0.00 179.01 179.13 1rla h THR 87 N -0.26 1.27 -0.77 0.32 1.35 -0.97 -2.98 112.91 110.87 1rla h THR 87 Ca -0.02 -1.37 -0.01 0.00 -0.55 0.00 0.00 66.41 64.45 1rla h THR 87 Cb 0.21 1.24 -0.04 0.00 -1.73 0.00 0.00 68.15 67.84 1rla h THR 87 CO 0.03 0.46 0.43 1.56 -0.25 0.00 0.00 175.52 177.75 1rla h GLN 88 N 0.67 1.07 -1.01 4.72 1.08 -0.84 -2.30 115.11 118.51 1rla h GLN 88 Ca 0.09 -0.12 0.08 0.00 -1.45 0.00 0.00 58.65 57.25 1rla h GLN 88 Cb 0.77 -0.21 -0.07 0.00 -0.05 0.00 0.00 27.48 27.91 1rla h GLN 88 CO 0.06 0.79 0.65 -0.22 -0.95 0.00 0.00 178.83 179.16 1rla h LYS 89 N 1.07 1.11 0.00 1.46 3.64 -0.91 0.16 116.57 123.09 1rla h LYS 89 Ca 0.27 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1rla h LYS 89 Cb 0.02 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 1rla h LYS 89 CO -0.05 0.73 0.00 0.09 -2.27 0.00 0.00 179.45 177.96 1rla n ASN 90 N -4.53 0.00 -0.90 4.20 3.02 -0.89 -4.87 115.26 111.30 1rla n ASN 90 Ca 0.16 -1.04 -0.07 0.00 -0.03 0.00 0.00 54.58 53.61 1rla n ASN 90 Cb 0.23 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 1rla n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rla n GLY 91 N 0.37 0.15 3.80 7.41 0.00 0.56 -5.05 105.19 112.42 1rla n GLY 91 Ca 0.10 -0.56 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 1rla n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rla s THR 92 N -2.47 3.42 -0.22 2.61 -4.23 -1.07 -4.65 115.64 109.03 1rla s THR 92 Ca 0.03 -1.51 -0.17 0.00 -1.18 0.00 0.00 61.69 58.86 1rla s THR 92 Cb -0.01 -3.11 -0.03 0.00 1.34 0.00 0.00 72.50 70.68 1rla s THR 92 CO 0.04 -0.20 0.46 -0.63 -0.54 0.00 0.00 174.62 173.75 1rla s ILE 93 N -2.34 5.14 -0.06 2.99 1.01 0.10 -4.40 121.20 123.64 1rla s ILE 93 Ca 0.39 0.82 -0.22 0.00 0.00 0.00 0.00 60.65 61.64 1rla s ILE 93 Cb -0.05 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 1rla s ILE 93 CO 0.25 0.18 0.63 -0.94 0.00 0.00 0.00 174.94 175.06 1rla s SER 94 N 1.23 6.93 -0.26 3.58 1.04 -1.18 -0.58 113.70 124.46 1rla s SER 94 Ca 0.21 1.11 0.02 0.00 0.48 0.00 0.00 55.95 57.77 1rla s SER 94 Cb -0.15 -2.38 0.07 0.00 0.10 0.00 0.00 66.02 63.66 1rla s SER 94 CO 0.09 -0.04 -0.04 -0.69 0.98 0.00 0.00 173.24 173.54 1rla s VAL 95 N 0.53 1.73 -0.18 5.02 1.01 -0.54 -0.93 120.40 127.04 1rla s VAL 95 Ca 0.34 -1.51 -0.11 0.00 0.00 0.00 0.00 61.98 60.70 1rla s VAL 95 Cb -0.17 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 1rla s VAL 95 CO 0.16 -0.21 0.18 -0.69 0.00 0.00 0.00 175.10 174.54 1rla s VAL 96 N 1.27 5.38 -0.32 2.92 1.01 -0.29 -1.08 120.40 129.29 1rla s VAL 96 Ca -0.03 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.18 1rla s VAL 96 Cb -0.19 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.69 1rla s VAL 96 CO -0.08 0.44 0.11 -0.76 0.00 0.00 0.00 175.10 174.81 1rla s LEU 97 N 0.28 4.10 0.96 3.92 1.43 -0.47 -1.36 118.68 127.54 1rla s LEU 97 Ca 0.11 -0.81 -0.16 0.00 -1.03 0.00 0.00 54.13 52.25 1rla s LEU 97 Cb -0.12 -1.92 0.20 0.00 0.03 0.00 0.00 46.19 44.38 1rla s LEU 97 CO 0.00 -0.25 1.32 -0.83 0.23 0.00 0.00 176.35 176.82 1rla s GLY 98 N 1.51 1.78 0.00 -3.19 0.00 -0.13 -0.38 107.32 106.91 1rla s GLY 98 Ca 0.02 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1rla s GLY 98 CO 0.04 -0.45 0.00 0.61 0.00 0.00 0.00 173.10 173.30 1rla n GLY 99 N -3.74 -1.65 3.90 0.20 0.00 0.39 -3.32 105.19 100.98 1rla n GLY 99 Ca 0.15 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.41 1rla n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1rla s ASP 100 N -2.75 5.30 0.00 1.61 1.47 -0.71 -1.47 116.67 120.12 1rla s ASP 100 Ca 0.00 0.95 0.05 0.00 1.18 0.00 0.00 52.55 54.73 1rla s ASP 100 Cb 0.00 -1.73 0.24 0.00 -0.34 0.00 0.00 42.92 41.08 1rla s ASP 100 CO 0.00 -1.38 1.09 1.57 0.68 0.00 0.00 175.17 177.13 1rla n HIS 101 N -2.96 0.00 0.27 2.11 -0.00 -1.26 -2.45 115.22 110.94 1rla n HIS 101 Ca 0.07 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.94 1rla n HIS 101 Cb 0.58 -0.40 0.72 0.00 -0.00 0.00 0.00 29.99 30.89 1rla n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1rla h SER 102 N 0.00 0.00 0.35 0.26 4.64 -1.81 -2.25 113.55 114.74 1rla h SER 102 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rla h SER 102 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 1rla h SER 102 CO 0.00 0.08 0.00 0.23 -0.87 0.00 0.00 176.83 176.27 1rla n MET 103 N -3.29 0.06 0.28 4.77 2.81 -1.02 -2.00 117.12 118.72 1rla n MET 103 Ca -0.01 0.40 0.16 0.00 -1.81 0.00 0.00 57.70 56.44 1rla n MET 103 Cb 0.28 -1.63 0.78 0.00 -0.71 0.00 0.00 33.22 31.95 1rla n MET 103 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1rla h ALA 104 N 2.26 1.12 0.17 3.04 0.00 -1.66 -1.80 119.26 122.39 1rla h ALA 104 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1rla h ALA 104 Cb 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1rla h ALA 104 CO 0.00 0.09 -0.08 0.82 0.00 0.00 0.00 179.25 180.08 1rla h ILE 105 N 0.00 0.86 -0.26 0.00 2.04 -1.63 -0.72 117.51 117.79 1rla h ILE 105 Ca -0.00 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.64 1rla h ILE 105 Cb 0.36 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1rla h ILE 105 CO 0.01 0.02 -0.27 1.23 0.00 0.00 0.00 178.15 179.15 1rla h GLY 106 N -0.28 0.71 0.65 5.37 0.00 -1.66 -1.56 103.07 106.30 1rla h GLY 106 Ca -0.02 -0.73 0.01 0.00 0.00 0.00 0.00 47.33 46.59 1rla h GLY 106 CO 0.04 0.65 -0.25 0.23 0.00 0.00 0.00 176.54 177.21 1rla h SER 107 N 0.37 -0.69 -0.37 0.19 0.87 -1.27 -1.20 113.55 111.45 1rla h SER 107 Ca 0.04 0.07 -0.16 0.00 -1.23 0.00 0.00 61.79 60.52 1rla h SER 107 Cb 0.83 0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 63.03 1rla h SER 107 CO 0.07 -0.36 -0.37 0.40 -0.53 0.00 0.00 176.83 176.04 1rla h ILE 108 N -0.50 1.27 0.01 2.23 2.04 -1.19 -1.57 117.51 119.80 1rla h ILE 108 Ca 0.01 -1.54 0.02 0.00 1.00 0.00 0.00 64.86 64.34 1rla h ILE 108 Cb 0.49 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 1rla h ILE 108 CO -0.09 0.52 -0.12 0.28 0.00 0.00 0.00 178.15 178.74 1rla h SER 109 N 0.76 -0.34 -0.59 1.72 0.02 -1.22 0.21 113.55 114.11 1rla h SER 109 Ca 0.07 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 1rla h SER 109 Cb 0.96 0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 1rla h SER 109 CO 0.09 -0.17 0.31 1.23 -1.14 0.00 0.00 176.83 177.16 1rla h GLY 110 N -0.21 0.90 0.97 -3.77 0.00 -1.19 -2.27 103.07 97.50 1rla h GLY 110 Ca 0.04 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 1rla h GLY 110 CO -0.11 0.40 0.21 0.84 0.00 0.00 0.00 176.54 177.87 1rla h HIS 111 N 0.81 0.47 0.00 5.60 6.17 -1.04 -2.82 115.15 124.33 1rla h HIS 111 Ca 0.21 -0.00 -0.02 0.00 0.71 0.00 0.00 60.37 61.27 1rla h HIS 111 Cb 0.07 -0.15 -0.00 0.00 2.52 0.00 0.00 27.41 29.84 1rla h HIS 111 CO -0.01 0.35 -0.07 0.00 0.71 0.00 0.00 177.93 178.91 1rla h ALA 112 N 1.08 1.20 -0.54 5.26 0.00 -0.21 -1.47 119.26 124.57 1rla h ALA 112 Ca 0.13 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1rla h ALA 112 Cb 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1rla h ALA 112 CO -0.02 0.09 0.21 0.00 0.00 0.00 0.00 179.25 179.53 1rla h ARG 113 N 0.00 0.78 0.14 0.00 3.08 -1.15 -2.37 114.38 114.87 1rla h ARG 113 Ca -0.00 -0.12 -0.36 0.00 0.07 0.00 0.00 59.98 59.57 1rla h ARG 113 Cb 0.29 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1rla h ARG 113 CO 0.01 0.65 -1.90 0.28 -1.07 0.00 0.00 179.97 177.94 1rla h VAL 114 N 0.77 0.74 -3.00 2.04 2.07 -1.52 -3.42 116.25 113.93 1rla h VAL 114 Ca 0.18 -2.42 -0.62 0.00 0.82 0.00 0.00 66.70 64.67 1rla h VAL 114 Cb 0.16 2.59 -0.41 0.00 -1.52 0.00 0.00 31.29 32.11 1rla h VAL 114 CO -0.02 0.87 -0.68 -1.00 0.02 0.00 0.00 177.57 176.77 1rla s HIS 115 N -2.57 2.78 0.47 1.57 3.76 -0.60 -4.94 115.29 115.77 1rla s HIS 115 Ca -0.19 -2.97 0.34 0.00 -0.15 0.00 0.00 55.06 52.10 1rla s HIS 115 Cb 0.06 -2.27 1.82 0.00 1.11 0.00 0.00 32.58 33.30 1rla s HIS 115 CO 0.80 -0.67 2.19 -1.00 -0.85 0.00 0.00 174.74 175.20 1rla h PRO 116 N 5.89 0.00 -0.60 8.40 0.13 -1.68 -2.84 132.00 141.30 1rla h PRO 116 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1rla h PRO 116 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1rla h PRO 116 CO 0.61 0.04 0.00 -0.40 -0.23 0.00 0.00 178.00 178.02 1rla n ASP 117 N -3.40 3.44 -4.63 1.44 5.75 -1.26 -4.96 116.55 112.92 1rla n ASP 117 Ca -0.02 -2.17 -0.30 0.00 -0.01 0.00 0.00 54.79 52.29 1rla n ASP 117 Cb 0.17 -0.45 0.18 0.00 -1.03 0.00 0.00 41.12 40.00 1rla n ASP 117 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 1rla s LEU 118 N -1.27 2.13 0.17 -2.12 0.05 -1.07 -4.55 118.68 112.01 1rla s LEU 118 Ca 0.39 1.83 0.07 0.00 0.05 0.00 0.00 54.13 56.46 1rla s LEU 118 Cb 0.23 -4.09 -0.04 0.00 -2.05 0.00 0.00 46.19 40.23 1rla s LEU 118 CO 0.23 -3.29 -0.14 0.00 -0.55 0.00 0.00 176.35 172.60 1rla s VAL 120 N -2.75 1.85 -0.28 0.00 1.01 0.90 -1.08 120.40 120.05 1rla s VAL 120 Ca 0.17 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 61.18 1rla s VAL 120 Cb -0.01 -1.58 0.03 0.00 0.00 0.00 0.00 36.38 34.82 1rla s VAL 120 CO 0.04 0.52 -0.01 -0.63 0.00 0.00 0.00 175.10 175.02 1rla s ILE 121 N -0.02 3.13 -0.35 2.22 1.01 -0.42 -1.44 121.20 125.34 1rla s ILE 121 Ca -0.06 -1.14 -0.10 0.00 0.00 0.00 0.00 60.65 59.35 1rla s ILE 121 Cb -0.14 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.65 1rla s ILE 121 CO 0.04 0.03 0.18 0.86 0.00 0.00 0.00 174.94 176.04 1rla s TRP 122 N 1.32 3.22 -0.37 3.97 -0.11 0.13 -1.81 118.94 125.28 1rla s TRP 122 Ca -0.02 -0.83 -0.13 0.00 1.22 0.00 0.00 56.10 56.34 1rla s TRP 122 Cb -0.18 -2.40 0.01 0.00 -1.50 0.00 0.00 33.47 29.40 1rla s TRP 122 CO -0.02 -0.57 0.25 0.08 -4.62 0.00 0.00 176.95 172.07 1rla s VAL 123 N 1.57 5.09 -0.06 5.86 1.01 -0.76 -0.76 120.40 132.35 1rla s VAL 123 Ca 0.03 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 61.17 1rla s VAL 123 Cb -0.18 -3.75 0.11 0.00 0.00 0.00 0.00 36.38 32.55 1rla s VAL 123 CO 0.06 -0.18 0.90 -0.62 0.00 0.00 0.00 175.10 175.26 1rla s ASP 124 N 1.66 -0.41 0.20 3.32 -1.08 -0.89 -0.70 116.67 118.78 1rla s ASP 124 Ca 0.05 0.23 0.26 0.00 -0.52 0.00 0.00 52.55 52.57 1rla s ASP 124 Cb -0.18 0.38 0.87 0.00 -1.46 0.00 0.00 42.92 42.53 1rla s ASP 124 CO 0.09 -0.53 1.77 0.00 0.52 0.00 0.00 175.17 177.03 1rla n ALA 125 N 0.24 2.17 -2.44 3.66 0.00 -1.26 -2.76 120.51 120.13 1rla n ALA 125 Ca -0.11 -0.01 -0.25 0.00 0.00 0.00 0.00 53.44 53.07 1rla n ALA 125 Cb 0.60 -1.45 -0.11 0.00 0.00 0.00 0.00 19.45 18.48 1rla n ALA 125 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1rla s HIS 126 N -3.13 2.14 0.05 0.00 3.76 -1.26 -1.01 115.29 115.84 1rla s HIS 126 Ca 0.10 -0.39 0.09 0.00 -0.15 0.00 0.00 55.06 54.71 1rla s HIS 126 Cb 0.12 -1.03 -0.19 0.00 1.11 0.00 0.00 32.58 32.59 1rla s HIS 126 CO 0.55 0.49 1.12 1.79 -0.85 0.00 0.00 174.74 177.84 1rla h THR 127 N 3.01 1.39 -6.13 1.30 1.35 -1.88 -3.48 112.91 108.47 1rla h THR 127 Ca -0.44 -3.11 -0.45 0.00 -0.55 0.00 0.00 66.41 61.87 1rla h THR 127 Cb 1.22 2.68 0.03 0.00 -1.73 0.00 0.00 68.15 70.35 1rla h THR 127 CO 0.52 0.79 -0.73 0.47 -0.25 0.00 0.00 175.52 176.32 1rla n ASP 128 N -3.25 -5.39 -0.54 5.36 8.00 -1.26 -4.76 116.55 114.71 1rla n ASP 128 Ca -0.04 -0.69 0.07 0.00 0.71 0.00 0.00 54.79 54.83 1rla n ASP 128 Cb 0.95 -4.32 0.17 0.00 -0.02 0.00 0.00 41.12 37.90 1rla n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rla n ILE 129 N -4.81 1.91 -2.40 0.53 3.06 -1.11 -2.21 119.36 114.34 1rla n ILE 129 Ca 0.03 -2.77 -0.40 0.00 -2.50 0.00 0.00 62.75 57.11 1rla n ILE 129 Cb 0.54 -0.13 -0.04 0.00 0.54 0.00 0.00 39.64 40.55 1rla n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 1rla s ASN 130 N -3.01 7.16 0.54 9.51 0.01 -0.84 -4.60 114.94 123.71 1rla s ASN 130 Ca 0.35 2.33 -0.01 0.00 -0.71 0.00 0.00 52.86 54.83 1rla s ASN 130 Cb 0.34 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.39 1rla s ASN 130 CO -0.05 -0.25 0.78 0.42 -1.51 0.00 0.00 177.10 176.49 1rla s THR 131 N -0.98 3.25 0.63 1.60 -4.23 -1.26 -4.33 115.64 110.33 1rla s THR 131 Ca 0.47 -0.46 0.36 0.00 -1.18 0.00 0.00 61.69 60.88 1rla s THR 131 Cb -0.33 -3.24 0.39 0.00 1.34 0.00 0.00 72.50 70.66 1rla s THR 131 CO 0.42 -0.19 2.26 -0.65 -0.54 0.00 0.00 174.62 175.92 1rla h PRO 132 N 0.08 0.00 0.00 3.99 0.11 -1.95 -1.88 132.00 132.35 1rla h PRO 132 Ca -0.44 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.48 1rla h PRO 132 Cb 1.28 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 1rla h PRO 132 CO 0.56 0.00 -1.19 -0.07 -0.21 0.00 0.00 178.00 177.09 1rla h LEU 133 N 0.00 0.00 0.00 2.35 3.38 -1.93 -3.37 115.31 115.74 1rla h LEU 133 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1rla h LEU 133 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1rla h LEU 133 CO -0.00 0.73 -1.12 0.35 0.09 0.00 0.00 178.44 178.49 1rla n THR 134 N -3.08 0.25 -1.87 0.22 -2.24 -0.75 -4.98 114.28 101.83 1rla n THR 134 Ca -0.07 -0.34 -0.40 0.00 -2.27 0.00 0.00 64.05 60.97 1rla n THR 134 Cb 0.88 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.17 1rla n THR 134 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1rla s THR 135 N -3.27 2.20 -0.21 4.28 -4.23 -0.95 -4.89 115.64 108.58 1rla s THR 135 Ca 0.01 0.19 0.21 0.00 -1.18 0.00 0.00 61.69 60.92 1rla s THR 135 Cb 0.13 -3.12 -0.03 0.00 1.34 0.00 0.00 72.50 70.83 1rla s THR 135 CO 0.81 0.04 1.01 0.28 -0.54 0.00 0.00 174.62 176.21 1rla h SER 136 N 2.75 0.00 -3.79 3.99 0.02 -1.93 -3.45 113.55 111.14 1rla h SER 136 Ca -0.50 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 59.93 1rla h SER 136 Cb 1.25 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.60 1rla h SER 136 CO 0.63 0.19 -0.79 -0.94 -1.14 0.00 0.00 176.83 174.78 1rla s SER 137 N -5.55 2.53 -0.00 3.07 1.04 -1.26 -5.03 113.70 108.50 1rla s SER 137 Ca -0.01 -0.81 0.03 0.00 0.48 0.00 0.00 55.95 55.64 1rla s SER 137 Cb 0.09 -0.14 0.10 0.00 0.10 0.00 0.00 66.02 66.17 1rla s SER 137 CO 0.79 -0.03 1.03 0.61 0.98 0.00 0.00 173.24 176.62 1rla n GLY 138 N 0.52 -0.24 3.65 7.32 0.00 -1.24 -4.87 105.19 110.34 1rla n GLY 138 Ca -0.15 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1rla n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rla s ASN 139 N -0.89 6.48 0.48 1.61 0.01 -1.26 -1.91 114.94 119.46 1rla s ASN 139 Ca 0.07 2.37 0.28 0.00 -0.71 0.00 0.00 52.86 54.87 1rla s ASN 139 Cb 0.04 -2.53 1.05 0.00 0.41 0.00 0.00 41.25 40.22 1rla s ASN 139 CO 0.04 -1.06 1.87 -0.07 -1.51 0.00 0.00 177.10 176.37 1rla h LEU 140 N 10.78 0.00 -2.50 0.60 3.38 -1.51 -3.09 115.31 122.97 1rla h LEU 140 Ca -0.44 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.53 1rla h LEU 140 Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1rla h LEU 140 CO 0.95 0.13 -0.01 1.12 0.09 0.00 0.00 178.44 180.71 1rla h HIS 141 N 0.00 0.00 -0.56 1.13 2.07 -1.35 0.14 115.15 116.59 1rla h HIS 141 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1rla h HIS 141 Cb 0.68 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.66 1rla h HIS 141 CO 0.00 0.01 0.00 0.41 -3.07 0.00 0.00 177.93 175.28 1rla n GLY 142 N -0.82 1.72 0.00 6.13 0.00 -1.17 -4.34 105.19 106.71 1rla n GLY 142 Ca -0.02 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1rla n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rla n GLN 143 N 1.23 -0.30 -0.38 1.61 6.02 0.03 -1.98 117.38 123.61 1rla n GLN 143 Ca 0.20 -0.36 -0.07 0.00 -0.01 0.00 0.00 57.00 56.76 1rla n GLN 143 Cb 0.51 -0.85 -0.04 0.00 1.02 0.00 0.00 30.24 30.88 1rla n GLN 143 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1rla h PRO 144 N 0.00 -0.03 0.00 -1.09 0.11 -1.48 -0.64 132.00 128.86 1rla h PRO 144 Ca 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 1rla h PRO 144 Cb 0.10 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.22 1rla h PRO 144 CO 0.00 -0.02 -0.01 0.28 -0.21 0.00 0.00 178.00 178.04 1rla h VAL 145 N -0.03 0.59 -0.32 3.15 2.07 -1.74 -1.43 116.25 118.54 1rla h VAL 145 Ca 0.23 -0.03 -0.07 0.00 0.82 0.00 0.00 66.70 67.65 1rla h VAL 145 Cb 0.50 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1rla h VAL 145 CO -0.92 0.01 -0.09 0.00 0.02 0.00 0.00 177.57 176.58 1rla h ALA 146 N 1.99 1.26 0.00 1.67 0.00 -1.27 -2.25 119.26 120.66 1rla h ALA 146 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1rla h ALA 146 Cb 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1rla h ALA 146 CO 0.00 0.49 0.00 0.74 0.00 0.00 0.00 179.25 180.48 1rla h PHE 147 N 0.49 0.00 0.00 0.00 -1.00 -1.28 -3.32 116.94 111.83 1rla h PHE 147 Ca 0.09 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.76 1rla h PHE 147 Cb 0.46 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.99 1rla h PHE 147 CO 0.02 0.00 -1.92 1.28 -1.61 0.00 0.00 178.31 176.08 1rla n LEU 148 N -2.70 0.20 -4.73 1.54 4.77 -0.94 -4.35 117.00 110.79 1rla n LEU 148 Ca 0.05 0.08 -0.41 0.00 -0.03 0.00 0.00 56.01 55.69 1rla n LEU 148 Cb 0.47 0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.65 1rla n LEU 148 CO 0.32 0.12 0.84 -0.76 -1.33 0.00 0.00 177.39 176.58 1rla s LEU 149 N -5.01 4.44 0.21 2.23 1.43 -0.89 -2.42 118.68 118.67 1rla s LEU 149 Ca -0.07 2.08 -0.06 0.00 -1.03 0.00 0.00 54.13 55.05 1rla s LEU 149 Cb 0.11 -3.60 0.16 0.00 0.03 0.00 0.00 46.19 42.89 1rla s LEU 149 CO 0.86 -0.34 1.66 0.11 0.23 0.00 0.00 176.35 178.88 1rla h LYS 150 N 5.75 0.95 0.00 1.70 1.57 -1.43 -2.93 116.57 122.17 1rla h LYS 150 Ca -0.43 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.04 1rla h LYS 150 Cb 1.21 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1rla h LYS 150 CO 0.76 0.97 0.00 0.39 -0.57 0.00 0.00 179.45 180.99 1rla n GLU 151 N -4.17 0.16 -0.11 3.15 4.71 -1.26 -2.28 120.64 120.84 1rla n GLU 151 Ca 0.02 0.17 0.06 0.00 -0.01 0.00 0.00 57.16 57.40 1rla n GLU 151 Cb 0.36 -1.50 0.11 0.00 -1.01 0.00 0.00 31.44 29.40 1rla n GLU 151 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1rla n LEU 152 N -1.34 2.54 -4.68 -4.62 4.32 -1.11 -4.95 117.00 107.17 1rla n LEU 152 Ca 0.06 -1.62 -0.42 0.00 -0.02 0.00 0.00 56.01 54.01 1rla n LEU 152 Cb 0.13 -0.14 -0.03 0.00 -1.62 0.00 0.00 43.42 41.76 1rla n LEU 152 CO 0.12 0.59 1.37 -0.75 -1.22 0.00 0.00 177.39 177.50 1rla s LYS 153 N -0.97 4.19 0.00 3.23 2.47 -0.97 -2.46 119.74 125.22 1rla s LYS 153 Ca 0.19 2.35 0.00 0.00 -1.56 0.00 0.00 55.97 56.95 1rla s LYS 153 Cb 0.11 -3.71 0.00 0.00 -1.46 0.00 0.00 37.83 32.77 1rla s LYS 153 CO 0.15 -0.78 0.00 0.41 0.16 0.00 0.00 175.35 175.29 1rla n GLY 154 N 4.08 0.35 0.85 5.54 0.00 -1.26 -4.84 105.19 109.91 1rla n GLY 154 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1rla n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rla n LYS 155 N -1.80 2.15 -3.70 1.61 4.76 -1.03 -4.89 118.16 115.26 1rla n LYS 155 Ca 0.00 -1.70 -0.14 0.00 -2.87 0.00 0.00 58.31 53.60 1rla n LYS 155 Cb 0.15 -1.47 -0.09 0.00 -1.84 0.00 0.00 35.03 31.78 1rla n LYS 155 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 1rla s PHE 156 N -1.85 -0.45 0.55 2.13 -0.12 -1.26 -4.97 117.98 112.01 1rla s PHE 156 Ca 0.33 0.98 -0.20 0.00 -0.05 0.00 0.00 56.93 57.99 1rla s PHE 156 Cb 0.21 0.19 -0.07 0.00 -0.63 0.00 0.00 43.02 42.71 1rla s PHE 156 CO 0.31 -0.34 0.88 -0.35 -0.05 0.00 0.00 175.22 175.67 1rla n PRO 157 N 2.15 0.92 -2.04 1.99 -0.04 -1.26 -4.91 135.00 131.81 1rla n PRO 157 Ca -0.16 0.35 -0.41 0.00 -0.04 0.00 0.00 63.50 63.23 1rla n PRO 157 Cb 0.57 -2.04 -0.02 0.00 -0.04 0.00 0.00 33.50 31.96 1rla n PRO 157 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1rla s ASP 158 N -1.11 6.69 -0.01 3.54 1.01 -1.26 -4.99 116.67 120.54 1rla s ASP 158 Ca 0.71 2.61 -0.03 0.00 0.71 0.00 0.00 52.55 56.56 1rla s ASP 158 Cb -0.46 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 40.82 1rla s ASP 158 CO 0.51 -0.69 0.17 -0.69 0.21 0.00 0.00 175.17 174.68 1rla s VAL 159 N 0.15 5.34 0.03 -1.27 1.01 -1.26 -5.05 120.40 119.35 1rla s VAL 159 Ca 0.60 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 62.10 1rla s VAL 159 Cb -0.41 -3.48 -0.08 0.00 0.00 0.00 0.00 36.38 32.40 1rla s VAL 159 CO 0.41 0.34 1.90 -2.84 0.00 0.00 0.00 175.10 174.91 1rla s PRO 160 N -1.88 4.15 0.00 2.72 0.02 -1.26 -2.37 135.00 136.38 1rla s PRO 160 Ca 0.26 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1rla s PRO 160 Cb -0.13 -4.09 0.00 0.00 0.02 0.00 0.00 34.50 30.30 1rla s PRO 160 CO 0.17 -0.93 0.00 0.41 -0.33 0.00 0.00 177.00 176.33 1rla n GLY 161 N 4.45 0.32 0.44 0.52 0.00 -1.26 -2.65 105.19 107.01 1rla n GLY 161 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.26 1rla n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1rla n PHE 162 N -1.81 0.35 0.31 1.61 3.01 -1.00 -4.15 117.46 115.78 1rla n PHE 162 Ca 0.00 -0.57 0.20 0.00 1.01 0.00 0.00 57.45 58.09 1rla n PHE 162 Cb 0.00 -0.07 0.98 0.00 -0.01 0.00 0.00 39.48 40.38 1rla n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1rla h SER 163 N 1.28 0.00 1.55 4.37 4.64 -1.93 -2.00 113.55 121.46 1rla h SER 163 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rla h SER 163 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1rla h SER 163 CO 0.02 0.00 0.00 4.11 -0.87 0.00 0.00 176.83 180.09 1rla h TRP 164 N 0.00 0.00 -3.59 4.77 5.08 -1.97 -3.46 115.95 116.78 1rla h TRP 164 Ca 0.00 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.45 1rla h TRP 164 Cb 0.18 0.00 0.03 0.00 -3.00 0.00 0.00 29.16 26.36 1rla h TRP 164 CO 0.00 0.00 0.56 0.08 -1.28 0.00 0.00 178.44 177.80 1rla s VAL 165 N -3.31 3.39 -0.15 0.12 1.01 -0.76 -5.03 120.40 115.67 1rla s VAL 165 Ca 0.06 1.24 -0.00 0.00 0.00 0.00 0.00 61.98 63.28 1rla s VAL 165 Cb 0.08 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.70 1rla s VAL 165 CO 0.60 0.23 -0.09 -0.89 0.00 0.00 0.00 175.10 174.95 1rla s THR 166 N -0.43 1.29 -0.33 3.92 2.01 -1.26 -5.07 115.64 115.77 1rla s THR 166 Ca 0.51 -0.57 -0.35 0.00 0.31 0.00 0.00 61.69 61.59 1rla s THR 166 Cb -0.34 -1.32 -0.11 0.00 0.01 0.00 0.00 72.50 70.74 1rla s THR 166 CO 0.40 0.31 2.18 -2.65 -0.69 0.00 0.00 174.62 174.16 1rla n PRO 167 N 4.84 1.14 -0.06 4.92 -0.02 -1.26 -4.83 135.00 139.73 1rla n PRO 167 Ca -0.14 0.31 -0.12 0.00 -2.02 0.00 0.00 63.50 61.54 1rla n PRO 167 Cb 0.49 -2.49 -0.15 0.00 -0.02 0.00 0.00 33.50 31.33 1rla n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rla s ILE 169 N -2.54 2.71 0.56 0.00 -0.00 -1.07 -4.95 121.20 115.91 1rla s ILE 169 Ca -0.12 -1.71 0.04 0.00 -0.00 0.00 0.00 60.65 58.86 1rla s ILE 169 Cb 0.07 -2.28 0.06 0.00 -0.00 0.00 0.00 42.46 40.31 1rla s ILE 169 CO 0.79 -0.00 0.78 -0.94 -0.00 0.00 0.00 174.94 175.57 1rla s SER 170 N -2.41 5.13 0.55 4.36 1.04 -1.26 -1.20 113.70 119.90 1rla s SER 170 Ca 0.20 -0.36 0.25 0.00 0.48 0.00 0.00 55.95 56.51 1rla s SER 170 Cb -0.09 -0.39 1.57 0.00 0.10 0.00 0.00 66.02 67.20 1rla s SER 170 CO 0.11 -1.25 2.18 0.00 0.98 0.00 0.00 173.24 175.25 1rla h ALA 171 N 0.10 1.61 0.00 5.32 0.00 -1.96 -1.47 119.26 122.86 1rla h ALA 171 Ca -0.38 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1rla h ALA 171 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1rla h ALA 171 CO 0.45 0.05 0.00 1.63 0.00 0.00 0.00 179.25 181.38 1rla n LYS 172 N -4.01 0.03 -0.16 0.00 4.76 -1.26 -3.57 118.16 113.95 1rla n LYS 172 Ca -0.03 0.13 0.09 0.00 -2.87 0.00 0.00 58.31 55.63 1rla n LYS 172 Cb 0.12 -1.54 0.17 0.00 -1.84 0.00 0.00 35.03 31.95 1rla n LYS 172 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1rla n ASP 173 N -1.59 3.10 -4.27 4.39 8.00 -0.55 -4.92 116.55 120.70 1rla n ASP 173 Ca 0.05 -1.90 -0.27 0.00 0.71 0.00 0.00 54.79 53.39 1rla n ASP 173 Cb 0.28 -0.21 -0.14 0.00 -0.02 0.00 0.00 41.12 41.03 1rla n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1rla s ILE 174 N -1.26 1.78 -0.04 0.53 2.07 -1.23 -0.07 121.20 122.98 1rla s ILE 174 Ca 0.31 -1.24 -0.00 0.00 -1.41 0.00 0.00 60.65 58.31 1rla s ILE 174 Cb 0.18 -1.54 0.03 0.00 0.13 0.00 0.00 42.46 41.26 1rla s ILE 174 CO 0.25 0.25 -0.00 -0.69 -1.91 0.00 0.00 174.94 172.84 1rla s VAL 175 N -0.79 0.25 -0.01 4.00 1.01 -0.52 -4.15 120.40 120.19 1rla s VAL 175 Ca 0.09 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.08 1rla s VAL 175 Cb -0.09 -0.36 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 1rla s VAL 175 CO 0.02 0.18 0.27 -0.31 0.00 0.00 0.00 175.10 175.26 1rla s TYR 176 N 1.30 3.60 -0.05 5.22 2.02 -1.06 -0.69 117.35 127.69 1rla s TYR 176 Ca -0.06 0.62 -0.01 0.00 -0.37 0.00 0.00 57.07 57.26 1rla s TYR 176 Cb -0.13 -2.02 0.03 0.00 -0.40 0.00 0.00 41.96 39.43 1rla s TYR 176 CO -0.02 0.63 0.02 0.42 -1.57 0.00 0.00 175.55 175.03 1rla s ILE 177 N -1.24 0.19 0.00 2.71 1.01 0.06 -0.95 121.20 122.99 1rla s ILE 177 Ca 0.26 0.21 0.00 0.00 0.00 0.00 0.00 60.65 61.11 1rla s ILE 177 Cb -0.13 -0.36 0.00 0.00 0.01 0.00 0.00 42.46 41.97 1rla s ILE 177 CO 0.14 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.90 1rla n GLY 178 N 4.97 0.85 3.66 6.18 0.00 -0.25 -2.09 105.19 118.50 1rla n GLY 178 Ca -0.10 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.47 1rla n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rla n LEU 179 N 0.00 2.86 0.00 0.99 4.77 -1.11 -4.20 117.00 120.31 1rla n LEU 179 Ca 0.00 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 1rla n LEU 179 Cb 0.00 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 39.69 1rla n LEU 179 CO 0.00 -0.62 0.00 -2.11 -1.33 0.00 0.00 177.39 173.33 1rla n ARG 180 N 1.97 0.00 -3.26 3.23 1.85 -0.18 -0.64 116.66 119.64 1rla n ARG 180 Ca 0.12 -0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.75 1rla n ARG 180 Cb 0.30 -0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.63 1rla n ARG 180 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1rla s ASP 181 N 0.00 0.82 -0.17 2.89 2.15 -0.40 -5.05 116.67 116.91 1rla s ASP 181 Ca 0.00 -2.69 -0.01 0.00 0.43 0.00 0.00 52.55 50.28 1rla s ASP 181 Cb 0.00 0.12 -0.00 0.00 -0.30 0.00 0.00 42.92 42.73 1rla s ASP 181 CO 0.00 -0.15 -0.11 -0.69 -0.17 0.00 0.00 175.17 174.04 1rla s VAL 182 N 0.33 2.95 0.81 1.11 1.01 -1.26 -4.46 120.40 120.88 1rla s VAL 182 Ca 0.31 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 1rla s VAL 182 Cb 0.01 -2.28 0.08 0.00 0.00 0.00 0.00 36.38 34.20 1rla s VAL 182 CO -0.15 0.49 1.11 -1.81 0.00 0.00 0.00 175.10 174.74 1rla s ASP 183 N 0.97 4.00 0.20 3.32 1.01 -1.26 -4.79 116.67 120.13 1rla s ASP 183 Ca -0.02 1.97 -0.10 0.00 0.71 0.00 0.00 52.55 55.11 1rla s ASP 183 Cb -0.15 -2.54 0.20 0.00 1.01 0.00 0.00 42.92 41.45 1rla s ASP 183 CO -0.01 -2.38 1.81 -0.65 0.21 0.00 0.00 175.17 174.15 1rla h PRO 184 N -1.30 0.66 0.21 8.23 0.11 -1.99 -1.05 132.00 136.87 1rla h PRO 184 Ca -0.44 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1rla h PRO 184 Cb 1.25 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1rla h PRO 184 CO 0.48 0.44 -0.20 0.78 -0.21 0.00 0.00 178.00 179.29 1rla h GLY 185 N 0.68 -0.44 0.52 -0.55 0.00 -1.92 -1.01 103.07 100.36 1rla h GLY 185 Ca 0.28 0.23 0.08 0.00 0.00 0.00 0.00 47.33 47.91 1rla h GLY 185 CO -0.16 -0.19 0.27 0.83 0.00 0.00 0.00 176.54 177.29 1rla h GLU 186 N -0.44 0.48 -0.73 4.80 5.08 -1.81 -1.13 114.58 120.83 1rla h GLU 186 Ca -0.00 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1rla h GLU 186 Cb 0.40 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1rla h GLU 186 CO -0.04 0.32 0.45 1.25 -1.00 0.00 0.00 179.01 179.99 1rla h HIS 187 N 0.50 0.95 -0.21 4.33 2.76 -0.93 -1.14 115.15 121.41 1rla h HIS 187 Ca 0.29 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.46 1rla h HIS 187 Cb 0.29 -0.32 -0.01 0.00 1.55 0.00 0.00 27.41 28.93 1rla h HIS 187 CO -0.13 0.62 0.12 -0.92 -1.30 0.00 0.00 177.93 176.32 1rla h TYR 188 N 1.00 0.29 0.37 5.26 3.20 -0.03 -2.35 116.97 124.72 1rla h TYR 188 Ca 0.26 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 1rla h TYR 188 Cb -0.06 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 1rla h TYR 188 CO 0.00 0.26 -0.33 0.82 -1.64 0.00 0.00 178.16 177.27 1rla h ILE 189 N 0.24 0.31 -0.62 1.81 2.04 -0.43 -0.39 117.51 120.46 1rla h ILE 189 Ca 0.07 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.93 1rla h ILE 189 Cb 0.06 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 1rla h ILE 189 CO -0.01 0.00 0.37 0.16 0.00 0.00 0.00 178.15 178.67 1rla h ILE 190 N -0.72 1.18 0.03 -0.67 3.07 -1.25 0.15 117.51 119.30 1rla h ILE 190 Ca -0.03 -0.39 -0.00 0.00 1.55 0.00 0.00 64.86 66.00 1rla h ILE 190 Cb 0.64 0.30 0.00 0.00 -0.27 0.00 0.00 36.82 37.49 1rla h ILE 190 CO -0.04 0.18 -0.01 0.11 -1.05 0.00 0.00 178.15 177.34 1rla h LYS 191 N 0.85 -0.04 -0.90 0.16 1.79 -1.23 -1.17 116.57 116.04 1rla h LYS 191 Ca 0.22 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.70 1rla h LYS 191 Cb -0.03 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 30.58 1rla h LYS 191 CO -0.04 0.41 0.56 1.15 -1.08 0.00 0.00 179.45 180.45 1rla h THR 192 N -0.50 1.24 -0.00 -0.16 2.02 -0.82 -2.37 112.91 112.33 1rla h THR 192 Ca -0.00 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1rla h THR 192 Cb 0.47 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1rla h THR 192 CO 0.01 0.25 -0.15 0.18 0.37 0.00 0.00 175.52 176.18 1rla n LEU 193 N -4.37 0.20 -2.15 2.58 4.32 0.51 -4.95 117.00 113.14 1rla n LEU 193 Ca 0.10 0.28 -0.16 0.00 -0.02 0.00 0.00 56.01 56.21 1rla n LEU 193 Cb 0.05 -0.37 0.02 0.00 -1.62 0.00 0.00 43.42 41.50 1rla n LEU 193 CO 0.37 0.05 -0.03 0.61 -1.22 0.00 0.00 177.39 177.17 1rla n GLY 194 N 1.45 -0.19 3.69 -0.72 0.00 -0.50 -4.90 105.19 104.02 1rla n GLY 194 Ca 0.08 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1rla n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rla s ILE 195 N -2.96 4.20 0.16 -0.61 1.01 -0.85 -4.90 121.20 117.25 1rla s ILE 195 Ca 0.19 1.53 -0.31 0.00 0.00 0.00 0.00 60.65 62.05 1rla s ILE 195 Cb -0.08 -3.98 -0.09 0.00 0.01 0.00 0.00 42.46 38.31 1rla s ILE 195 CO 0.23 -0.01 1.50 -0.75 0.00 0.00 0.00 174.94 175.91 1rla s LYS 196 N 2.31 4.25 0.07 2.79 2.47 -1.26 -4.89 119.74 125.48 1rla s LYS 196 Ca 0.57 2.27 -0.11 0.00 -1.56 0.00 0.00 55.97 57.13 1rla s LYS 196 Cb -0.25 -3.18 0.01 0.00 -1.46 0.00 0.00 37.83 32.95 1rla s LYS 196 CO 0.22 -0.53 0.25 1.52 0.16 0.00 0.00 175.35 176.97 1rla s TYR 197 N 0.96 0.01 -0.37 4.03 1.13 -1.26 -2.55 117.35 119.29 1rla s TYR 197 Ca 0.67 -0.29 0.01 0.00 -1.41 0.00 0.00 57.07 56.05 1rla s TYR 197 Cb -0.41 0.04 0.12 0.00 -1.10 0.00 0.00 41.96 40.60 1rla s TYR 197 CO 0.33 -0.53 0.16 -0.06 -2.51 0.00 0.00 175.55 172.94 1rla s PHE 198 N -3.19 1.98 1.01 -3.49 0.08 -0.12 -4.93 117.98 109.32 1rla s PHE 198 Ca -0.00 -2.15 -0.16 0.00 0.12 0.00 0.00 56.93 54.73 1rla s PHE 198 Cb 0.02 -1.88 0.21 0.00 -0.57 0.00 0.00 43.02 40.80 1rla s PHE 198 CO -0.07 -0.84 1.25 -1.54 -0.10 0.00 0.00 175.22 173.92 1rla s SER 199 N 0.97 2.69 0.56 1.36 1.04 -1.26 -1.09 113.70 117.96 1rla s SER 199 Ca 0.14 0.42 0.25 0.00 0.48 0.00 0.00 55.95 57.24 1rla s SER 199 Cb -0.21 -0.57 1.50 0.00 0.10 0.00 0.00 66.02 66.84 1rla s SER 199 CO -0.11 -3.01 2.08 0.24 0.98 0.00 0.00 173.24 173.42 1rla h MET 200 N -1.83 0.00 -0.08 4.02 0.00 -1.08 -1.26 114.93 114.70 1rla h MET 200 Ca -0.45 0.00 -0.12 0.00 0.00 0.00 0.00 59.70 59.13 1rla h MET 200 Cb 1.26 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.85 1rla h MET 200 CO 0.40 0.00 -0.50 0.00 0.00 0.00 0.00 176.91 176.81 1rla h THR 201 N 0.00 1.35 0.01 2.22 1.03 -1.91 -0.17 112.91 115.43 1rla h THR 201 Ca 0.12 -1.75 -0.19 0.00 -0.01 0.00 0.00 66.41 64.58 1rla h THR 201 Cb 0.55 1.85 -0.02 0.00 -1.07 0.00 0.00 68.15 69.46 1rla h THR 201 CO -0.00 0.52 -0.87 -0.33 -0.01 0.00 0.00 175.52 174.82 1rla h GLU 202 N 0.18 0.11 -0.31 0.00 3.07 -1.58 -1.29 114.58 114.77 1rla h GLU 202 Ca 0.01 -0.13 -0.03 0.00 -0.50 0.00 0.00 59.36 58.70 1rla h GLU 202 Cb 0.95 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.89 1rla h GLU 202 CO 0.08 0.91 0.07 0.28 -1.40 0.00 0.00 179.01 178.95 1rla h VAL 203 N 0.06 1.22 -0.62 3.13 2.07 -1.08 0.29 116.25 121.32 1rla h VAL 203 Ca -0.03 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 1rla h VAL 203 Cb 1.51 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 1rla h VAL 203 CO 0.13 0.25 0.30 0.44 0.02 0.00 0.00 177.57 178.71 1rla h ASP 204 N 0.34 0.81 -0.10 0.57 3.32 -0.99 0.26 116.42 120.63 1rla h ASP 204 Ca 0.10 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1rla h ASP 204 Cb 0.30 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1rla h ASP 204 CO 0.00 0.71 -0.03 0.50 -1.72 0.00 0.00 179.24 178.71 1rla h LYS 205 N 0.85 0.19 0.00 3.56 3.64 -1.08 -3.37 116.57 120.36 1rla h LYS 205 Ca 0.21 -0.07 -0.30 0.00 -1.27 0.00 0.00 60.65 59.22 1rla h LYS 205 Cb 0.11 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 1rla h LYS 205 CO -0.03 0.51 -1.79 1.28 -2.27 0.00 0.00 179.45 177.15 1rla n LEU 206 N -4.77 0.78 0.00 5.20 4.77 0.08 -5.09 117.00 117.97 1rla n LEU 206 Ca -0.06 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1rla n LEU 206 Cb 0.24 0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1rla n LEU 206 CO 0.36 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 1rla n GLY 207 N 1.58 -0.26 0.29 -0.72 0.00 0.91 -4.38 105.19 102.61 1rla n GLY 207 Ca -0.19 -1.45 0.08 0.00 0.00 0.00 0.00 46.02 44.47 1rla n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1rla h ILE 208 N 0.00 1.01 -0.36 -0.61 6.09 -1.93 -2.52 117.51 119.17 1rla h ILE 208 Ca 0.00 -0.08 0.01 0.00 -1.37 0.00 0.00 64.86 63.42 1rla h ILE 208 Cb 0.00 0.75 -0.02 0.00 0.47 0.00 0.00 36.82 38.02 1rla h ILE 208 CO 0.00 0.04 0.23 1.23 -3.07 0.00 0.00 178.15 176.59 1rla h GLY 209 N 0.23 0.51 1.95 8.18 0.00 -1.96 -1.94 103.07 110.04 1rla h GLY 209 Ca 0.10 -0.18 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 1rla h GLY 209 CO -0.02 0.18 -0.72 1.70 0.00 0.00 0.00 176.54 177.68 1rla h LYS 210 N 0.48 0.05 -0.57 4.80 1.63 -1.68 -2.85 116.57 118.42 1rla h LYS 210 Ca 0.14 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.90 1rla h LYS 210 Cb -0.04 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.57 1rla h LYS 210 CO -0.04 0.75 0.37 0.28 -3.45 0.00 0.00 179.45 177.36 1rla h VAL 211 N 0.03 1.13 -0.26 2.00 2.07 -1.12 -0.60 116.25 119.50 1rla h VAL 211 Ca -0.01 -0.26 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 1rla h VAL 211 Cb 1.27 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1rla h VAL 211 CO 0.10 0.14 -0.28 0.24 0.02 0.00 0.00 177.57 177.79 1rla h MET 212 N 0.76 0.51 -0.37 1.57 2.86 -1.22 -1.60 114.93 117.44 1rla h MET 212 Ca 0.21 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1rla h MET 212 Cb -0.07 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1rla h MET 212 CO -0.05 0.74 0.19 1.49 1.06 0.00 0.00 176.91 180.34 1rla h GLU 213 N 0.45 0.53 -0.13 1.72 4.81 -1.20 -1.51 114.58 119.23 1rla h GLU 213 Ca 0.06 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.06 1rla h GLU 213 Cb 0.72 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1rla h GLU 213 CO 0.06 0.46 -0.58 0.93 -0.73 0.00 0.00 179.01 179.14 1rla h GLU 214 N 0.47 0.43 -0.23 1.92 5.08 -0.84 -1.71 114.58 119.69 1rla h GLU 214 Ca 0.13 -0.28 -0.14 0.00 -1.00 0.00 0.00 59.36 58.07 1rla h GLU 214 Cb 0.09 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1rla h GLU 214 CO -0.02 0.89 -0.43 1.79 -1.00 0.00 0.00 179.01 180.25 1rla h THR 215 N 0.32 1.30 -0.20 1.13 1.35 -1.12 -1.78 112.91 113.92 1rla h THR 215 Ca -0.00 -1.60 -0.05 0.00 -0.55 0.00 0.00 66.41 64.21 1rla h THR 215 Cb 1.11 1.59 -0.01 0.00 -1.73 0.00 0.00 68.15 69.12 1rla h THR 215 CO 0.10 0.50 -0.07 -0.26 -0.25 0.00 0.00 175.52 175.54 1rla h PHE 216 N 0.45 0.45 0.00 4.73 0.04 -1.19 -0.82 116.94 120.60 1rla h PHE 216 Ca 0.03 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.68 1rla h PHE 216 Cb 0.93 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.97 1rla h PHE 216 CO 0.04 0.67 -0.09 0.66 -0.60 0.00 0.00 178.31 178.99 1rla h SER 217 N 0.10 0.00 0.04 2.17 4.64 -1.27 0.24 113.55 119.48 1rla h SER 217 Ca 0.05 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.30 1rla h SER 217 Cb 0.54 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1rla h SER 217 CO 0.02 0.09 -0.28 0.22 -0.87 0.00 0.00 176.83 176.02 1rla h TYR 218 N 0.00 0.20 0.11 4.77 3.20 -1.04 -2.83 116.97 121.38 1rla h TYR 218 Ca -0.00 -0.14 -0.30 0.00 3.14 0.00 0.00 58.73 61.43 1rla h TYR 218 Cb 0.39 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 1rla h TYR 218 CO 0.00 1.07 -1.52 -0.07 -1.64 0.00 0.00 178.16 176.00 1rla h LEU 219 N -0.72 0.36 -2.26 2.82 3.38 -1.04 -3.39 115.31 114.46 1rla h LEU 219 Ca -0.05 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.42 1rla h LEU 219 Cb 1.17 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1rla h LEU 219 CO 0.05 1.42 0.00 0.18 0.09 0.00 0.00 178.44 180.18 1rla n LEU 220 N -3.43 2.64 -0.08 1.67 4.77 0.83 -4.70 117.00 118.70 1rla n LEU 220 Ca -0.16 -1.56 -0.07 0.00 -0.03 0.00 0.00 56.01 54.20 1rla n LEU 220 Cb 1.04 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 1rla n LEU 220 CO 0.50 0.60 0.86 1.23 -1.33 0.00 0.00 177.39 179.25 1rla h GLY 221 N 2.45 0.31 0.00 -0.72 0.00 -1.48 -3.32 103.07 100.31 1rla h GLY 221 Ca 0.00 0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.28 1rla h GLY 221 CO 0.00 -0.06 -0.52 3.21 0.00 0.00 0.00 176.54 179.17 1rla h ARG 222 N 0.10 0.00 -5.58 4.80 3.08 -1.84 -3.48 114.38 111.47 1rla h ARG 222 Ca 0.15 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.71 1rla h ARG 222 Cb 0.19 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 29.99 1rla h ARG 222 CO -0.23 0.60 -0.81 0.15 -1.07 0.00 0.00 179.97 178.61 1rla s LYS 223 N -2.15 1.08 -0.10 0.04 -0.14 -1.25 -5.11 119.74 112.11 1rla s LYS 223 Ca -0.18 -0.83 -0.23 0.00 -1.36 0.00 0.00 55.97 53.37 1rla s LYS 223 Cb 0.02 -1.13 -0.03 0.00 -1.68 0.00 0.00 37.83 35.01 1rla s LYS 223 CO 0.43 0.28 0.70 0.15 -0.76 0.00 0.00 175.35 176.15 1rla s LYS 224 N -1.18 4.38 0.15 1.68 3.01 -1.26 -4.36 119.74 122.16 1rla s LYS 224 Ca 0.03 0.84 -0.01 0.00 -1.01 0.00 0.00 55.97 55.83 1rla s LYS 224 Cb -0.08 -3.49 -0.04 0.00 -1.01 0.00 0.00 37.83 33.21 1rla s LYS 224 CO 0.02 -0.04 0.08 -0.98 0.51 0.00 0.00 175.35 174.94 1rla s ARG 225 N 1.16 1.02 0.48 1.68 1.70 -1.26 -5.13 118.95 118.60 1rla s ARG 225 Ca 0.36 -1.50 -0.23 0.00 -0.47 0.00 0.00 55.73 53.88 1rla s ARG 225 Cb -0.17 0.25 -0.07 0.00 -0.57 0.00 0.00 34.95 34.39 1rla s ARG 225 CO 0.16 -0.30 1.30 -2.14 -1.08 0.00 0.00 175.30 173.23 1rla s PRO 226 N -4.08 3.55 -0.11 3.89 0.02 -1.26 -4.87 135.00 132.14 1rla s PRO 226 Ca 0.29 2.10 -0.01 0.00 0.02 0.00 0.00 61.00 63.40 1rla s PRO 226 Cb 0.07 -2.45 -0.03 0.00 0.02 0.00 0.00 34.50 32.12 1rla s PRO 226 CO 0.05 -0.82 -0.07 0.42 -0.33 0.00 0.00 177.00 176.26 1rla s ILE 227 N -1.35 3.65 -0.22 2.83 1.01 -0.38 -1.53 121.20 125.20 1rla s ILE 227 Ca 0.65 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.79 1rla s ILE 227 Cb -0.37 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.56 1rla s ILE 227 CO 0.45 0.55 -0.05 -2.28 0.00 0.00 0.00 174.94 173.61 1rla s HIS 228 N -0.18 2.95 -0.29 3.97 5.65 -0.24 -0.50 115.29 126.66 1rla s HIS 228 Ca 0.02 -0.92 -0.06 0.00 0.25 0.00 0.00 55.06 54.35 1rla s HIS 228 Cb -0.13 -2.10 0.01 0.00 -1.18 0.00 0.00 32.58 29.19 1rla s HIS 228 CO 0.03 -0.53 0.06 -1.17 -0.65 0.00 0.00 174.74 172.48 1rla s LEU 229 N 1.43 3.77 -0.29 8.88 2.96 -0.26 -1.30 118.68 133.86 1rla s LEU 229 Ca 0.05 -0.73 -0.08 0.00 -0.22 0.00 0.00 54.13 53.15 1rla s LEU 229 Cb -0.14 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 1rla s LEU 229 CO -0.03 -0.18 0.11 -0.55 -1.32 0.00 0.00 176.35 174.38 1rla s SER 230 N 1.48 5.33 -0.33 3.68 0.15 -0.75 -0.52 113.70 122.74 1rla s SER 230 Ca 0.02 -0.50 -0.03 0.00 0.70 0.00 0.00 55.95 56.15 1rla s SER 230 Cb -0.17 -1.95 0.06 0.00 -1.71 0.00 0.00 66.02 62.25 1rla s SER 230 CO 0.02 -0.16 0.07 0.12 1.20 0.00 0.00 173.24 174.49 1rla s PHE 231 N 1.58 3.35 -0.27 3.44 2.19 0.25 -1.83 117.98 126.69 1rla s PHE 231 Ca 0.04 -1.95 -0.22 0.00 0.33 0.00 0.00 56.93 55.13 1rla s PHE 231 Cb -0.17 -2.43 -0.01 0.00 -1.31 0.00 0.00 43.02 39.11 1rla s PHE 231 CO 0.05 -0.84 0.71 0.34 1.83 0.00 0.00 175.22 177.31 1rla s ASP 232 N 1.41 6.64 0.63 6.13 -1.08 0.13 -1.29 116.67 129.24 1rla s ASP 232 Ca -0.01 0.73 0.31 0.00 -0.52 0.00 0.00 52.55 53.06 1rla s ASP 232 Cb -0.20 -2.37 1.70 0.00 -1.46 0.00 0.00 42.92 40.59 1rla s ASP 232 CO -0.01 -0.47 1.95 1.62 0.52 0.00 0.00 175.17 178.78 1rla h VAL 233 N 5.47 0.00 0.00 1.11 3.04 -1.61 0.15 116.25 124.42 1rla h VAL 233 Ca -0.25 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.44 1rla h VAL 233 Cb 1.11 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1rla h VAL 233 CO 0.82 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.48 1rla n ASP 234 N -2.84 0.00 0.19 3.17 5.68 -1.26 -2.53 116.55 118.95 1rla n ASP 234 Ca -0.02 -1.16 0.06 0.00 -0.50 0.00 0.00 54.79 53.17 1rla n ASP 234 Cb 0.31 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.62 1rla n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1rla h GLY 235 N 5.07 0.00 -2.58 6.12 0.00 -0.93 -3.34 103.07 107.40 1rla h GLY 235 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1rla h GLY 235 CO 0.00 0.00 0.04 1.08 0.00 0.00 0.00 176.54 177.66 1rla s LEU 236 N -7.02 3.86 0.58 3.11 1.43 -1.05 -2.34 118.68 117.24 1rla s LEU 236 Ca 0.00 0.97 -0.21 0.00 -1.03 0.00 0.00 54.13 53.86 1rla s LEU 236 Cb 0.11 -3.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 1rla s LEU 236 CO 0.68 -0.37 1.33 -0.67 0.23 0.00 0.00 176.35 177.55 1rla n ASP 237 N -1.38 2.45 0.19 2.29 2.03 0.10 -4.68 116.55 117.55 1rla n ASP 237 Ca 0.01 0.93 0.11 0.00 0.52 0.00 0.00 54.79 56.36 1rla n ASP 237 Cb 0.54 -1.57 0.58 0.00 -0.72 0.00 0.00 41.12 39.96 1rla n ASP 237 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1rla h PRO 238 N 1.13 0.00 0.00 -0.67 0.11 -1.82 -0.58 132.00 130.17 1rla h PRO 238 Ca -0.51 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.48 1rla h PRO 238 Cb 1.32 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.41 1rla h PRO 238 CO 0.56 0.00 -0.56 0.28 -0.21 0.00 0.00 178.00 178.07 1rla h VAL 239 N 0.00 1.32 0.03 3.15 2.07 -1.97 -2.24 116.25 118.61 1rla h VAL 239 Ca 0.00 -1.97 -0.38 0.00 0.82 0.00 0.00 66.70 65.16 1rla h VAL 239 Cb 0.27 2.09 -0.06 0.00 -1.52 0.00 0.00 31.29 32.08 1rla h VAL 239 CO 0.00 0.55 -2.36 0.49 0.02 0.00 0.00 177.57 176.27 1rla n PHE 240 N -3.75 0.29 -3.22 1.57 3.72 -0.26 -4.67 117.46 111.14 1rla n PHE 240 Ca -0.01 0.06 -0.26 0.00 -0.05 0.00 0.00 57.45 57.20 1rla n PHE 240 Cb 0.59 -1.04 -0.06 0.00 -0.94 0.00 0.00 39.48 38.03 1rla n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1rla n THR 241 N -3.30 1.81 0.20 4.37 -2.24 -1.00 -3.69 114.28 110.43 1rla n THR 241 Ca -0.42 -5.06 0.04 0.00 -2.27 0.00 0.00 64.05 56.33 1rla n THR 241 Cb 1.01 -1.69 0.41 0.00 -2.10 0.00 0.00 70.33 67.96 1rla n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1rla h PRO 242 N 3.69 0.00 -3.77 -0.78 0.13 -1.64 -3.38 132.00 126.25 1rla h PRO 242 Ca 0.15 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.56 1rla h PRO 242 Cb 0.68 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.76 1rla h PRO 242 CO 0.74 0.31 3.01 0.00 -0.23 0.00 0.00 178.00 181.83 1rla n ALA 243 N -2.46 5.77 -2.17 -0.56 0.00 -1.26 -4.83 120.51 115.00 1rla n ALA 243 Ca -0.02 -3.92 -0.11 0.00 0.00 0.00 0.00 53.44 49.39 1rla n ALA 243 Cb 0.36 -3.41 -0.10 0.00 0.00 0.00 0.00 19.45 16.30 1rla n ALA 243 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1rla s THR 244 N 2.49 0.36 0.13 0.00 -4.23 -1.26 -1.30 115.64 111.83 1rla s THR 244 Ca 0.48 -1.92 -0.03 0.00 -1.18 0.00 0.00 61.69 59.05 1rla s THR 244 Cb 0.14 -1.95 -0.19 0.00 1.34 0.00 0.00 72.50 71.84 1rla s THR 244 CO -0.07 -0.60 1.29 1.23 -0.54 0.00 0.00 174.62 175.94 1rla h GLY 245 N 2.87 0.37 -6.32 3.99 0.00 -1.89 -3.39 103.07 98.70 1rla h GLY 245 Ca -0.35 -0.70 -0.59 0.00 0.00 0.00 0.00 47.33 45.69 1rla h GLY 245 CO 0.62 0.62 -0.80 2.41 0.00 0.00 0.00 176.54 179.39 1rla n THR 246 N -3.69 0.83 -2.55 4.70 -1.04 -1.26 -5.10 114.28 106.17 1rla n THR 246 Ca -0.06 -4.55 -0.40 0.00 -2.04 0.00 0.00 64.05 57.00 1rla n THR 246 Cb 0.86 -2.01 -0.05 0.00 -1.82 0.00 0.00 70.33 67.31 1rla n THR 246 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1rla s PRO 247 N -1.56 4.70 -0.08 -2.82 0.04 -1.26 -4.92 135.00 129.09 1rla s PRO 247 Ca 0.35 1.72 0.01 0.00 0.04 0.00 0.00 61.00 63.11 1rla s PRO 247 Cb 0.11 -3.22 0.02 0.00 0.04 0.00 0.00 34.50 31.45 1rla s PRO 247 CO -0.10 0.29 -0.07 0.08 0.04 0.00 0.00 177.00 177.24 1rla s VAL 248 N -1.12 0.87 0.69 -0.36 1.01 -1.26 -5.05 120.40 115.18 1rla s VAL 248 Ca 0.44 -0.26 -0.15 0.00 0.00 0.00 0.00 61.98 62.00 1rla s VAL 248 Cb -0.30 -0.88 0.02 0.00 0.00 0.00 0.00 36.38 35.22 1rla s VAL 248 CO 0.38 0.32 1.17 0.68 0.00 0.00 0.00 175.10 177.65 1rla s VAL 249 N 1.25 2.69 0.00 2.92 -7.23 -1.26 -4.15 120.40 114.62 1rla s VAL 249 Ca -0.04 0.35 0.00 0.00 -1.81 0.00 0.00 61.98 60.47 1rla s VAL 249 Cb -0.14 -2.91 0.00 0.00 0.56 0.00 0.00 36.38 33.89 1rla s VAL 249 CO -0.02 -0.18 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 1rla n GLY 250 N 0.08 0.93 0.00 2.32 0.00 -1.26 -5.04 105.19 102.22 1rla n GLY 250 Ca 0.12 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1rla n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rla n GLY 251 N -0.49 1.73 3.76 -0.02 0.00 -1.26 -4.97 105.19 103.95 1rla n GLY 251 Ca 0.00 -2.09 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 1rla n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rla s LEU 252 N 0.00 3.98 0.66 0.99 1.43 -0.99 -4.32 118.68 120.43 1rla s LEU 252 Ca 0.00 2.69 -0.06 0.00 -1.03 0.00 0.00 54.13 55.73 1rla s LEU 252 Cb 0.00 -4.16 0.04 0.00 0.03 0.00 0.00 46.19 42.10 1rla s LEU 252 CO 0.00 -1.28 0.97 -0.94 0.23 0.00 0.00 176.35 175.32 1rla s SER 253 N -0.92 5.11 0.22 2.29 1.04 -1.26 -0.72 113.70 119.46 1rla s SER 253 Ca 0.66 0.53 -0.08 0.00 0.48 0.00 0.00 55.95 57.55 1rla s SER 253 Cb -0.38 -1.31 0.27 0.00 0.10 0.00 0.00 66.02 64.70 1rla s SER 253 CO 0.47 -1.39 1.83 0.22 0.98 0.00 0.00 173.24 175.35 1rla h TYR 254 N -0.42 0.81 -0.37 5.02 5.03 -1.95 -0.07 116.97 125.00 1rla h TYR 254 Ca -0.45 0.03 0.01 0.00 2.58 0.00 0.00 58.73 60.89 1rla h TYR 254 Cb 1.29 -0.25 -0.02 0.00 1.55 0.00 0.00 36.73 39.30 1rla h TYR 254 CO 0.39 0.40 0.24 0.00 -1.32 0.00 0.00 178.16 177.87 1rla h ARG 255 N 0.80 0.48 -0.48 1.82 3.08 -1.99 -0.99 114.38 117.10 1rla h ARG 255 Ca 0.33 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.25 1rla h ARG 255 Cb 0.17 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1rla h ARG 255 CO -0.17 0.32 -0.09 0.93 -1.07 0.00 0.00 179.97 179.88 1rla h GLU 256 N 0.50 0.87 0.12 0.04 5.08 -1.77 0.23 114.58 119.65 1rla h GLU 256 Ca 0.14 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1rla h GLU 256 Cb -0.05 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1rla h GLU 256 CO -0.03 0.92 -0.06 0.78 -1.00 0.00 0.00 179.01 179.62 1rla h GLY 257 N 0.97 -0.17 1.74 -3.84 0.00 -0.71 -0.62 103.07 100.44 1rla h GLY 257 Ca 0.13 0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.50 1rla h GLY 257 CO 0.04 -0.06 0.02 1.41 0.00 0.00 0.00 176.54 177.95 1rla h LEU 258 N -0.16 0.30 -0.67 3.11 3.38 -0.95 -1.77 115.31 118.55 1rla h LEU 258 Ca -0.02 -0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1rla h LEU 258 Cb 0.12 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1rla h LEU 258 CO 0.03 0.34 0.12 0.22 0.09 0.00 0.00 178.44 179.24 1rla h TYR 259 N 0.33 1.17 0.31 1.13 3.20 -0.39 -1.65 116.97 121.07 1rla h TYR 259 Ca 0.08 -0.16 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 1rla h TYR 259 Cb 0.19 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.14 1rla h TYR 259 CO 0.00 0.97 -0.15 0.82 -1.64 0.00 0.00 178.16 178.17 1rla h ILE 260 N 1.03 0.70 -0.28 1.81 2.04 -0.29 -2.23 117.51 120.29 1rla h ILE 260 Ca 0.21 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.94 1rla h ILE 260 Cb 0.42 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 1rla h ILE 260 CO 0.01 0.02 0.02 0.71 0.00 0.00 0.00 178.15 178.91 1rla h THR 261 N -0.47 1.16 -0.25 -0.27 1.35 -1.34 -1.84 112.91 111.25 1rla h THR 261 Ca -0.04 -0.61 -0.13 0.00 -0.55 0.00 0.00 66.41 65.08 1rla h THR 261 Cb 0.36 0.93 -0.01 0.00 -1.73 0.00 0.00 68.15 67.69 1rla h THR 261 CO 0.07 0.21 -0.38 -0.33 -0.25 0.00 0.00 175.52 174.84 1rla h GLU 262 N 0.41 0.57 -0.21 4.72 5.08 -1.23 -0.83 114.58 123.08 1rla h GLU 262 Ca 0.09 -0.28 -0.20 0.00 -1.00 0.00 0.00 59.36 57.98 1rla h GLU 262 Cb 0.24 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1rla h GLU 262 CO 0.00 0.86 -0.64 0.93 -1.00 0.00 0.00 179.01 179.16 1rla h GLU 263 N 0.48 0.77 -0.45 2.33 4.39 -0.97 -2.56 114.58 118.57 1rla h GLU 263 Ca 0.05 -0.54 -0.03 0.00 0.34 0.00 0.00 59.36 59.17 1rla h GLU 263 Cb 0.87 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.59 1rla h GLU 263 CO 0.07 1.17 0.16 0.82 -1.16 0.00 0.00 179.01 180.07 1rla h ILE 264 N 0.57 1.21 -0.63 3.13 2.04 -1.24 -2.64 117.51 119.95 1rla h ILE 264 Ca -0.01 -0.69 0.06 0.00 1.00 0.00 0.00 64.86 65.21 1rla h ILE 264 Cb 1.25 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 38.10 1rla h ILE 264 CO 0.13 0.25 0.34 0.22 0.00 0.00 0.00 178.15 179.10 1rla h TYR 265 N 0.58 0.63 0.00 1.37 3.20 -1.13 -2.34 116.97 119.29 1rla h TYR 265 Ca 0.15 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 1rla h TYR 265 Cb 0.24 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 1rla h TYR 265 CO 0.01 0.30 -0.03 0.87 -1.64 0.00 0.00 178.16 177.67 1rla h LYS 266 N 0.64 0.00 0.00 1.82 1.57 -1.11 -2.12 116.57 117.37 1rla h LYS 266 Ca 0.28 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 1rla h LYS 266 Cb 0.17 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 1rla h LYS 266 CO -0.18 0.03 -0.10 1.79 -0.57 0.00 0.00 179.45 180.42 1rla h THR 267 N 0.00 0.45 -0.00 -0.16 1.35 -1.14 -3.46 112.91 109.95 1rla h THR 267 Ca -0.00 -0.52 -0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1rla h THR 267 Cb 0.08 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1rla h THR 267 CO 0.00 0.10 -0.00 0.61 -0.25 0.00 0.00 175.52 175.98 1rla n GLY 268 N -0.58 0.27 0.56 5.82 0.00 -0.80 -4.88 105.19 105.57 1rla n GLY 268 Ca -0.01 -0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.06 1rla n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rla n LEU 269 N -0.00 2.54 -4.71 0.99 4.77 -1.26 -5.00 117.00 114.33 1rla n LEU 269 Ca -0.00 -1.64 -0.42 0.00 -0.03 0.00 0.00 56.01 53.92 1rla n LEU 269 Cb 0.23 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1rla n LEU 269 CO 0.00 0.59 1.33 -0.22 -1.33 0.00 0.00 177.39 177.77 1rla s LEU 270 N -0.97 4.37 0.00 2.23 2.96 -1.26 -1.25 118.68 124.76 1rla s LEU 270 Ca 0.19 2.72 0.00 0.00 -0.22 0.00 0.00 54.13 56.82 1rla s LEU 270 Cb 0.11 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.21 1rla s LEU 270 CO 0.15 -0.92 0.00 -0.24 -1.32 0.00 0.00 176.35 174.02 1rla n SER 271 N 4.44 4.08 -3.84 3.68 2.88 0.35 -4.84 113.62 120.37 1rla n SER 271 Ca 0.15 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.58 1rla n SER 271 Cb 0.37 0.35 -0.09 0.00 -0.75 0.00 0.00 64.21 64.09 1rla n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1rla s GLY 272 N -2.91 -0.00 -0.08 0.46 0.00 -1.02 -3.10 107.32 100.68 1rla s GLY 272 Ca 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 44.72 44.63 1rla s GLY 272 CO 0.00 -0.18 0.20 -2.27 0.00 0.00 0.00 173.10 170.84 1rla s LEU 273 N -1.39 1.14 -0.07 0.66 0.20 -0.10 -1.10 118.68 118.01 1rla s LEU 273 Ca -0.14 0.40 0.04 0.00 0.69 0.00 0.00 54.13 55.12 1rla s LEU 273 Cb -0.07 0.66 -0.00 0.00 -0.43 0.00 0.00 46.19 46.35 1rla s LEU 273 CO 0.02 -0.08 -0.20 -1.81 -0.29 0.00 0.00 176.35 173.99 1rla s ASP 274 N 0.28 2.59 -0.43 3.68 1.01 0.32 -1.14 116.67 122.99 1rla s ASP 274 Ca -0.01 -0.44 0.01 0.00 0.71 0.00 0.00 52.55 52.81 1rla s ASP 274 Cb -0.03 -0.93 0.12 0.00 1.01 0.00 0.00 42.92 43.09 1rla s ASP 274 CO -0.01 0.16 0.18 -0.63 0.21 0.00 0.00 175.17 175.08 1rla s ILE 275 N 0.17 2.80 0.26 0.77 -1.09 -0.47 -0.58 121.20 123.06 1rla s ILE 275 Ca -0.10 -2.54 0.09 0.00 -2.23 0.00 0.00 60.65 55.87 1rla s ILE 275 Cb -0.15 -2.96 -0.04 0.00 -1.58 0.00 0.00 42.46 37.73 1rla s ILE 275 CO 0.05 -0.70 0.05 -0.04 -1.23 0.00 0.00 174.94 173.06 1rla s MET 276 N 0.60 2.46 -1.20 2.79 -1.94 -0.41 -0.96 119.30 120.64 1rla s MET 276 Ca 0.12 -1.32 0.00 0.00 -1.71 0.00 0.00 55.69 52.78 1rla s MET 276 Cb -0.22 -2.27 0.00 0.00 2.01 0.00 0.00 34.83 34.36 1rla s MET 276 CO -0.05 0.37 0.00 0.39 -0.01 0.00 0.00 175.02 175.73 1rla n GLU 277 N -0.97 -0.79 -2.65 2.03 -0.58 -0.54 -1.73 120.64 115.41 1rla n GLU 277 Ca -0.07 0.89 -0.43 0.00 -0.42 0.00 0.00 57.16 57.13 1rla n GLU 277 Cb 0.59 -4.88 -0.02 0.00 -0.57 0.00 0.00 31.44 26.56 1rla n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1rla s VAL 278 N -2.43 4.35 -0.39 2.62 1.01 -1.26 -4.30 120.40 120.00 1rla s VAL 278 Ca 0.00 1.32 0.01 0.00 0.00 0.00 0.00 61.98 63.32 1rla s VAL 278 Cb 0.00 -4.51 0.11 0.00 0.00 0.00 0.00 36.38 31.97 1rla s VAL 278 CO 0.00 -0.81 0.13 0.21 0.00 0.00 0.00 175.10 174.64 1rla s ASN 279 N 2.17 4.93 0.65 3.32 3.84 -0.42 -3.98 114.94 125.44 1rla s ASN 279 Ca 0.45 -2.20 0.38 0.00 0.21 0.00 0.00 52.86 51.70 1rla s ASN 279 Cb -0.09 -1.71 2.12 0.00 -0.55 0.00 0.00 41.25 41.02 1rla s ASN 279 CO 0.26 -0.43 2.25 -0.65 -2.79 0.00 0.00 177.10 175.74 1rla h PRO 280 N 7.67 0.00 -0.01 0.43 0.11 -1.80 -2.29 132.00 136.12 1rla h PRO 280 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1rla h PRO 280 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1rla h PRO 280 CO 0.60 0.00 -0.11 0.25 -0.21 0.00 0.00 178.00 178.54 1rla n THR 281 N -3.28 0.00 0.35 -1.15 -2.24 -1.26 -3.78 114.28 102.92 1rla n THR 281 Ca -0.02 -0.13 0.12 0.00 -2.27 0.00 0.00 64.05 61.74 1rla n THR 281 Cb 0.15 0.19 0.23 0.00 -2.10 0.00 0.00 70.33 68.81 1rla n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1rla n LEU 282 N -0.51 3.38 -4.70 3.22 4.77 -0.86 -4.91 117.00 117.38 1rla n LEU 282 Ca 0.16 -1.46 -0.42 0.00 -0.03 0.00 0.00 56.01 54.26 1rla n LEU 282 Cb 0.31 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 1rla n LEU 282 CO 0.21 0.73 0.72 -0.83 -1.33 0.00 0.00 177.39 176.89 1rla s GLY 283 N -1.47 2.69 0.34 -0.72 0.00 -1.25 -4.66 107.32 102.25 1rla s GLY 283 Ca 0.39 0.47 0.10 0.00 0.00 0.00 0.00 44.72 45.68 1rla s GLY 283 CO 0.31 1.77 1.78 0.50 0.00 0.00 0.00 173.10 177.47 1rla h LYS 284 N 6.91 0.14 -4.71 2.90 1.57 -1.94 -3.45 116.57 118.00 1rla h LYS 284 Ca -0.37 -0.05 -0.26 0.00 -1.87 0.00 0.00 60.65 58.09 1rla h LYS 284 Cb 1.19 -0.01 -0.17 0.00 0.08 0.00 0.00 32.23 33.32 1rla h LYS 284 CO 0.79 0.48 -0.72 0.95 -0.57 0.00 0.00 179.45 180.39 1rla s THR 285 N -4.23 0.72 0.40 -0.16 -4.23 -1.26 -5.02 115.64 101.85 1rla s THR 285 Ca -0.04 -1.63 0.14 0.00 -1.18 0.00 0.00 61.69 58.98 1rla s THR 285 Cb 0.14 -1.31 0.35 0.00 1.34 0.00 0.00 72.50 73.02 1rla s THR 285 CO 0.75 -0.66 1.88 -0.65 -0.54 0.00 0.00 174.62 175.39 1rla h PRO 286 N 3.52 0.49 -0.14 3.99 0.11 -1.99 0.24 132.00 138.21 1rla h PRO 286 Ca -0.36 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.67 1rla h PRO 286 Cb 1.18 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1rla h PRO 286 CO 0.55 0.32 -0.13 1.49 -0.21 0.00 0.00 178.00 180.02 1rla h GLU 287 N 0.50 0.23 -0.21 1.05 4.57 -1.98 -0.11 114.58 118.63 1rla h GLU 287 Ca 0.44 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.46 1rla h GLU 287 Cb 0.94 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.48 1rla h GLU 287 CO -0.17 0.37 -0.32 0.93 -1.18 0.00 0.00 179.01 178.64 1rla h GLU 288 N 0.22 0.44 0.00 1.92 5.08 -0.91 0.11 114.58 121.44 1rla h GLU 288 Ca 0.04 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1rla h GLU 288 Cb 0.37 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1rla h GLU 288 CO 0.02 0.71 -0.00 0.28 -1.00 0.00 0.00 179.01 179.02 1rla h VAL 289 N 0.38 1.40 -0.88 3.13 2.07 -1.18 -1.93 116.25 119.24 1rla h VAL 289 Ca 0.05 -1.20 0.06 0.00 0.82 0.00 0.00 66.70 66.43 1rla h VAL 289 Cb 0.75 2.21 -0.06 0.00 -1.52 0.00 0.00 31.29 32.67 1rla h VAL 289 CO 0.06 0.31 0.55 0.74 0.02 0.00 0.00 177.57 179.25 1rla h THR 290 N -0.52 1.06 -0.06 2.57 2.02 -0.93 -0.41 112.91 116.63 1rla h THR 290 Ca -0.00 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.83 1rla h THR 290 Cb 0.51 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 1rla h THR 290 CO 0.00 0.18 0.04 -0.09 0.37 0.00 0.00 175.52 176.03 1rla h ARG 291 N 1.01 0.08 -0.05 6.66 2.43 -0.69 -0.80 114.38 123.02 1rla h ARG 291 Ca 0.38 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1rla h ARG 291 Cb 0.16 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1rla h ARG 291 CO -0.17 0.07 0.03 1.15 -1.51 0.00 0.00 179.97 179.54 1rla h THR 292 N 0.08 1.03 0.09 0.20 2.02 -0.71 -2.37 112.91 113.24 1rla h THR 292 Ca 0.02 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 1rla h THR 292 Cb 0.00 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.40 1rla h THR 292 CO -0.00 0.03 -0.05 0.58 0.37 0.00 0.00 175.52 176.44 1rla h VAL 293 N 0.05 0.90 -0.96 3.16 2.07 -0.97 -2.29 116.25 118.20 1rla h VAL 293 Ca 0.02 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.69 1rla h VAL 293 Cb 0.01 0.90 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 1rla h VAL 293 CO -0.00 0.00 0.61 0.78 0.02 0.00 0.00 177.57 178.97 1rla h ASN 294 N -0.13 0.79 0.65 0.57 2.35 -1.08 0.19 115.58 118.92 1rla h ASN 294 Ca -0.01 0.06 -0.19 0.00 -0.55 0.00 0.00 56.30 55.61 1rla h ASN 294 Cb 0.10 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1rla h ASN 294 CO 0.02 0.38 -0.85 0.00 -1.65 0.00 0.00 177.43 175.33 1rla h THR 295 N 0.82 1.52 -0.19 2.81 1.03 -1.26 -1.56 112.91 116.07 1rla h THR 295 Ca 0.50 -2.64 -0.01 0.00 -0.01 0.00 0.00 66.41 64.24 1rla h THR 295 Cb 0.68 2.46 -0.01 0.00 -1.07 0.00 0.00 68.15 70.21 1rla h THR 295 CO -0.27 0.77 0.07 0.00 -0.01 0.00 0.00 175.52 176.08 1rla h ALA 296 N 1.05 0.25 -0.31 0.00 0.00 -0.59 -1.21 119.26 118.45 1rla h ALA 296 Ca -0.03 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1rla h ALA 296 Cb 1.47 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 1rla h ALA 296 CO 0.12 -0.13 0.11 0.28 0.00 0.00 0.00 179.25 179.63 1rla h VAL 297 N 0.15 0.91 -0.90 0.00 2.07 -0.98 -2.12 116.25 115.37 1rla h VAL 297 Ca 0.06 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.56 1rla h VAL 297 Cb 0.21 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.56 1rla h VAL 297 CO -0.00 0.04 0.56 0.00 0.02 0.00 0.00 177.57 178.19 1rla h ALA 298 N 1.20 1.24 -0.57 1.67 0.00 -0.95 -0.15 119.26 121.70 1rla h ALA 298 Ca 0.14 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 1rla h ALA 298 Cb 0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1rla h ALA 298 CO -0.15 0.32 -0.05 -0.07 0.00 0.00 0.00 179.25 179.30 1rla h LEU 299 N 1.02 1.01 0.17 0.00 3.38 -0.90 -0.86 115.31 119.14 1rla h LEU 299 Ca 0.39 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1rla h LEU 299 Cb 0.18 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1rla h LEU 299 CO -0.18 1.09 -0.08 0.74 0.09 0.00 0.00 178.44 180.10 1rla h THR 300 N 0.93 0.92 -0.98 0.22 2.02 -0.63 -1.86 112.91 113.52 1rla h THR 300 Ca 0.16 -0.47 0.09 0.00 0.77 0.00 0.00 66.41 66.96 1rla h THR 300 Cb 0.60 1.20 -0.07 0.00 -1.74 0.00 0.00 68.15 68.14 1rla h THR 300 CO 0.04 0.11 0.63 -0.07 0.37 0.00 0.00 175.52 176.60 1rla h LEU 301 N -0.46 0.96 -1.16 2.58 3.38 -1.00 -0.39 115.31 119.21 1rla h LEU 301 Ca -0.02 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1rla h LEU 301 Cb 0.36 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1rla h LEU 301 CO 0.04 0.57 0.20 -1.28 0.09 0.00 0.00 178.44 178.06 1rla h SER 302 N 1.06 0.72 0.12 -0.43 0.87 -0.89 -1.68 113.55 113.32 1rla h SER 302 Ca 0.45 -0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.89 1rla h SER 302 Cb 0.32 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1rla h SER 302 CO -0.20 0.66 -0.10 0.00 -0.53 0.00 0.00 176.83 176.65 1rla n PHE 304 N -4.33 2.75 0.00 0.00 3.72 -0.67 -4.29 117.46 114.64 1rla n PHE 304 Ca -0.03 -1.80 0.00 0.00 -0.05 0.00 0.00 57.45 55.57 1rla n PHE 304 Cb 0.18 -0.87 0.00 0.00 -0.94 0.00 0.00 39.48 37.85 1rla n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rla n GLY 305 N -1.13 2.97 3.63 1.37 0.00 -1.05 -4.72 105.19 106.27 1rla n GLY 305 Ca 0.55 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.15 1rla n GLY 305 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rla s THR 306 N -2.67 3.26 -0.01 2.61 2.01 -0.96 -4.97 115.64 114.91 1rla s THR 306 Ca 0.00 0.29 -0.02 0.00 0.31 0.00 0.00 61.69 62.27 1rla s THR 306 Cb 0.00 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 1rla s THR 306 CO 0.00 -0.11 0.16 -0.54 -0.69 0.00 0.00 174.62 173.44 1rla s LYS 307 N 5.18 3.34 0.34 4.92 1.02 -1.26 -4.35 119.74 128.93 1rla s LYS 307 Ca 0.86 -0.36 0.08 0.00 0.02 0.00 0.00 55.97 56.57 1rla s LYS 307 Cb -0.33 -3.04 0.61 0.00 -0.52 0.00 0.00 37.83 34.55 1rla s LYS 307 CO 0.35 0.67 1.80 0.00 -0.92 0.00 0.00 175.35 177.24 1rla h ARG 308 N 3.88 0.21 0.00 1.68 3.08 -1.98 -1.91 114.38 119.34 1rla h ARG 308 Ca -0.49 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.49 1rla h ARG 308 Cb 1.19 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.22 1rla h ARG 308 CO 0.67 0.50 0.00 -0.85 -1.07 0.00 0.00 179.97 179.22 1rla n GLU 309 N -4.12 0.32 0.00 0.04 0.28 -1.26 -4.98 120.64 110.92 1rla n GLU 309 Ca -0.01 0.09 0.00 0.00 -0.16 0.00 0.00 57.16 57.08 1rla n GLU 309 Cb 0.39 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.76 1rla n GLU 309 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1rla n GLY 310 N 0.20 1.61 3.10 -1.84 0.00 -0.72 -5.09 105.19 102.45 1rla n GLY 310 Ca 0.10 -1.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.02 1rla n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rla s ASN 311 N 0.00 0.04 -0.01 1.61 0.01 -1.26 -4.56 114.94 110.76 1rla s ASN 311 Ca 0.00 -0.23 -0.04 0.00 -0.71 0.00 0.00 52.86 51.89 1rla s ASN 311 Cb 0.00 0.20 -0.00 0.00 0.41 0.00 0.00 41.25 41.86 1rla s ASN 311 CO 0.00 -0.37 0.08 -1.38 -1.51 0.00 0.00 177.10 173.91 1rla s HIS 312 N -1.42 0.03 0.19 2.20 -3.43 -1.26 -5.12 115.29 106.49 1rla s HIS 312 Ca -0.15 -0.06 -0.30 0.00 -0.80 0.00 0.00 55.06 53.75 1rla s HIS 312 Cb -0.08 -0.05 -0.08 0.00 -1.43 0.00 0.00 32.58 30.94 1rla s HIS 312 CO 0.01 -0.16 1.25 0.21 -2.00 0.00 0.00 174.74 174.06 1rla s LYS 313 N -0.76 4.44 0.53 -0.38 2.20 -1.26 -5.01 119.74 119.51 1rla s LYS 313 Ca -0.08 1.96 -0.21 0.00 -0.36 0.00 0.00 55.97 57.28 1rla s LYS 313 Cb -0.05 -3.22 -0.05 0.00 -1.51 0.00 0.00 37.83 33.00 1rla s LYS 313 CO 0.00 -0.16 1.22 -1.25 -0.36 0.00 0.00 175.35 174.80 1rla s PRO 314 N -0.23 3.31 0.00 4.03 0.04 -1.26 -3.18 135.00 137.71 1rla s PRO 314 Ca 0.54 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1rla s PRO 314 Cb -0.34 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.03 1rla s PRO 314 CO 0.38 -0.94 0.00 0.39 0.04 0.00 0.00 177.00 176.86 1rla n GLU 315 N -1.07 0.00 -3.34 4.56 1.02 -1.26 -4.98 120.64 115.58 1rla n GLU 315 Ca 0.11 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.81 1rla n GLU 315 Cb 0.48 -3.19 -0.08 0.00 -0.02 0.00 0.00 31.44 28.63 1rla n GLU 315 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1rla s THR 316 N -2.94 5.13 -0.59 2.62 2.01 -1.19 -5.02 115.64 115.65 1rla s THR 316 Ca 0.00 -0.63 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 1rla s THR 316 Cb 0.00 -4.09 0.04 0.00 0.01 0.00 0.00 72.50 68.46 1rla s THR 316 CO 0.00 -0.51 1.07 -0.62 -0.69 0.00 0.00 174.62 173.87 1rla s ASP 317 N 2.14 6.35 0.00 3.53 2.15 -1.26 -4.87 116.67 124.71 1rla s ASP 317 Ca 0.09 -0.22 0.24 0.00 0.43 0.00 0.00 52.55 53.08 1rla s ASP 317 Cb -0.20 -2.49 1.39 0.00 -0.30 0.00 0.00 42.92 41.32 1rla s ASP 317 CO 0.11 -1.40 1.77 -1.22 -0.17 0.00 0.00 175.17 174.26 1rla n TYR 318 N 8.04 0.00 0.37 -5.34 4.02 -1.26 -5.25 117.16 117.74 1rla n TYR 318 Ca 0.04 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.98 1rla n TYR 318 Cb 0.48 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.81 1rla n TYR 318 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13