#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 3.35 0.03 1.64 0.02 -1.26 -1.13 135.00 137.65 1rla s PRO 7 Ca 0.00 -0.28 0.09 0.00 0.02 0.00 0.00 61.00 60.83 1rla s PRO 7 Cb 0.00 -3.08 -0.03 0.00 0.02 0.00 0.00 34.50 31.42 1rla s PRO 7 CO 0.00 0.71 -0.25 0.42 -0.33 0.00 0.00 177.00 177.56 1rla s ILE 8 N -1.16 2.25 -0.10 2.83 -1.09 0.15 -0.32 121.20 123.77 1rla s ILE 8 Ca 0.21 -1.28 -0.02 0.00 -2.23 0.00 0.00 60.65 57.33 1rla s ILE 8 Cb -0.12 -1.87 0.03 0.00 -1.58 0.00 0.00 42.46 38.92 1rla s ILE 8 CO 0.11 0.41 0.00 -0.70 -1.23 0.00 0.00 174.94 173.54 1rla s GLU 9 N -1.13 0.66 -0.08 2.79 2.12 -0.33 -0.83 118.70 121.90 1rla s GLU 9 Ca 0.12 -0.01 -0.25 0.00 0.36 0.00 0.00 54.97 55.18 1rla s GLU 9 Cb -0.10 -1.23 -0.03 0.00 0.26 0.00 0.00 34.13 33.03 1rla s GLU 9 CO 0.02 -0.37 0.79 0.42 -0.54 0.00 0.00 175.26 175.58 1rla s ILE 10 N 1.94 4.97 -0.14 -3.70 1.09 -0.40 -1.57 121.20 123.39 1rla s ILE 10 Ca 0.04 1.62 -0.00 0.00 -1.10 0.00 0.00 60.65 61.21 1rla s ILE 10 Cb -0.13 -4.12 0.03 0.00 -1.06 0.00 0.00 42.46 37.17 1rla s ILE 10 CO -0.06 0.18 -0.10 -0.63 -0.10 0.00 0.00 174.94 174.23 1rla s ILE 11 N 1.18 1.29 -0.00 2.92 1.01 -0.06 -0.45 121.20 127.09 1rla s ILE 11 Ca 0.41 -0.52 -0.20 0.00 0.00 0.00 0.00 60.65 60.34 1rla s ILE 11 Cb -0.18 -1.30 -0.05 0.00 0.01 0.00 0.00 42.46 40.94 1rla s ILE 11 CO 0.19 0.35 0.57 -0.83 0.00 0.00 0.00 174.94 175.22 1rla s GLY 12 N 1.59 2.59 -0.61 6.18 0.00 -0.81 -1.72 107.32 114.54 1rla s GLY 12 Ca 0.04 -0.01 0.06 0.00 0.00 0.00 0.00 44.72 44.81 1rla s GLY 12 CO -0.09 0.67 0.63 0.00 0.00 0.00 0.00 173.10 174.31 1rla n ALA 13 N 2.59 3.63 -1.15 3.20 0.00 -0.46 -1.21 120.51 127.10 1rla n ALA 13 Ca -0.08 -4.44 -0.42 0.00 0.00 0.00 0.00 53.44 48.50 1rla n ALA 13 Cb 0.51 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.99 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 1.31 1.36 -5.03 0.00 -0.04 -1.26 -3.73 135.00 127.61 1rla n PRO 14 Ca 0.26 -1.81 -0.30 0.00 -0.04 0.00 0.00 63.50 61.62 1rla n PRO 14 Cb 0.42 -2.94 -0.15 0.00 -0.04 0.00 0.00 33.50 30.78 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 5.66 2.23 0.00 0.54 5.36 -1.26 -4.69 117.98 125.81 1rla s PHE 15 Ca 0.59 -0.41 0.00 0.00 -0.96 0.00 0.00 56.93 56.15 1rla s PHE 15 Cb 0.13 -1.38 0.00 0.00 -0.34 0.00 0.00 43.02 41.44 1rla s PHE 15 CO 0.14 0.05 0.07 -1.13 -1.46 0.00 0.00 175.22 172.89 1rla n SER 16 N 2.09 0.14 0.00 6.13 3.41 -1.26 -2.38 113.62 121.74 1rla n SER 16 Ca -0.16 -0.49 0.01 0.00 -0.26 0.00 0.00 58.87 57.97 1rla n SER 16 Cb 0.52 0.23 0.03 0.00 -0.26 0.00 0.00 64.21 64.73 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 -0.23 0.01 0.00 4.33 4.01 -1.26 -2.09 118.16 122.93 1rla n LYS 17 Ca 0.00 0.38 0.10 0.00 -0.51 0.00 0.00 58.31 58.29 1rla n LYS 17 Cb 0.06 -1.50 0.50 0.00 -0.51 0.00 0.00 35.03 33.57 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 -1.27 -1.10 3.53 0.72 0.00 -1.26 -4.76 105.19 101.04 1rla n GLY 18 Ca 0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.78 1.39 0.49 1.61 1.03 -0.89 -0.46 119.66 120.05 1rla s GLN 19 Ca 0.15 -0.82 0.31 0.00 0.04 0.00 0.00 55.36 55.04 1rla s GLN 19 Cb 0.14 0.54 1.18 0.00 0.03 0.00 0.00 33.01 34.89 1rla s GLN 19 CO 0.35 -0.60 1.90 -1.00 -2.54 0.00 0.00 175.29 173.40 1rla h PRO 20 N 2.16 0.00 -5.32 9.60 0.13 -1.89 -3.43 132.00 133.25 1rla h PRO 20 Ca -0.29 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.19 1rla h PRO 20 Cb 1.27 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.24 1rla h PRO 20 CO 0.36 0.00 0.32 1.03 -0.23 0.00 0.00 178.00 179.48 1rla s ARG 21 N -3.55 3.18 0.67 0.86 0.52 -1.26 -5.04 118.95 114.33 1rla s ARG 21 Ca 0.03 -0.72 -0.17 0.00 -0.52 0.00 0.00 55.73 54.34 1rla s ARG 21 Cb 0.09 -4.13 0.00 0.00 0.52 0.00 0.00 34.95 31.43 1rla s ARG 21 CO 0.54 -1.46 1.24 0.20 0.02 0.00 0.00 175.30 175.84 1rla s GLY 22 N 3.04 2.63 0.00 -3.53 0.00 -1.26 -4.21 107.32 103.99 1rla s GLY 22 Ca 0.21 1.04 0.00 0.00 0.00 0.00 0.00 44.72 45.97 1rla s GLY 22 CO 0.13 1.46 0.00 0.61 0.00 0.00 0.00 173.10 175.30 1rla n GLY 23 N 0.62 3.02 0.29 0.20 0.00 -1.26 -4.91 105.19 103.16 1rla n GLY 23 Ca 0.14 -0.60 0.20 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.79 -1.63 116.25 112.93 1rla h VAL 24 Ca 0.00 -0.10 -0.06 0.00 -1.23 0.00 0.00 66.70 65.31 1rla h VAL 24 Cb 0.00 1.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.16 1rla h VAL 24 CO 0.00 0.00 -0.27 1.05 -1.23 0.00 0.00 177.57 177.12 1rla h GLU 25 N 0.00 0.00 0.00 5.19 9.09 -1.84 0.13 114.58 127.15 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 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1rla h GLU 25 CO 0.00 0.27 0.00 1.63 0.05 0.00 0.00 179.01 180.96 1rla n LYS 26 N -4.11 0.42 0.07 1.06 5.02 -0.61 -4.07 118.16 115.94 1rla n LYS 26 Ca -0.02 0.04 -0.12 0.00 -2.02 0.00 0.00 58.31 56.19 1rla n LYS 26 Cb 0.33 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.79 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 4.19 -0.55 0.51 0.72 0.00 -1.37 -2.19 103.07 104.39 1rla h GLY 27 Ca 0.00 0.38 0.09 0.00 0.00 0.00 0.00 47.33 47.80 1rla h GLY 27 CO 0.00 -0.24 0.41 -2.55 0.00 0.00 0.00 176.54 174.16 1rla h PRO 28 N -0.49 0.67 -0.43 4.80 0.11 -1.69 -1.84 132.00 133.13 1rla h PRO 28 Ca 0.05 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1rla h PRO 28 Cb 0.56 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 1rla h PRO 28 CO -0.24 0.44 0.26 0.00 -0.21 0.00 0.00 178.00 178.25 1rla h ALA 29 N 1.43 0.54 -0.95 -0.75 0.00 -1.77 -1.03 119.26 116.74 1rla h ALA 29 Ca 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1rla h ALA 29 Cb 0.35 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 1rla h ALA 29 CO -0.25 0.03 0.57 0.00 0.00 0.00 0.00 179.25 179.60 1rla h ALA 30 N 1.12 1.21 -0.24 0.00 0.00 -0.81 0.15 119.26 120.69 1rla h ALA 30 Ca 0.15 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1rla h ALA 30 Cb -0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 1rla h ALA 30 CO -0.03 0.67 -0.46 -0.07 0.00 0.00 0.00 179.25 179.36 1rla h LEU 31 N 1.31 0.66 -0.23 0.00 3.38 -1.06 -2.08 115.31 117.29 1rla h LEU 31 Ca 0.34 -0.32 -0.21 0.00 0.09 0.00 0.00 57.88 57.78 1rla h LEU 31 Cb -0.05 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.52 1rla h LEU 31 CO -0.06 1.02 -0.74 0.03 0.09 0.00 0.00 178.44 178.77 1rla h ARG 32 N 0.49 0.73 -0.46 1.13 3.08 -0.88 -2.64 114.38 115.83 1rla h ARG 32 Ca 0.03 -0.58 0.04 0.00 0.07 0.00 0.00 59.98 59.54 1rla h ARG 32 Cb 0.98 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.12 1rla h ARG 32 CO 0.09 1.19 0.31 -0.22 -1.07 0.00 0.00 179.97 180.27 1rla h LYS 33 N 0.51 0.45 -0.02 0.04 1.63 -0.61 0.59 116.57 119.16 1rla h LYS 33 Ca -0.04 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1rla h LYS 33 Cb 1.36 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.89 1rla h LYS 33 CO 0.15 0.30 0.00 0.00 -3.45 0.00 0.00 179.45 176.45 1rla n ALA 34 N -2.50 2.60 -1.08 5.00 0.00 -0.79 -4.90 120.51 118.85 1rla n ALA 34 Ca 0.05 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1rla n ALA 34 Cb 0.18 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 0.84 0.52 0.15 0.00 0.00 0.20 -4.98 105.19 101.92 1rla n GLY 35 Ca 0.15 -0.87 -0.06 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.11 -0.28 0.99 5.85 -1.58 -0.81 115.31 119.36 1rla h LEU 36 Ca 0.00 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1rla h LEU 36 Cb 0.24 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1rla h LEU 36 CO 0.00 -0.02 0.07 0.58 -0.34 0.00 0.00 178.44 178.73 1rla h VAL 37 N 0.12 1.22 -0.41 1.05 2.07 -1.84 -1.96 116.25 116.49 1rla h VAL 37 Ca 0.17 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1rla h VAL 37 Cb 0.22 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1rla h VAL 37 CO -0.27 0.23 0.19 -0.33 0.02 0.00 0.00 177.57 177.41 1rla h GLU 38 N 0.29 0.59 0.00 1.57 3.07 -1.86 -2.31 114.58 115.93 1rla h GLU 38 Ca 0.09 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 58.81 1rla h GLU 38 Cb 0.29 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 1rla h GLU 38 CO 0.00 0.53 -0.21 0.87 -1.40 0.00 0.00 179.01 178.80 1rla h LYS 39 N 0.52 0.00 0.00 2.33 1.57 -1.13 -1.94 116.57 117.92 1rla h LYS 39 Ca 0.14 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.79 1rla h LYS 39 Cb 0.13 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1rla h LYS 39 CO -0.02 0.21 -0.63 -0.07 -0.57 0.00 0.00 179.45 178.37 1rla h LEU 40 N 0.00 0.00 -1.31 2.94 3.38 -0.88 -3.09 115.31 116.35 1rla h LEU 40 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1rla h LEU 40 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1rla h LEU 40 CO 0.03 0.63 -0.23 0.11 0.09 0.00 0.00 178.44 179.06 1rla h LYS 41 N 0.00 0.00 0.00 1.13 1.57 -0.82 -2.65 116.57 115.80 1rla h LYS 41 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1rla h LYS 41 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 1rla h LYS 41 CO 0.08 0.23 0.00 0.39 -0.57 0.00 0.00 179.45 179.58 1rla n GLU 42 N -3.51 0.08 -2.15 3.15 1.02 -1.17 -4.78 120.64 113.28 1rla n GLU 42 Ca -0.01 0.22 -0.28 0.00 -0.02 0.00 0.00 57.16 57.08 1rla n GLU 42 Cb 0.39 -1.62 0.15 0.00 -0.02 0.00 0.00 31.44 30.34 1rla n GLU 42 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1rla s THR 43 N -3.08 2.06 -1.89 2.62 -4.23 -1.00 -4.95 115.64 105.17 1rla s THR 43 Ca 0.09 -0.20 0.20 0.00 -1.18 0.00 0.00 61.69 60.60 1rla s THR 43 Cb 0.12 -2.86 0.53 0.00 1.34 0.00 0.00 72.50 71.63 1rla s THR 43 CO 0.41 0.00 1.59 -1.84 -0.54 0.00 0.00 174.62 174.24 1rla n GLU 44 N -3.41 0.56 -3.31 3.99 0.28 -1.26 -4.84 120.64 112.66 1rla n GLU 44 Ca 0.14 0.02 -0.29 0.00 -0.16 0.00 0.00 57.16 56.88 1rla n GLU 44 Cb 0.60 -1.50 -0.03 0.00 1.43 0.00 0.00 31.44 31.94 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 -2.11 3.48 -0.28 -1.84 2.02 -1.26 -4.51 117.35 112.84 1rla s TYR 45 Ca 0.28 0.66 -0.15 0.00 -0.37 0.00 0.00 57.07 57.49 1rla s TYR 45 Cb 0.14 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.54 1rla s TYR 45 CO 0.24 0.15 0.37 -0.80 -1.57 0.00 0.00 175.55 173.94 1rla s ASN 46 N -3.18 6.23 -0.12 2.29 0.01 -0.28 -4.78 114.94 115.11 1rla s ASN 46 Ca 0.44 0.19 -0.03 0.00 -0.71 0.00 0.00 52.86 52.76 1rla s ASN 46 Cb -0.11 -2.20 -0.03 0.00 0.41 0.00 0.00 41.25 39.32 1rla s ASN 46 CO 0.30 -0.21 -0.02 -0.69 -1.51 0.00 0.00 177.10 174.97 1rla s VAL 47 N 2.06 4.10 -0.08 1.60 1.01 -1.26 0.33 120.40 128.15 1rla s VAL 47 Ca 0.14 -0.31 -0.00 0.00 0.00 0.00 0.00 61.98 61.81 1rla s VAL 47 Cb -0.16 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.49 1rla s VAL 47 CO 0.10 0.55 -0.05 -0.60 0.00 0.00 0.00 175.10 175.11 1rla s ARG 48 N -0.32 1.10 -0.40 2.72 3.52 -0.01 -4.95 118.95 120.60 1rla s ARG 48 Ca 0.06 -0.11 -0.20 0.00 -0.13 0.00 0.00 55.73 55.35 1rla s ARG 48 Cb -0.12 -1.24 0.01 0.00 -1.56 0.00 0.00 34.95 32.04 1rla s ARG 48 CO 0.02 -0.24 0.60 0.34 -0.81 0.00 0.00 175.30 175.22 1rla s ASP 49 N 1.63 6.34 0.00 -2.12 -1.08 -1.26 -1.27 116.67 118.90 1rla s ASP 49 Ca 0.01 -0.19 0.27 0.00 -0.52 0.00 0.00 52.55 52.13 1rla s ASP 49 Cb -0.13 -2.31 1.35 0.00 -1.46 0.00 0.00 42.92 40.37 1rla s ASP 49 CO -0.05 -0.66 1.92 1.57 0.52 0.00 0.00 175.17 178.47 1rla n HIS 50 N 6.07 0.00 -1.20 -5.34 -0.00 0.40 -4.94 115.22 110.21 1rla n HIS 50 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.70 1rla n HIS 50 Cb 0.48 -0.32 0.00 0.00 -0.00 0.00 0.00 29.99 30.16 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 1.07 -2.40 3.86 1.57 0.00 -1.25 -4.90 105.19 103.13 1rla n GLY 51 Ca 0.12 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.52 6.69 0.31 1.61 1.01 -1.26 -1.92 116.67 120.59 1rla s ASP 52 Ca 0.00 0.83 -0.27 0.00 0.71 0.00 0.00 52.55 53.82 1rla s ASP 52 Cb 0.00 -2.20 -0.09 0.00 1.01 0.00 0.00 42.92 41.64 1rla s ASP 52 CO 0.00 0.26 1.02 -0.76 0.21 0.00 0.00 175.17 175.90 1rla s LEU 53 N -1.47 4.41 -0.32 1.23 1.43 -0.35 -4.92 118.68 118.68 1rla s LEU 53 Ca 0.27 2.04 -0.12 0.00 -1.03 0.00 0.00 54.13 55.30 1rla s LEU 53 Cb -0.15 -3.87 -0.02 0.00 0.03 0.00 0.00 46.19 42.18 1rla s LEU 53 CO 0.15 -0.16 0.21 0.00 0.23 0.00 0.00 176.35 176.78 1rla s ALA 54 N -1.41 3.45 -0.15 4.21 0.00 -1.26 -4.59 121.76 122.02 1rla s ALA 54 Ca 0.49 -1.32 -0.13 0.00 0.00 0.00 0.00 51.96 51.00 1rla s ALA 54 Cb -0.25 -2.56 -0.05 0.00 0.00 0.00 0.00 23.12 20.27 1rla s ALA 54 CO 0.31 -0.86 0.27 -0.06 0.00 0.00 0.00 175.76 175.43 1rla s PHE 55 N 1.70 3.48 -0.11 0.00 0.08 -1.26 -5.06 117.98 116.81 1rla s PHE 55 Ca 0.06 0.59 -0.30 0.00 0.12 0.00 0.00 56.93 57.41 1rla s PHE 55 Cb -0.17 -2.29 -0.02 0.00 -0.57 0.00 0.00 43.02 39.97 1rla s PHE 55 CO 0.10 0.30 1.09 0.14 -0.10 0.00 0.00 175.22 176.74 1rla s VAL 56 N 0.26 4.58 -0.05 -0.44 -7.23 -1.26 -5.01 120.40 111.25 1rla s VAL 56 Ca 0.16 1.87 -0.30 0.00 -1.81 0.00 0.00 61.98 61.91 1rla s VAL 56 Cb -0.13 -4.21 -0.02 0.00 0.56 0.00 0.00 36.38 32.58 1rla s VAL 56 CO 0.04 -0.03 1.04 -1.81 -0.31 0.00 0.00 175.10 174.03 1rla s ASP 57 N 1.28 7.25 -0.53 4.85 1.01 -1.26 -4.88 116.67 124.39 1rla s ASP 57 Ca 0.50 1.64 -0.26 0.00 0.71 0.00 0.00 52.55 55.15 1rla s ASP 57 Cb -0.20 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.20 1rla s ASP 57 CO 0.17 -0.41 1.03 -0.69 0.21 0.00 0.00 175.17 175.48 1rla s VAL 58 N 1.65 4.29 0.49 -1.27 1.01 -1.26 -5.02 120.40 120.28 1rla s VAL 58 Ca 0.51 0.67 -0.23 0.00 0.00 0.00 0.00 61.98 62.93 1rla s VAL 58 Cb -0.21 -4.57 -0.06 0.00 0.00 0.00 0.00 36.38 31.54 1rla s VAL 58 CO 0.22 -1.10 1.28 -2.16 0.00 0.00 0.00 175.10 173.35 1rla s PRO 59 N 4.23 3.51 -1.13 2.72 0.04 -1.26 -3.28 135.00 139.83 1rla s PRO 59 Ca 0.37 2.06 -0.07 0.00 0.04 0.00 0.00 61.00 63.41 1rla s PRO 59 Cb -0.10 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 32.05 1rla s PRO 59 CO 0.24 -0.84 0.99 0.09 0.04 0.00 0.00 177.00 177.52 1rla n ASN 60 N -0.63 -5.24 -4.53 6.66 3.02 -1.26 -4.89 115.26 108.38 1rla n ASN 60 Ca 0.08 -0.47 -0.43 0.00 -0.03 0.00 0.00 54.58 53.73 1rla n ASN 60 Cb 0.46 -4.36 0.00 0.00 -0.61 0.00 0.00 39.78 35.27 1rla n ASN 60 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1rla n ASP 61 N -2.40 4.94 -4.77 6.41 -0.08 -1.20 -4.97 116.55 114.48 1rla n ASP 61 Ca -0.03 -2.93 -0.40 0.00 -1.51 0.00 0.00 54.79 49.93 1rla n ASP 61 Cb 0.56 -1.72 -0.02 0.00 2.34 0.00 0.00 41.12 42.28 1rla n ASP 61 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1rla s SER 62 N 3.99 6.72 0.46 1.67 0.01 -1.26 -4.48 113.70 120.80 1rla s SER 62 Ca 0.52 2.54 -0.24 0.00 1.31 0.00 0.00 55.95 60.08 1rla s SER 62 Cb 0.03 -2.64 -0.07 0.00 0.21 0.00 0.00 66.02 63.55 1rla s SER 62 CO 0.06 -0.56 1.34 -2.16 0.41 0.00 0.00 173.24 172.34 1rla s PRO 63 N -1.93 3.65 -0.70 12.44 0.04 -1.26 -4.70 135.00 142.55 1rla s PRO 63 Ca 0.51 2.21 -0.17 0.00 0.04 0.00 0.00 61.00 63.60 1rla s PRO 63 Cb -0.36 -2.56 0.15 0.00 0.04 0.00 0.00 34.50 31.76 1rla s PRO 63 CO 0.47 -0.77 0.73 0.12 0.04 0.00 0.00 177.00 177.60 1rla s PHE 64 N -1.28 3.32 0.00 0.56 5.36 -0.16 -4.88 117.98 120.89 1rla s PHE 64 Ca 0.62 -1.43 0.00 0.00 -0.96 0.00 0.00 56.93 55.17 1rla s PHE 64 Cb -0.39 -3.94 0.00 0.00 -0.34 0.00 0.00 43.02 38.35 1rla s PHE 64 CO 0.49 -1.16 0.00 1.04 -1.46 0.00 0.00 175.22 174.13 1rla n GLN 65 N 5.36 0.00 -0.03 10.12 6.02 -1.26 -2.04 117.38 135.55 1rla n GLN 65 Ca 0.01 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.87 1rla n GLN 65 Cb 0.44 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.56 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 1.64 -1.58 5.09 5.41 -1.26 -4.93 119.36 123.74 1rla n ILE 66 Ca 0.00 -0.74 -0.53 0.00 1.00 0.00 0.00 62.75 62.48 1rla n ILE 66 Cb 0.00 -1.25 -0.07 0.00 -0.71 0.00 0.00 39.64 37.61 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 -3.18 0.29 -3.42 1.39 0.31 -0.86 -3.68 118.33 109.17 1rla n VAL 67 Ca -0.25 -0.14 -0.34 0.00 -0.01 0.00 0.00 64.34 63.59 1rla n VAL 67 Cb 1.06 -1.47 -0.06 0.00 -0.91 0.00 0.00 33.84 32.46 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 4.85 3.87 -1.63 5.55 1.02 -0.92 -0.99 119.74 131.49 1rla s LYS 68 Ca 1.03 0.34 -0.11 0.00 0.02 0.00 0.00 55.97 57.25 1rla s LYS 68 Cb -0.94 -2.84 0.10 0.00 -0.52 0.00 0.00 37.83 33.64 1rla s LYS 68 CO 0.57 0.43 0.53 0.09 -0.92 0.00 0.00 175.35 176.05 1rla n ASN 69 N 0.45 -1.59 -0.08 2.83 3.02 -1.26 -4.73 115.26 113.90 1rla n ASN 69 Ca -0.04 -1.09 -0.07 0.00 -0.03 0.00 0.00 54.58 53.35 1rla n ASN 69 Cb 0.52 -2.46 -0.00 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 -1.54 0.18 -0.42 3.52 0.13 -1.84 -1.68 132.00 130.35 1rla h PRO 70 Ca -0.61 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 64.42 1rla h PRO 70 Cb 1.39 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 1rla h PRO 70 CO 0.75 0.12 -0.06 0.00 -0.23 0.00 0.00 178.00 178.58 1rla h ARG 71 N 0.19 0.79 -0.61 0.86 3.08 -1.86 0.21 114.38 117.04 1rla h ARG 71 Ca 0.14 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1rla h ARG 71 Cb 0.13 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1rla h ARG 71 CO -0.17 0.89 0.37 0.77 -1.07 0.00 0.00 179.97 180.77 1rla h SER 72 N 0.61 0.73 -0.20 7.04 0.02 -1.84 0.92 113.55 120.83 1rla h SER 72 Ca 0.11 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.94 1rla h SER 72 Cb 0.57 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 1rla h SER 72 CO 0.03 0.57 -0.13 0.58 -1.14 0.00 0.00 176.83 176.74 1rla h VAL 73 N 0.82 1.31 -0.64 2.27 2.07 -1.17 -1.48 116.25 119.45 1rla h VAL 73 Ca 0.22 -1.23 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 1rla h VAL 73 Cb -0.03 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1rla h VAL 73 CO -0.04 0.37 0.20 1.23 0.02 0.00 0.00 177.57 179.35 1rla h GLY 74 N 0.14 1.04 0.79 2.17 0.00 -0.30 -2.06 103.07 104.85 1rla h GLY 74 Ca 0.04 -0.59 -0.12 0.00 0.00 0.00 0.00 47.33 46.66 1rla h GLY 74 CO 0.04 0.55 -0.40 1.70 0.00 0.00 0.00 176.54 178.43 1rla h LYS 75 N 0.94 0.44 -0.76 4.80 1.63 -0.83 -2.17 116.57 120.62 1rla h LYS 75 Ca 0.21 -0.35 0.04 0.00 -0.85 0.00 0.00 60.65 59.70 1rla h LYS 75 Cb 0.27 0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.93 1rla h LYS 75 CO -0.01 0.98 0.50 0.00 -3.45 0.00 0.00 179.45 177.47 1rla h ALA 76 N 0.47 1.55 -0.12 5.00 0.00 -1.16 -1.76 119.26 123.23 1rla h ALA 76 Ca -0.02 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1rla h ALA 76 Cb 1.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1rla h ALA 76 CO 0.08 0.37 -0.54 -0.91 0.00 0.00 0.00 179.25 178.26 1rla h ASN 77 N 0.93 0.39 -0.30 0.00 2.35 -1.37 -1.45 115.58 116.13 1rla h ASN 77 Ca 0.30 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.80 1rla h ASN 77 Cb 0.06 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 1rla h ASN 77 CO -0.09 0.85 -0.02 -0.08 -1.65 0.00 0.00 177.43 176.45 1rla h GLU 78 N 0.27 0.55 -0.34 0.81 4.81 -0.66 0.46 114.58 120.48 1rla h GLU 78 Ca 0.01 -0.18 -0.03 0.00 -0.13 0.00 0.00 59.36 59.03 1rla h GLU 78 Cb 1.03 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 1rla h GLU 78 CO 0.09 0.70 0.11 0.37 -0.73 0.00 0.00 179.01 179.55 1rla h GLN 79 N 0.33 0.52 -0.67 1.92 4.15 -1.34 -1.95 115.11 118.08 1rla h GLN 79 Ca 0.08 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 1rla h GLN 79 Cb 0.47 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.05 1rla h GLN 79 CO 0.02 0.54 0.40 1.25 -1.93 0.00 0.00 178.83 179.11 1rla h LEU 80 N 0.39 0.81 -1.32 -2.39 5.85 -1.14 -2.03 115.31 115.48 1rla h LEU 80 Ca 0.11 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1rla h LEU 80 Cb 0.24 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1rla h LEU 80 CO -0.00 0.64 0.43 0.00 -0.34 0.00 0.00 178.44 179.17 1rla h ALA 81 N 1.20 1.50 -0.21 1.25 0.00 -0.61 -0.99 119.26 121.41 1rla h ALA 81 Ca 0.24 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1rla h ALA 81 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1rla h ALA 81 CO -0.04 0.45 0.06 0.00 0.00 0.00 0.00 179.25 179.72 1rla h ALA 82 N 1.57 0.28 0.06 0.00 0.00 -0.82 -0.60 119.26 119.74 1rla h ALA 82 Ca 0.24 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1rla h ALA 82 Cb -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1rla h ALA 82 CO -0.05 -0.09 -0.03 0.28 0.00 0.00 0.00 179.25 179.36 1rla h VAL 83 N 0.16 1.01 -0.71 0.00 2.07 -0.91 -2.20 116.25 115.67 1rla h VAL 83 Ca 0.07 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1rla h VAL 83 Cb 0.25 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1rla h VAL 83 CO -0.00 0.06 0.40 0.58 0.02 0.00 0.00 177.57 178.63 1rla h VAL 84 N -0.18 1.21 -0.33 2.57 2.07 -1.17 -1.51 116.25 118.91 1rla h VAL 84 Ca -0.01 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1rla h VAL 84 Cb 0.15 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1rla h VAL 84 CO 0.01 0.23 0.15 0.00 0.02 0.00 0.00 177.57 177.99 1rla h ALA 85 N 1.21 1.65 0.24 1.67 0.00 -1.01 -0.38 119.26 122.63 1rla h ALA 85 Ca 0.25 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1rla h ALA 85 Cb 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1rla h ALA 85 CO -0.04 0.29 -0.12 1.49 0.00 0.00 0.00 179.25 180.87 1rla h GLU 86 N 0.46 -0.31 -0.66 0.00 4.57 -0.66 -1.90 114.58 116.08 1rla h GLU 86 Ca 0.12 0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.27 1rla h GLU 86 Cb 0.06 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 1rla h GLU 86 CO -0.02 0.00 0.23 1.79 -1.18 0.00 0.00 179.01 179.84 1rla h THR 87 N -0.65 1.25 -0.62 0.32 1.35 -1.00 -2.69 112.91 110.85 1rla h THR 87 Ca -0.03 -0.81 0.01 0.00 -0.55 0.00 0.00 66.41 65.02 1rla h THR 87 Cb 0.46 0.53 -0.03 0.00 -1.73 0.00 0.00 68.15 67.38 1rla h THR 87 CO 0.05 0.32 0.41 1.56 -0.25 0.00 0.00 175.52 177.61 1rla h GLN 88 N 0.95 0.82 -0.81 4.72 1.08 -1.06 -2.22 115.11 118.59 1rla h GLN 88 Ca 0.22 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.35 1rla h GLN 88 Cb 0.25 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.46 1rla h GLN 88 CO -0.01 0.55 0.44 -0.22 -0.95 0.00 0.00 178.83 178.64 1rla h LYS 89 N 0.85 1.13 0.00 1.46 3.64 -1.01 -1.20 116.57 121.44 1rla h LYS 89 Ca 0.23 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1rla h LYS 89 Cb -0.10 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.50 1rla h LYS 89 CO -0.05 0.83 0.00 0.09 -2.27 0.00 0.00 179.45 178.05 1rla n ASN 90 N -4.41 0.00 -0.38 4.20 3.02 -0.85 -4.87 115.26 111.97 1rla n ASN 90 Ca 0.08 -1.26 -0.02 0.00 -0.03 0.00 0.00 54.58 53.35 1rla n ASN 90 Cb 0.10 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 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 0.54 0.40 3.72 7.41 0.00 -0.45 -5.07 105.19 111.74 1rla n GLY 91 Ca 0.11 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.32 3.87 -0.21 2.61 -4.23 -1.12 -4.69 115.64 109.55 1rla s THR 92 Ca 0.01 -1.69 -0.20 0.00 -1.18 0.00 0.00 61.69 58.63 1rla s THR 92 Cb -0.01 -3.09 -0.02 0.00 1.34 0.00 0.00 72.50 70.72 1rla s THR 92 CO 0.02 -0.36 0.61 -0.63 -0.54 0.00 0.00 174.62 173.72 1rla s ILE 93 N -2.25 5.02 0.07 2.99 1.01 0.57 -4.33 121.20 124.29 1rla s ILE 93 Ca 0.32 1.14 -0.21 0.00 0.00 0.00 0.00 60.65 61.90 1rla s ILE 93 Cb -0.07 -3.93 -0.07 0.00 0.01 0.00 0.00 42.46 38.41 1rla s ILE 93 CO 0.22 0.10 0.63 -0.94 0.00 0.00 0.00 174.94 174.95 1rla s SER 94 N 1.27 7.12 -0.19 3.58 1.04 -1.14 -1.19 113.70 124.19 1rla s SER 94 Ca 0.27 1.33 -0.00 0.00 0.48 0.00 0.00 55.95 58.03 1rla s SER 94 Cb -0.16 -2.40 0.05 0.00 0.10 0.00 0.00 66.02 63.62 1rla s SER 94 CO 0.10 0.20 -0.04 -0.69 0.98 0.00 0.00 173.24 173.79 1rla s VAL 95 N -0.82 1.15 -0.19 5.02 1.01 -0.61 -1.21 120.40 124.75 1rla s VAL 95 Ca 0.32 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 1rla s VAL 95 Cb -0.20 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 1rla s VAL 95 CO 0.20 -0.00 0.13 -0.69 0.00 0.00 0.00 175.10 174.74 1rla s VAL 96 N 1.59 5.37 -0.30 2.92 1.01 -0.04 -0.88 120.40 130.08 1rla s VAL 96 Ca -0.02 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.09 1rla s VAL 96 Cb -0.17 -3.43 0.03 0.00 0.00 0.00 0.00 36.38 32.81 1rla s VAL 96 CO -0.07 0.47 0.04 -0.76 0.00 0.00 0.00 175.10 174.77 1rla s LEU 97 N 0.17 3.85 0.93 3.92 1.43 -0.70 -1.01 118.68 127.27 1rla s LEU 97 Ca 0.09 -0.99 -0.14 0.00 -1.03 0.00 0.00 54.13 52.05 1rla s LEU 97 Cb -0.11 -1.79 0.19 0.00 0.03 0.00 0.00 46.19 44.51 1rla s LEU 97 CO -0.01 -0.23 1.28 -0.83 0.23 0.00 0.00 176.35 176.79 1rla s GLY 98 N 1.38 1.78 0.00 -3.19 0.00 -0.35 -1.36 107.32 105.57 1rla s GLY 98 Ca -0.01 -1.26 0.00 0.00 0.00 0.00 0.00 44.72 43.45 1rla s GLY 98 CO 0.00 -0.52 0.00 0.61 0.00 0.00 0.00 173.10 173.19 1rla n GLY 99 N -3.65 -1.57 3.89 0.20 0.00 0.34 -3.25 105.19 101.14 1rla n GLY 99 Ca 0.15 -1.42 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.34 5.59 0.40 1.61 1.47 -1.00 -1.21 116.67 121.20 1rla s ASP 100 Ca 0.00 1.11 0.25 0.00 1.18 0.00 0.00 52.55 55.08 1rla s ASP 100 Cb 0.00 -1.98 1.34 0.00 -0.34 0.00 0.00 42.92 41.94 1rla s ASP 100 CO 0.00 -1.22 1.73 -0.74 0.68 0.00 0.00 175.17 175.62 1rla h HIS 101 N -0.52 0.00 0.00 2.11 -0.00 -1.93 -2.58 115.15 112.23 1rla h HIS 101 Ca -0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 59.91 1rla h HIS 101 Cb 1.24 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.65 1rla h HIS 101 CO 0.52 0.00 -0.04 0.66 -0.00 0.00 0.00 177.93 179.07 1rla h SER 102 N 0.00 0.00 0.19 3.26 4.64 -1.79 -1.19 113.55 118.67 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 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1rla h SER 102 CO 0.00 0.04 0.00 0.23 -0.87 0.00 0.00 176.83 176.23 1rla n MET 103 N -3.60 0.11 0.21 4.77 2.81 -0.97 -1.21 117.12 119.23 1rla n MET 103 Ca -0.02 0.23 0.07 0.00 -1.81 0.00 0.00 57.70 56.16 1rla n MET 103 Cb 0.14 -1.50 0.45 0.00 -0.71 0.00 0.00 33.22 31.59 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 2.41 1.14 0.13 3.04 0.00 -1.46 -2.25 119.26 122.26 1rla h ALA 104 Ca 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1rla h ALA 104 Cb 0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1rla h ALA 104 CO 0.00 0.37 -0.18 0.82 0.00 0.00 0.00 179.25 180.26 1rla h ILE 105 N 0.00 0.59 -0.36 0.00 2.04 -1.38 0.57 117.51 118.97 1rla h ILE 105 Ca -0.00 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 1rla h ILE 105 Cb 0.70 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1rla h ILE 105 CO 0.04 0.00 -0.26 1.23 0.00 0.00 0.00 178.15 179.16 1rla h GLY 106 N -0.37 0.89 0.96 5.37 0.00 -1.71 -1.61 103.07 106.60 1rla h GLY 106 Ca 0.02 -0.86 -0.01 0.00 0.00 0.00 0.00 47.33 46.48 1rla h GLY 106 CO -0.08 0.78 0.21 0.23 0.00 0.00 0.00 176.54 177.68 1rla h SER 107 N 0.61 0.51 0.64 0.19 0.87 -1.27 -1.12 113.55 113.98 1rla h SER 107 Ca 0.07 -0.10 -0.20 0.00 -1.23 0.00 0.00 61.79 60.33 1rla h SER 107 Cb 0.83 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 1rla h SER 107 CO 0.07 0.47 -0.90 0.40 -0.53 0.00 0.00 176.83 176.34 1rla h ILE 108 N 0.52 1.52 0.21 2.23 2.04 -0.92 -2.48 117.51 120.64 1rla h ILE 108 Ca 0.14 -2.71 -0.01 0.00 1.00 0.00 0.00 64.86 63.28 1rla h ILE 108 Cb 0.08 2.52 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1rla h ILE 108 CO -0.02 0.79 -0.10 0.28 0.00 0.00 0.00 178.15 179.09 1rla h SER 109 N 0.09 -0.24 -0.61 1.72 0.02 -1.13 -0.69 113.55 112.71 1rla h SER 109 Ca -0.04 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 60.82 1rla h SER 109 Cb 1.54 0.06 -0.03 0.00 0.14 0.00 0.00 62.40 64.11 1rla h SER 109 CO 0.13 -0.05 0.40 1.23 -1.14 0.00 0.00 176.83 177.40 1rla h GLY 110 N -0.42 0.86 1.01 -3.77 0.00 -1.28 -2.12 103.07 97.35 1rla h GLY 110 Ca -0.03 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.99 1rla h GLY 110 CO 0.05 0.30 0.54 0.84 0.00 0.00 0.00 176.54 178.26 1rla h HIS 111 N 0.81 1.07 0.00 5.60 6.17 -1.33 -2.34 115.15 125.13 1rla h HIS 111 Ca 0.23 0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.29 1rla h HIS 111 Cb -0.07 -0.36 -0.00 0.00 2.52 0.00 0.00 27.41 29.50 1rla h HIS 111 CO -0.04 0.69 -0.13 0.00 0.71 0.00 0.00 177.93 179.17 1rla h ALA 112 N 1.29 1.05 -0.15 5.26 0.00 -0.52 -1.21 119.26 124.98 1rla h ALA 112 Ca 0.30 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1rla h ALA 112 Cb -0.10 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1rla h ALA 112 CO -0.06 0.16 -0.05 0.00 0.00 0.00 0.00 179.25 179.30 1rla h ARG 113 N 0.00 0.22 0.04 0.00 3.08 -0.82 -1.78 114.38 115.12 1rla h ARG 113 Ca -0.00 -0.04 -0.37 0.00 0.07 0.00 0.00 59.98 59.64 1rla h ARG 113 Cb 0.58 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.54 1rla h ARG 113 CO 0.02 0.29 -2.27 0.28 -1.07 0.00 0.00 179.97 177.22 1rla n VAL 114 N -4.36 1.57 -3.71 2.04 0.31 -1.06 -4.67 118.33 108.45 1rla n VAL 114 Ca -0.01 -0.65 -0.28 0.00 -0.01 0.00 0.00 64.34 63.39 1rla n VAL 114 Cb 0.20 -1.34 -0.11 0.00 -0.91 0.00 0.00 33.84 31.68 1rla n VAL 114 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1rla n HIS 115 N -3.23 2.89 0.31 3.52 8.25 -0.48 -4.95 115.22 121.53 1rla n HIS 115 Ca -0.38 -4.17 0.17 0.00 -0.26 0.00 0.00 57.72 53.09 1rla n HIS 115 Cb 1.04 -0.53 0.99 0.00 1.12 0.00 0.00 29.99 32.61 1rla n HIS 115 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1rla h PRO 116 N 5.04 0.00 -0.55 -0.41 0.13 -1.57 -2.67 132.00 131.97 1rla h PRO 116 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1rla h PRO 116 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1rla h PRO 116 CO 0.71 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.09 1rla n ASP 117 N -3.64 2.63 -4.67 1.44 5.75 -1.26 -4.94 116.55 111.86 1rla n ASP 117 Ca -0.03 -2.20 -0.30 0.00 -0.01 0.00 0.00 54.79 52.25 1rla n ASP 117 Cb 0.08 -0.40 0.16 0.00 -1.03 0.00 0.00 41.12 39.94 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 -1.18 2.27 0.18 -2.12 0.05 -1.00 -4.59 118.68 112.29 1rla s LEU 118 Ca 0.26 1.75 0.08 0.00 0.05 0.00 0.00 54.13 56.27 1rla s LEU 118 Cb 0.17 -4.10 -0.04 0.00 -2.05 0.00 0.00 46.19 40.16 1rla s LEU 118 CO 0.13 -2.99 -0.15 0.00 -0.55 0.00 0.00 176.35 172.79 1rla s VAL 120 N -2.68 1.93 -0.24 0.00 1.01 0.34 -0.77 120.40 119.99 1rla s VAL 120 Ca 0.19 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.18 1rla s VAL 120 Cb -0.02 -1.64 0.04 0.00 0.00 0.00 0.00 36.38 34.76 1rla s VAL 120 CO 0.06 0.54 -0.10 -0.63 0.00 0.00 0.00 175.10 174.97 1rla s ILE 121 N -0.11 2.50 -0.33 2.22 1.01 -0.36 -1.19 121.20 124.94 1rla s ILE 121 Ca -0.04 -1.20 -0.09 0.00 0.00 0.00 0.00 60.65 59.32 1rla s ILE 121 Cb -0.13 -2.29 0.01 0.00 0.01 0.00 0.00 42.46 40.06 1rla s ILE 121 CO 0.04 0.19 0.15 0.86 0.00 0.00 0.00 174.94 176.18 1rla s TRP 122 N 1.25 3.20 -0.31 3.97 -0.11 0.17 -1.27 118.94 125.84 1rla s TRP 122 Ca -0.02 -0.85 -0.08 0.00 1.22 0.00 0.00 56.10 56.37 1rla s TRP 122 Cb -0.17 -2.35 0.01 0.00 -1.50 0.00 0.00 33.47 29.46 1rla s TRP 122 CO -0.06 -0.56 0.11 0.08 -4.62 0.00 0.00 176.95 171.89 1rla s VAL 123 N 1.55 4.18 -0.07 5.86 1.01 -0.57 -0.66 120.40 131.70 1rla s VAL 123 Ca 0.03 -0.66 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 1rla s VAL 123 Cb -0.18 -3.17 0.11 0.00 0.00 0.00 0.00 36.38 33.14 1rla s VAL 123 CO 0.05 0.04 0.92 -0.62 0.00 0.00 0.00 175.10 175.49 1rla s ASP 124 N 1.53 -0.38 0.31 3.32 -1.08 -0.72 -0.57 116.67 119.08 1rla s ASP 124 Ca 0.03 0.18 0.25 0.00 -0.52 0.00 0.00 52.55 52.48 1rla s ASP 124 Cb -0.17 0.36 0.57 0.00 -1.46 0.00 0.00 42.92 42.22 1rla s ASP 124 CO 0.04 -0.52 1.67 0.00 0.52 0.00 0.00 175.17 176.88 1rla h ALA 125 N 2.25 0.97 -3.62 3.66 0.00 -1.74 -2.87 119.26 117.91 1rla h ALA 125 Ca -0.21 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.03 1rla h ALA 125 Cb 1.21 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.80 1rla h ALA 125 CO 0.31 0.00 -0.83 -1.01 0.00 0.00 0.00 179.25 177.72 1rla s HIS 126 N -3.16 2.39 -0.25 0.00 3.76 -1.26 -1.53 115.29 115.24 1rla s HIS 126 Ca 0.09 -0.33 0.18 0.00 -0.15 0.00 0.00 55.06 54.84 1rla s HIS 126 Cb 0.09 -1.25 0.17 0.00 1.11 0.00 0.00 32.58 32.69 1rla s HIS 126 CO 0.64 0.40 1.50 1.79 -0.85 0.00 0.00 174.74 178.23 1rla h THR 127 N 3.54 0.57 -6.69 1.30 1.35 -1.89 -3.48 112.91 107.61 1rla h THR 127 Ca -0.49 -1.80 -0.54 0.00 -0.55 0.00 0.00 66.41 63.03 1rla h THR 127 Cb 1.18 2.28 -0.18 0.00 -1.73 0.00 0.00 68.15 69.70 1rla h THR 127 CO 0.44 0.32 -0.84 0.47 -0.25 0.00 0.00 175.52 175.67 1rla n ASP 128 N -3.18 -3.00 -0.32 5.36 8.00 -1.26 -4.77 116.55 117.37 1rla n ASP 128 Ca 0.03 -1.00 0.08 0.00 0.71 0.00 0.00 54.79 54.61 1rla n ASP 128 Cb 0.66 -2.86 0.17 0.00 -0.02 0.00 0.00 41.12 39.08 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 -4.41 2.02 -2.28 0.53 3.06 -1.17 -2.23 119.36 114.88 1rla n ILE 129 Ca 0.02 -2.70 -0.40 0.00 -2.50 0.00 0.00 62.75 57.16 1rla n ILE 129 Cb 0.52 -0.23 -0.03 0.00 0.54 0.00 0.00 39.64 40.44 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 -3.03 7.00 0.51 9.51 0.01 -0.84 -4.54 114.94 123.56 1rla s ASN 130 Ca 0.35 2.50 0.02 0.00 -0.71 0.00 0.00 52.86 55.01 1rla s ASN 130 Cb 0.32 -2.64 0.02 0.00 0.41 0.00 0.00 41.25 39.36 1rla s ASN 130 CO -0.02 -0.36 0.73 0.42 -1.51 0.00 0.00 177.10 176.36 1rla s THR 131 N -1.15 3.06 0.57 1.60 -4.23 -1.26 -4.28 115.64 109.94 1rla s THR 131 Ca 0.47 -0.65 0.42 0.00 -1.18 0.00 0.00 61.69 60.74 1rla s THR 131 Cb -0.36 -3.13 0.42 0.00 1.34 0.00 0.00 72.50 70.77 1rla s THR 131 CO 0.48 -0.09 2.28 -0.65 -0.54 0.00 0.00 174.62 176.10 1rla h PRO 132 N 0.21 0.00 0.07 3.99 0.11 -1.95 -2.10 132.00 132.32 1rla h PRO 132 Ca -0.43 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.37 1rla h PRO 132 Cb 1.28 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.37 1rla h PRO 132 CO 0.53 0.00 -1.67 -0.07 -0.21 0.00 0.00 178.00 176.57 1rla h LEU 133 N 0.00 0.22 0.00 2.35 3.38 -1.94 -3.39 115.31 115.93 1rla h LEU 133 Ca 0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1rla h LEU 133 Cb 0.03 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1rla h LEU 133 CO 0.00 1.34 -0.84 0.35 0.09 0.00 0.00 178.44 179.38 1rla n THR 134 N -3.29 0.40 -1.79 0.22 -2.24 -0.85 -4.94 114.28 101.79 1rla n THR 134 Ca -0.19 -0.36 -0.41 0.00 -2.27 0.00 0.00 64.05 60.82 1rla n THR 134 Cb 1.04 -0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 69.14 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 -3.24 2.05 -0.23 4.28 -4.23 -0.86 -4.88 115.64 108.53 1rla s THR 135 Ca 0.03 0.05 0.20 0.00 -1.18 0.00 0.00 61.69 60.79 1rla s THR 135 Cb 0.12 -3.03 0.05 0.00 1.34 0.00 0.00 72.50 70.98 1rla s THR 135 CO 0.76 0.01 1.20 0.28 -0.54 0.00 0.00 174.62 176.33 1rla h SER 136 N 3.83 0.00 -3.51 3.99 0.02 -1.93 -3.45 113.55 112.51 1rla h SER 136 Ca -0.49 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.00 1rla h SER 136 Cb 1.23 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.61 1rla h SER 136 CO 0.71 0.25 -0.75 -0.94 -1.14 0.00 0.00 176.83 174.96 1rla s SER 137 N -5.89 2.45 -0.01 3.07 1.04 -1.26 -5.03 113.70 108.07 1rla s SER 137 Ca 0.01 -0.93 0.06 0.00 0.48 0.00 0.00 55.95 55.57 1rla s SER 137 Cb 0.08 -0.12 0.19 0.00 0.10 0.00 0.00 66.02 66.27 1rla s SER 137 CO 0.76 -0.14 1.12 0.61 0.98 0.00 0.00 173.24 176.57 1rla n GLY 138 N 0.00 0.25 3.65 7.32 0.00 -1.24 -4.86 105.19 110.31 1rla n GLY 138 Ca -0.11 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 -0.90 6.44 0.46 1.61 0.01 -1.26 -2.16 114.94 119.15 1rla s ASN 139 Ca 0.14 2.37 0.29 0.00 -0.71 0.00 0.00 52.86 54.96 1rla s ASN 139 Cb 0.08 -2.53 1.06 0.00 0.41 0.00 0.00 41.25 40.27 1rla s ASN 139 CO 0.09 -1.10 1.85 -0.07 -1.51 0.00 0.00 177.10 176.37 1rla h LEU 140 N 10.91 0.00 -1.26 0.60 3.38 -1.66 -3.00 115.31 124.29 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 0.00 0.00 1.12 0.09 0.00 0.00 178.44 180.60 1rla h HIS 141 N 0.00 0.00 -0.66 1.13 2.07 -1.12 -1.51 115.15 115.06 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 0.61 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.59 1rla h HIS 141 CO 0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 1rla n GLY 142 N -0.17 2.28 0.00 6.13 0.00 -1.13 -4.43 105.19 107.86 1rla n GLY 142 Ca 0.01 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 1.35 0.35 -0.25 1.61 6.02 -0.57 -1.98 117.38 123.90 1rla n GLN 143 Ca 0.23 -0.56 -0.04 0.00 -0.01 0.00 0.00 57.00 56.62 1rla n GLN 143 Cb 0.65 -0.75 0.02 0.00 1.02 0.00 0.00 30.24 31.19 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 -0.11 0.00 -1.09 0.11 -1.51 -0.83 132.00 128.57 1rla h PRO 144 Ca 0.00 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 1rla h PRO 144 Cb 0.47 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.60 1rla h PRO 144 CO 0.00 -0.07 -0.09 0.28 -0.21 0.00 0.00 178.00 177.91 1rla h VAL 145 N -0.11 0.90 -0.74 3.15 2.07 -1.75 -1.98 116.25 117.80 1rla h VAL 145 Ca 0.27 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 1rla h VAL 145 Cb 0.56 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1rla h VAL 145 CO -0.77 0.09 0.26 0.00 0.02 0.00 0.00 177.57 177.17 1rla h ALA 146 N 1.91 1.06 0.00 1.67 0.00 -1.31 -2.05 119.26 120.54 1rla h ALA 146 Ca -0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1rla h ALA 146 Cb 0.18 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1rla h ALA 146 CO 0.01 0.65 -0.21 0.74 0.00 0.00 0.00 179.25 180.44 1rla h PHE 147 N 1.08 0.00 0.00 0.00 -1.00 -1.37 -3.21 116.94 112.44 1rla h PHE 147 Ca 0.24 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.97 1rla h PHE 147 Cb 0.26 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.81 1rla h PHE 147 CO 0.02 0.21 -1.27 1.28 -1.61 0.00 0.00 178.31 176.94 1rla n LEU 148 N -3.38 0.72 -4.72 1.54 4.77 -0.94 -4.33 117.00 110.66 1rla n LEU 148 Ca 0.00 0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.86 1rla n LEU 148 Cb 0.42 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 1rla n LEU 148 CO 0.33 -0.06 0.77 -0.76 -1.33 0.00 0.00 177.39 176.34 1rla s LEU 149 N -5.36 4.42 0.14 2.23 1.43 -0.81 -2.68 118.68 118.04 1rla s LEU 149 Ca -0.02 1.90 -0.13 0.00 -1.03 0.00 0.00 54.13 54.85 1rla s LEU 149 Cb 0.10 -3.58 0.01 0.00 0.03 0.00 0.00 46.19 42.75 1rla s LEU 149 CO 0.81 -0.29 1.61 0.11 0.23 0.00 0.00 176.35 178.82 1rla h LYS 150 N 6.22 0.82 0.00 1.70 1.57 -1.57 -2.98 116.57 122.33 1rla h LYS 150 Ca -0.42 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.11 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 0.86 0.00 0.39 -0.57 0.00 0.00 179.45 180.89 1rla n GLU 151 N -4.38 0.00 -0.14 3.15 4.71 -1.26 -1.79 120.64 120.93 1rla n GLU 151 Ca 0.01 0.36 0.09 0.00 -0.01 0.00 0.00 57.16 57.61 1rla n GLU 151 Cb 0.29 -1.51 0.16 0.00 -1.01 0.00 0.00 31.44 29.37 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 -1.51 3.03 -4.70 -4.62 4.32 -1.13 -4.94 117.00 107.44 1rla n LEU 152 Ca 0.02 -1.46 -0.42 0.00 -0.02 0.00 0.00 56.01 54.13 1rla n LEU 152 Cb 0.10 -0.18 -0.03 0.00 -1.62 0.00 0.00 43.42 41.69 1rla n LEU 152 CO 0.08 0.65 1.16 -0.75 -1.22 0.00 0.00 177.39 177.31 1rla s LYS 153 N -1.31 4.27 0.00 3.23 2.47 -0.74 -2.71 119.74 124.95 1rla s LYS 153 Ca 0.30 2.14 0.00 0.00 -1.56 0.00 0.00 55.97 56.85 1rla s LYS 153 Cb 0.18 -3.41 0.00 0.00 -1.46 0.00 0.00 37.83 33.14 1rla s LYS 153 CO 0.25 -0.57 0.00 0.41 0.16 0.00 0.00 175.35 175.60 1rla n GLY 154 N 3.69 0.52 0.41 5.54 0.00 -1.26 -4.86 105.19 109.23 1rla n GLY 154 Ca 0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 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 -2.22 1.19 -3.82 1.61 4.76 -1.10 -4.88 118.16 113.70 1rla n LYS 155 Ca 0.00 -0.83 -0.12 0.00 -2.87 0.00 0.00 58.31 54.49 1rla n LYS 155 Cb 0.07 -1.48 -0.10 0.00 -1.84 0.00 0.00 35.03 31.67 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 -2.38 -0.11 0.59 2.13 -0.71 -1.26 -4.99 117.98 111.25 1rla s PHE 156 Ca 0.25 0.20 -0.20 0.00 -1.04 0.00 0.00 56.93 56.14 1rla s PHE 156 Cb 0.19 0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 42.00 1rla s PHE 156 CO 0.49 -0.27 1.21 -0.35 -1.34 0.00 0.00 175.22 174.96 1rla n PRO 157 N 1.81 1.27 -2.09 1.99 -0.04 -1.26 -4.93 135.00 131.75 1rla n PRO 157 Ca -0.20 0.48 -0.41 0.00 -0.04 0.00 0.00 63.50 63.33 1rla n PRO 157 Cb 0.56 -2.42 -0.02 0.00 -0.04 0.00 0.00 33.50 31.58 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 -1.14 6.75 -0.06 3.54 1.01 -1.26 -4.99 116.67 120.52 1rla s ASP 158 Ca 0.76 2.63 -0.04 0.00 0.71 0.00 0.00 52.55 56.60 1rla s ASP 158 Cb -0.41 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 40.85 1rla s ASP 158 CO 0.46 -0.60 0.13 -0.69 0.21 0.00 0.00 175.17 174.68 1rla s VAL 159 N -0.44 5.22 0.01 -1.27 1.01 -1.26 -5.04 120.40 118.62 1rla s VAL 159 Ca 0.55 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.17 1rla s VAL 159 Cb -0.40 -3.33 -0.08 0.00 0.00 0.00 0.00 36.38 32.57 1rla s VAL 159 CO 0.46 0.49 1.98 -2.84 0.00 0.00 0.00 175.10 175.19 1rla s PRO 160 N -1.39 4.06 0.00 2.72 0.02 -1.26 -2.09 135.00 137.06 1rla s PRO 160 Ca 0.20 2.55 0.00 0.00 0.02 0.00 0.00 61.00 63.76 1rla s PRO 160 Cb -0.12 -4.17 0.00 0.00 0.02 0.00 0.00 34.50 30.22 1rla s PRO 160 CO 0.10 -1.05 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 1rla n GLY 161 N 4.63 0.42 0.24 0.52 0.00 -1.26 -2.81 105.19 106.93 1rla n GLY 161 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.64 0.20 0.35 1.61 3.01 -0.89 -4.06 117.46 116.04 1rla n PHE 162 Ca 0.00 -0.92 0.14 0.00 1.01 0.00 0.00 57.45 57.68 1rla n PHE 162 Cb 0.00 -0.17 0.53 0.00 -0.01 0.00 0.00 39.48 39.83 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 0.40 0.00 1.68 4.37 4.64 -1.94 -2.80 113.55 119.91 1rla h SER 163 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1rla h SER 163 Cb 1.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1rla h SER 163 CO 0.04 0.00 -0.05 4.11 -0.87 0.00 0.00 176.83 180.06 1rla h TRP 164 N 0.00 0.00 -3.29 4.77 5.08 -1.97 -3.45 115.95 117.09 1rla h TRP 164 Ca 0.00 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.44 1rla h TRP 164 Cb 0.55 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.74 1rla h TRP 164 CO 0.00 0.05 0.64 0.08 -1.28 0.00 0.00 178.44 177.93 1rla s VAL 165 N -3.31 3.42 -0.17 0.12 1.01 -1.06 -5.03 120.40 115.38 1rla s VAL 165 Ca 0.05 1.11 0.01 0.00 0.00 0.00 0.00 61.98 63.15 1rla s VAL 165 Cb 0.06 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.76 1rla s VAL 165 CO 0.65 0.14 -0.16 -0.89 0.00 0.00 0.00 175.10 174.84 1rla s THR 166 N 0.44 1.76 -0.22 3.92 2.01 -1.26 -5.07 115.64 117.23 1rla s THR 166 Ca 0.58 -0.82 -0.35 0.00 0.31 0.00 0.00 61.69 61.42 1rla s THR 166 Cb -0.35 -1.66 -0.11 0.00 0.01 0.00 0.00 72.50 70.39 1rla s THR 166 CO 0.35 0.43 2.01 -2.65 -0.69 0.00 0.00 174.62 174.07 1rla n PRO 167 N 4.70 1.65 -0.08 4.92 -0.02 -1.26 -4.84 135.00 140.06 1rla n PRO 167 Ca -0.18 0.55 -0.06 0.00 -2.02 0.00 0.00 63.50 61.79 1rla n PRO 167 Cb 0.49 -2.58 -0.16 0.00 -0.02 0.00 0.00 33.50 31.23 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 -2.69 2.54 0.42 0.00 -0.00 -1.14 -4.98 121.20 115.35 1rla s ILE 169 Ca -0.10 -1.78 0.08 0.00 -0.00 0.00 0.00 60.65 58.85 1rla s ILE 169 Cb 0.08 -2.19 -0.00 0.00 -0.00 0.00 0.00 42.46 40.35 1rla s ILE 169 CO 0.85 -0.00 0.49 -0.94 -0.00 0.00 0.00 174.94 175.33 1rla s SER 170 N -2.39 5.42 0.60 4.36 1.04 -1.26 -1.56 113.70 119.92 1rla s SER 170 Ca 0.19 -0.54 0.30 0.00 0.48 0.00 0.00 55.95 56.37 1rla s SER 170 Cb -0.09 -0.63 1.67 0.00 0.10 0.00 0.00 66.02 67.06 1rla s SER 170 CO 0.09 -0.71 2.06 0.00 0.98 0.00 0.00 173.24 175.67 1rla h ALA 171 N 0.80 1.78 0.00 5.32 0.00 -1.97 -0.03 119.26 125.17 1rla h ALA 171 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1rla h ALA 171 Cb 1.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1rla h ALA 171 CO 0.50 -0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.03 1rla n LYS 172 N -3.67 0.16 -0.52 0.00 4.76 -1.26 -3.77 118.16 113.87 1rla n LYS 172 Ca 0.02 0.18 0.09 0.00 -2.87 0.00 0.00 58.31 55.73 1rla n LYS 172 Cb 0.37 -1.71 0.31 0.00 -1.84 0.00 0.00 35.03 32.17 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 -1.99 4.35 -4.06 4.39 8.00 -0.02 -4.91 116.55 122.30 1rla n ASP 173 Ca 0.05 -2.46 -0.20 0.00 0.71 0.00 0.00 54.79 52.89 1rla n ASP 173 Cb 0.36 -0.52 -0.15 0.00 -0.02 0.00 0.00 41.12 40.80 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 -1.86 0.86 -0.04 0.53 2.07 -1.25 -0.51 121.20 121.01 1rla s ILE 174 Ca 0.45 -0.48 0.02 0.00 -1.41 0.00 0.00 60.65 59.23 1rla s ILE 174 Cb 0.30 -0.72 0.01 0.00 0.13 0.00 0.00 42.46 42.17 1rla s ILE 174 CO 0.21 0.23 -0.09 -0.69 -1.91 0.00 0.00 174.94 172.69 1rla s VAL 175 N -0.28 0.85 -0.00 4.00 1.01 -0.33 -4.10 120.40 121.55 1rla s VAL 175 Ca 0.04 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.64 1rla s VAL 175 Cb -0.04 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1rla s VAL 175 CO -0.00 0.28 0.15 -0.31 0.00 0.00 0.00 175.10 175.21 1rla s TYR 176 N 0.43 3.45 -0.03 5.22 2.02 -1.01 -0.65 117.35 126.79 1rla s TYR 176 Ca -0.08 0.30 -0.00 0.00 -0.37 0.00 0.00 57.07 56.92 1rla s TYR 176 Cb -0.12 -1.79 0.03 0.00 -0.40 0.00 0.00 41.96 39.68 1rla s TYR 176 CO 0.01 0.61 0.04 0.42 -1.57 0.00 0.00 175.55 175.07 1rla s ILE 177 N -1.29 -0.07 0.00 2.71 1.01 0.16 -1.18 121.20 122.54 1rla s ILE 177 Ca 0.26 0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.15 1rla s ILE 177 Cb -0.12 -0.10 0.00 0.00 0.01 0.00 0.00 42.46 42.24 1rla s ILE 177 CO 0.18 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.82 1rla n GLY 178 N 4.29 0.51 3.60 6.18 0.00 -0.51 -1.75 105.19 117.51 1rla n GLY 178 Ca -0.26 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.26 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 1.89 0.00 0.99 4.77 -1.08 -4.27 117.00 119.30 1rla n LEU 179 Ca 0.00 1.12 0.00 0.00 -0.03 0.00 0.00 56.01 57.10 1rla n LEU 179 Cb 0.00 -1.24 0.00 0.00 -2.33 0.00 0.00 43.42 39.85 1rla n LEU 179 CO 0.00 -0.96 0.01 -2.11 -1.33 0.00 0.00 177.39 173.00 1rla n ARG 180 N 2.49 0.00 -3.11 3.23 1.85 -0.58 -0.98 116.66 119.55 1rla n ARG 180 Ca 0.17 -0.03 -0.17 0.00 -1.00 0.00 0.00 57.85 56.82 1rla n ARG 180 Cb 0.22 -0.08 -0.05 0.00 -1.05 0.00 0.00 32.46 31.50 1rla n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1rla n ASP 181 N 0.00 -1.65 -4.33 2.89 2.03 -0.94 -5.07 116.55 109.48 1rla n ASP 181 Ca 0.00 -2.64 -0.34 0.00 0.52 0.00 0.00 54.79 52.33 1rla n ASP 181 Cb 0.33 0.40 -0.14 0.00 -0.72 0.00 0.00 41.12 40.99 1rla n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1rla s VAL 182 N 0.30 3.10 0.83 5.18 1.01 -1.26 -4.54 120.40 125.02 1rla s VAL 182 Ca 0.32 -0.62 -0.11 0.00 0.00 0.00 0.00 61.98 61.58 1rla s VAL 182 Cb 0.04 -2.34 0.10 0.00 0.00 0.00 0.00 36.38 34.18 1rla s VAL 182 CO -0.14 0.49 1.12 -1.81 0.00 0.00 0.00 175.10 174.76 1rla s ASP 183 N 0.83 3.77 0.24 3.32 1.01 -1.26 -4.80 116.67 119.78 1rla s ASP 183 Ca -0.03 2.02 -0.07 0.00 0.71 0.00 0.00 52.55 55.18 1rla s ASP 183 Cb -0.15 -2.55 0.27 0.00 1.01 0.00 0.00 42.92 41.51 1rla s ASP 183 CO 0.01 -2.53 1.88 -0.65 0.21 0.00 0.00 175.17 174.09 1rla h PRO 184 N -1.42 1.06 0.11 8.23 0.11 -1.99 -1.13 132.00 136.98 1rla h PRO 184 Ca -0.43 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1rla h PRO 184 Cb 1.25 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1rla h PRO 184 CO 0.47 0.70 -0.05 0.78 -0.21 0.00 0.00 178.00 179.69 1rla h GLY 185 N 1.10 -0.16 0.82 -0.55 0.00 -1.92 -0.71 103.07 101.65 1rla h GLY 185 Ca 0.35 0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.77 1rla h GLY 185 CO -0.12 -0.06 0.35 0.83 0.00 0.00 0.00 176.54 177.54 1rla h GLU 186 N -0.23 0.66 -0.62 4.80 5.08 -1.84 -0.90 114.58 121.52 1rla h GLU 186 Ca -0.02 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1rla h GLU 186 Cb 0.19 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.23 1rla h GLU 186 CO 0.03 0.44 0.32 1.25 -1.00 0.00 0.00 179.01 180.05 1rla h HIS 187 N 0.68 0.59 -0.39 4.33 2.76 -0.98 -0.53 115.15 121.62 1rla h HIS 187 Ca 0.25 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.47 1rla h HIS 187 Cb 0.06 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 28.82 1rla h HIS 187 CO -0.06 0.27 0.18 -0.92 -1.30 0.00 0.00 177.93 176.09 1rla h TYR 188 N 0.60 0.33 0.02 5.26 3.20 -0.14 -2.05 116.97 124.19 1rla h TYR 188 Ca 0.29 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.17 1rla h TYR 188 Cb 0.21 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1rla h TYR 188 CO -0.10 0.17 -0.03 0.82 -1.64 0.00 0.00 178.16 177.38 1rla h ILE 189 N 0.37 0.94 -0.36 1.81 2.04 -0.12 -0.14 117.51 122.05 1rla h ILE 189 Ca 0.17 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.98 1rla h ILE 189 Cb 0.09 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1rla h ILE 189 CO -0.13 0.00 0.03 0.16 0.00 0.00 0.00 178.15 178.22 1rla h ILE 190 N -0.05 1.19 -0.11 -0.67 3.07 -0.97 0.02 117.51 119.98 1rla h ILE 190 Ca 0.01 -0.72 -0.08 0.00 1.55 0.00 0.00 64.86 65.62 1rla h ILE 190 Cb 0.06 0.88 0.00 0.00 -0.27 0.00 0.00 36.82 37.49 1rla h ILE 190 CO -0.02 0.25 -0.23 0.11 -1.05 0.00 0.00 178.15 177.21 1rla h LYS 191 N 0.52 0.36 -0.24 0.16 1.79 -1.20 -1.85 116.57 116.12 1rla h LYS 191 Ca 0.12 -0.23 -0.01 0.00 -2.18 0.00 0.00 60.65 58.34 1rla h LYS 191 Cb 0.28 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1rla h LYS 191 CO 0.00 0.83 0.09 1.15 -1.08 0.00 0.00 179.45 180.45 1rla h THR 192 N -0.07 1.17 0.00 -0.16 2.02 -0.74 -2.99 112.91 112.14 1rla h THR 192 Ca 0.00 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1rla h THR 192 Cb 0.82 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.30 1rla h THR 192 CO 0.05 0.17 0.00 0.18 0.37 0.00 0.00 175.52 176.29 1rla n LEU 193 N -4.80 0.18 -1.85 2.58 4.32 -0.03 -4.94 117.00 112.46 1rla n LEU 193 Ca -0.03 0.52 -0.11 0.00 -0.02 0.00 0.00 56.01 56.37 1rla n LEU 193 Cb 0.13 -0.48 0.03 0.00 -1.62 0.00 0.00 43.42 41.48 1rla n LEU 193 CO 0.35 -0.13 0.08 0.61 -1.22 0.00 0.00 177.39 177.08 1rla n GLY 194 N 0.99 0.18 3.71 -0.72 0.00 -0.76 -4.92 105.19 103.67 1rla n GLY 194 Ca 0.06 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.04 4.41 0.09 -0.61 1.01 -0.81 -4.91 121.20 117.34 1rla s ILE 195 Ca 0.24 1.73 -0.31 0.00 0.00 0.00 0.00 60.65 62.31 1rla s ILE 195 Cb -0.10 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 1rla s ILE 195 CO 0.29 0.13 1.29 -0.75 0.00 0.00 0.00 174.94 175.90 1rla s LYS 196 N 1.04 4.38 0.06 2.79 2.47 -1.26 -4.90 119.74 124.33 1rla s LYS 196 Ca 0.56 1.91 -0.10 0.00 -1.56 0.00 0.00 55.97 56.78 1rla s LYS 196 Cb -0.26 -3.30 0.00 0.00 -1.46 0.00 0.00 37.83 32.82 1rla s LYS 196 CO 0.29 -0.34 0.20 1.52 0.16 0.00 0.00 175.35 177.18 1rla s TYR 197 N 1.08 0.08 -0.37 4.03 1.13 -1.26 -2.41 117.35 119.63 1rla s TYR 197 Ca 0.61 -0.38 0.01 0.00 -1.41 0.00 0.00 57.07 55.91 1rla s TYR 197 Cb -0.33 -0.03 0.11 0.00 -1.10 0.00 0.00 41.96 40.62 1rla s TYR 197 CO 0.30 -0.49 0.15 -0.06 -2.51 0.00 0.00 175.55 172.94 1rla s PHE 198 N -3.11 2.10 0.94 -3.49 0.08 -0.32 -4.94 117.98 109.23 1rla s PHE 198 Ca -0.01 -2.20 -0.13 0.00 0.12 0.00 0.00 56.93 54.71 1rla s PHE 198 Cb 0.01 -1.95 0.15 0.00 -0.57 0.00 0.00 43.02 40.66 1rla s PHE 198 CO -0.07 -0.85 1.16 -1.54 -0.10 0.00 0.00 175.22 173.82 1rla s SER 199 N 0.99 3.29 0.53 1.36 1.04 -1.26 -1.43 113.70 118.22 1rla s SER 199 Ca 0.13 0.84 0.30 0.00 0.48 0.00 0.00 55.95 57.71 1rla s SER 199 Cb -0.21 -1.32 1.45 0.00 0.10 0.00 0.00 66.02 66.05 1rla s SER 199 CO -0.12 -2.67 1.90 0.24 0.98 0.00 0.00 173.24 173.56 1rla h MET 200 N -1.58 0.02 -0.11 4.02 2.86 -1.26 0.11 114.93 118.99 1rla h MET 200 Ca -0.49 -0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.04 1rla h MET 200 Cb 1.32 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.96 1rla h MET 200 CO 0.57 0.02 -0.44 0.00 1.06 0.00 0.00 176.91 178.12 1rla h THR 201 N 0.03 1.32 -0.05 2.22 1.03 -1.91 0.74 112.91 116.29 1rla h THR 201 Ca 0.42 -1.59 -0.18 0.00 -0.01 0.00 0.00 66.41 65.04 1rla h THR 201 Cb 1.63 1.73 -0.01 0.00 -1.07 0.00 0.00 68.15 70.43 1rla h THR 201 CO -0.02 0.48 -0.76 -0.33 -0.01 0.00 0.00 175.52 174.88 1rla h GLU 202 N 0.20 0.33 -0.19 0.00 3.07 -1.14 -1.43 114.58 115.42 1rla h GLU 202 Ca 0.02 -0.29 -0.01 0.00 -0.50 0.00 0.00 59.36 58.57 1rla h GLU 202 Cb 0.86 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.83 1rla h GLU 202 CO 0.07 0.95 0.07 0.28 -1.40 0.00 0.00 179.01 178.98 1rla h VAL 203 N 0.22 1.17 -0.34 3.13 2.07 -1.00 0.91 116.25 122.40 1rla h VAL 203 Ca -0.03 -0.51 0.04 0.00 0.82 0.00 0.00 66.70 67.01 1rla h VAL 203 Cb 1.34 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 32.22 1rla h VAL 203 CO 0.13 0.16 0.13 0.44 0.02 0.00 0.00 177.57 178.44 1rla h ASP 204 N 0.15 0.15 -0.32 0.57 3.32 -0.79 0.46 116.42 119.96 1rla h ASP 204 Ca 0.06 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 1rla h ASP 204 Cb 0.19 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1rla h ASP 204 CO -0.00 0.12 -0.08 0.50 -1.72 0.00 0.00 179.24 178.06 1rla h LYS 205 N 0.28 0.61 0.03 3.56 3.64 -1.12 -3.37 116.57 120.20 1rla h LYS 205 Ca 0.15 -0.24 -0.34 0.00 -1.27 0.00 0.00 60.65 58.96 1rla h LYS 205 Cb 0.12 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.85 1rla h LYS 205 CO -0.15 0.80 -2.00 1.28 -2.27 0.00 0.00 179.45 177.10 1rla n LEU 206 N -4.45 1.41 0.00 5.20 4.77 0.30 -5.09 117.00 119.14 1rla n LEU 206 Ca -0.03 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1rla n LEU 206 Cb 0.33 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1rla n LEU 206 CO 0.41 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 1rla n GLY 207 N 1.79 -0.14 0.37 -0.72 0.00 0.16 -4.29 105.19 102.36 1rla n GLY 207 Ca -0.27 -1.43 0.17 0.00 0.00 0.00 0.00 46.02 44.49 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 0.79 -0.15 -0.61 6.09 -1.93 -2.04 117.51 119.66 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 0.55 -0.01 0.00 0.47 0.00 0.00 36.82 37.83 1rla h ILE 208 CO 0.00 0.04 0.07 1.23 -3.07 0.00 0.00 178.15 176.42 1rla h GLY 209 N 0.22 0.19 1.78 8.18 0.00 -1.96 -2.07 103.07 109.42 1rla h GLY 209 Ca 0.29 -0.05 -0.16 0.00 0.00 0.00 0.00 47.33 47.41 1rla h GLY 209 CO -0.06 0.04 -0.71 1.70 0.00 0.00 0.00 176.54 177.52 1rla h LYS 210 N 0.16 0.21 -0.72 4.80 1.63 -1.59 -2.88 116.57 118.19 1rla h LYS 210 Ca 0.06 -0.18 0.04 0.00 -0.85 0.00 0.00 60.65 59.73 1rla h LYS 210 Cb 0.01 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.63 1rla h LYS 210 CO -0.04 0.83 0.43 0.28 -3.45 0.00 0.00 179.45 177.50 1rla h VAL 211 N 0.14 1.05 -0.39 2.00 2.07 -1.06 -1.27 116.25 118.79 1rla h VAL 211 Ca -0.02 -0.28 -0.14 0.00 0.82 0.00 0.00 66.70 67.08 1rla h VAL 211 Cb 1.26 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1rla h VAL 211 CO 0.11 0.15 -0.32 0.24 0.02 0.00 0.00 177.57 177.77 1rla h MET 212 N 0.83 0.86 -0.47 1.57 2.86 -1.32 -1.64 114.93 117.61 1rla h MET 212 Ca 0.30 -0.41 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 1rla h MET 212 Cb 0.09 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 1rla h MET 212 CO -0.14 1.06 0.28 1.49 1.06 0.00 0.00 176.91 180.65 1rla h GLU 213 N 0.72 0.54 -0.12 1.72 4.81 -1.22 -1.54 114.58 119.49 1rla h GLU 213 Ca 0.08 -0.03 -0.17 0.00 -0.13 0.00 0.00 59.36 59.11 1rla h GLU 213 Cb 0.88 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1rla h GLU 213 CO 0.08 0.36 -0.62 0.93 -0.73 0.00 0.00 179.01 179.03 1rla h GLU 214 N 0.56 0.45 -0.47 1.92 5.08 -1.10 -1.49 114.58 119.53 1rla h GLU 214 Ca 0.19 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.13 1rla h GLU 214 Cb 0.01 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1rla h GLU 214 CO -0.08 0.93 -0.12 1.79 -1.00 0.00 0.00 179.01 180.53 1rla h THR 215 N 0.33 1.26 -0.40 1.13 1.35 -1.04 -1.05 112.91 114.49 1rla h THR 215 Ca -0.01 -1.22 -0.15 0.00 -0.55 0.00 0.00 66.41 64.48 1rla h THR 215 Cb 1.17 1.02 -0.01 0.00 -1.73 0.00 0.00 68.15 68.61 1rla h THR 215 CO 0.11 0.42 -0.33 -0.26 -0.25 0.00 0.00 175.52 175.21 1rla h PHE 216 N 0.78 1.11 0.00 4.73 0.04 -1.18 0.60 116.94 123.02 1rla h PHE 216 Ca 0.13 -0.32 -0.06 0.00 2.80 0.00 0.00 57.97 60.52 1rla h PHE 216 Cb 0.64 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.54 1rla h PHE 216 CO 0.04 1.14 -0.30 0.66 -0.60 0.00 0.00 178.31 179.25 1rla h SER 217 N 0.76 0.00 0.04 2.17 4.64 -1.13 0.12 113.55 120.16 1rla h SER 217 Ca 0.07 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.26 1rla h SER 217 Cb 0.93 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.03 1rla h SER 217 CO 0.09 0.30 -0.54 0.22 -0.87 0.00 0.00 176.83 176.03 1rla h TYR 218 N 0.00 0.46 0.00 4.77 3.20 -0.75 -2.64 116.97 122.01 1rla h TYR 218 Ca -0.00 -0.28 -0.20 0.00 3.14 0.00 0.00 58.73 61.39 1rla h TYR 218 Cb 0.61 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.81 1rla h TYR 218 CO 0.00 1.14 -1.21 -0.07 -1.64 0.00 0.00 178.16 176.38 1rla h LEU 219 N -0.36 0.00 -1.79 2.82 3.38 -0.82 -3.39 115.31 115.16 1rla h LEU 219 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1rla h LEU 219 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1rla h LEU 219 CO 0.10 0.76 0.00 0.18 0.09 0.00 0.00 178.44 179.57 1rla n LEU 220 N -3.10 1.39 -0.21 1.67 4.77 0.40 -4.71 117.00 117.21 1rla n LEU 220 Ca -0.07 -1.39 -0.01 0.00 -0.03 0.00 0.00 56.01 54.51 1rla n LEU 220 Cb 0.89 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 42.08 1rla n LEU 220 CO 0.44 0.35 1.05 1.23 -1.33 0.00 0.00 177.39 179.13 1rla h GLY 221 N 0.00 0.90 0.00 -0.72 0.00 -1.41 -3.30 103.07 98.54 1rla h GLY 221 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 47.33 47.00 1rla h GLY 221 CO 0.00 0.10 -0.77 3.21 0.00 0.00 0.00 176.54 179.08 1rla h ARG 222 N 0.58 0.00 -4.97 4.80 3.08 -1.86 -3.48 114.38 112.53 1rla h ARG 222 Ca 0.29 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.86 1rla h ARG 222 Cb 0.24 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 29.98 1rla h ARG 222 CO -0.21 0.72 -0.81 0.15 -1.07 0.00 0.00 179.97 178.76 1rla s LYS 223 N -2.25 1.21 -0.10 0.04 1.02 -1.24 -5.11 119.74 113.31 1rla s LYS 223 Ca -0.22 -0.44 -0.27 0.00 0.02 0.00 0.00 55.97 55.07 1rla s LYS 223 Cb 0.03 -1.11 -0.02 0.00 -0.52 0.00 0.00 37.83 36.21 1rla s LYS 223 CO 0.49 0.20 0.86 0.15 -0.92 0.00 0.00 175.35 176.13 1rla s LYS 224 N -0.01 4.41 0.07 1.68 -0.14 -1.26 -4.36 119.74 120.12 1rla s LYS 224 Ca -0.01 1.13 -0.06 0.00 -1.36 0.00 0.00 55.97 55.67 1rla s LYS 224 Cb -0.08 -3.51 -0.01 0.00 -1.68 0.00 0.00 37.83 32.54 1rla s LYS 224 CO 0.01 -0.17 0.11 -0.98 -0.76 0.00 0.00 175.35 173.56 1rla s ARG 225 N 1.56 0.73 0.63 1.68 1.70 -1.26 -5.13 118.95 118.85 1rla s ARG 225 Ca 0.43 -0.98 -0.18 0.00 -0.47 0.00 0.00 55.73 54.53 1rla s ARG 225 Cb -0.18 0.28 -0.05 0.00 -0.57 0.00 0.00 34.95 34.44 1rla s ARG 225 CO 0.18 -0.20 0.78 -2.30 -1.08 0.00 0.00 175.30 172.68 1rla n PRO 226 N 0.16 0.64 -5.10 3.89 -0.02 -1.26 -4.80 135.00 128.51 1rla n PRO 226 Ca -0.16 0.26 -0.32 0.00 -2.02 0.00 0.00 63.50 61.26 1rla n PRO 226 Cb 0.61 -2.00 -0.15 0.00 -0.02 0.00 0.00 33.50 31.94 1rla n PRO 226 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1rla s ILE 227 N -1.67 2.46 -0.21 4.25 1.01 -0.31 -1.94 121.20 124.79 1rla s ILE 227 Ca 0.73 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 60.43 1rla s ILE 227 Cb -0.40 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.14 1rla s ILE 227 CO 0.51 0.57 -0.09 -2.28 0.00 0.00 0.00 174.94 173.65 1rla s HIS 228 N -0.27 2.92 -0.29 3.97 5.65 0.05 -0.77 115.29 126.55 1rla s HIS 228 Ca 0.00 -1.19 -0.07 0.00 0.25 0.00 0.00 55.06 54.05 1rla s HIS 228 Cb -0.13 -2.05 -0.00 0.00 -1.18 0.00 0.00 32.58 29.22 1rla s HIS 228 CO 0.03 -0.64 0.09 -1.17 -0.65 0.00 0.00 174.74 172.40 1rla s LEU 229 N 1.41 3.80 -0.33 8.88 2.96 0.10 -1.22 118.68 134.27 1rla s LEU 229 Ca 0.05 -0.57 -0.08 0.00 -0.22 0.00 0.00 54.13 53.30 1rla s LEU 229 Cb -0.14 -1.91 0.02 0.00 0.50 0.00 0.00 46.19 44.66 1rla s LEU 229 CO -0.06 -0.16 0.14 -0.55 -1.32 0.00 0.00 176.35 174.40 1rla s SER 230 N 1.54 5.43 -0.38 3.68 0.15 -0.39 -0.80 113.70 122.93 1rla s SER 230 Ca 0.04 -0.89 -0.09 0.00 0.70 0.00 0.00 55.95 55.71 1rla s SER 230 Cb -0.17 -1.94 0.05 0.00 -1.71 0.00 0.00 66.02 62.26 1rla s SER 230 CO 0.03 -0.29 0.19 0.12 1.20 0.00 0.00 173.24 174.50 1rla s PHE 231 N 1.51 3.29 -0.24 3.44 2.19 0.18 -1.52 117.98 126.83 1rla s PHE 231 Ca 0.02 -1.36 -0.19 0.00 0.33 0.00 0.00 56.93 55.73 1rla s PHE 231 Cb -0.18 -2.60 -0.03 0.00 -1.31 0.00 0.00 43.02 38.90 1rla s PHE 231 CO 0.04 -0.76 0.55 0.34 1.83 0.00 0.00 175.22 177.22 1rla s ASP 232 N 1.73 6.52 0.61 6.13 -1.08 0.27 -0.78 116.67 130.07 1rla s ASP 232 Ca 0.01 0.63 0.33 0.00 -0.52 0.00 0.00 52.55 53.00 1rla s ASP 232 Cb -0.21 -2.30 1.88 0.00 -1.46 0.00 0.00 42.92 40.83 1rla s ASP 232 CO 0.03 -0.27 2.19 1.62 0.52 0.00 0.00 175.17 179.26 1rla h VAL 233 N 5.31 0.34 0.00 1.11 3.04 -1.68 0.97 116.25 125.33 1rla h VAL 233 Ca -0.30 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.39 1rla h VAL 233 Cb 1.14 0.90 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 1rla h VAL 233 CO 0.74 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.40 1rla n ASP 234 N -3.57 0.00 0.21 3.17 5.68 -1.26 -2.27 116.55 118.51 1rla n ASP 234 Ca -0.01 -0.54 0.05 0.00 -0.50 0.00 0.00 54.79 53.79 1rla n ASP 234 Cb 0.20 -0.08 0.45 0.00 -1.14 0.00 0.00 41.12 40.56 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 3.62 0.00 -2.70 6.12 0.00 -1.05 -3.35 103.07 105.71 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 -0.02 1.08 0.00 0.00 0.00 176.54 177.60 1rla s LEU 236 N -8.09 3.90 0.48 3.11 1.43 -0.96 -2.37 118.68 116.19 1rla s LEU 236 Ca -0.03 0.87 -0.24 0.00 -1.03 0.00 0.00 54.13 53.70 1rla s LEU 236 Cb 0.14 -3.73 -0.07 0.00 0.03 0.00 0.00 46.19 42.56 1rla s LEU 236 CO 0.69 -0.34 1.34 -0.67 0.23 0.00 0.00 176.35 177.60 1rla n ASP 237 N -1.36 2.76 0.24 2.29 -0.08 0.27 -4.65 116.55 116.03 1rla n ASP 237 Ca -0.00 1.05 0.14 0.00 -1.51 0.00 0.00 54.79 54.47 1rla n ASP 237 Cb 0.54 -1.56 0.74 0.00 2.34 0.00 0.00 41.12 43.18 1rla n ASP 237 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1rla h PRO 238 N 1.84 0.00 -0.07 -0.67 0.11 -1.80 0.96 132.00 132.37 1rla h PRO 238 Ca -0.50 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 1rla h PRO 238 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1rla h PRO 238 CO 0.59 0.00 -0.34 0.28 -0.21 0.00 0.00 178.00 178.31 1rla h VAL 239 N 0.00 1.27 0.03 3.15 2.07 -1.97 -2.61 116.25 118.20 1rla h VAL 239 Ca 0.00 -1.29 -0.39 0.00 0.82 0.00 0.00 66.70 65.84 1rla h VAL 239 Cb 0.28 1.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.59 1rla h VAL 239 CO 0.00 0.38 -2.33 0.49 0.02 0.00 0.00 177.57 176.13 1rla n PHE 240 N -4.10 0.34 -3.32 1.57 3.72 0.27 -4.70 117.46 111.24 1rla n PHE 240 Ca -0.01 0.08 -0.26 0.00 -0.05 0.00 0.00 57.45 57.20 1rla n PHE 240 Cb 0.41 -1.04 -0.07 0.00 -0.94 0.00 0.00 39.48 37.84 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 -3.44 1.97 0.18 4.37 -2.24 -0.82 -3.77 114.28 110.53 1rla n THR 241 Ca -0.43 -5.09 0.04 0.00 -2.27 0.00 0.00 64.05 56.31 1rla n THR 241 Cb 0.98 -1.94 0.34 0.00 -2.10 0.00 0.00 70.33 67.61 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 3.96 0.00 -3.24 -0.78 0.13 -1.71 -3.38 132.00 126.98 1rla h PRO 242 Ca 0.17 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.61 1rla h PRO 242 Cb 0.68 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.79 1rla h PRO 242 CO 0.77 0.40 3.40 0.00 -0.23 0.00 0.00 178.00 182.35 1rla n ALA 243 N -2.36 6.84 -2.27 -0.56 0.00 -1.26 -4.84 120.51 116.07 1rla n ALA 243 Ca -0.01 -3.73 -0.15 0.00 0.00 0.00 0.00 53.44 49.55 1rla n ALA 243 Cb 0.49 -3.33 -0.10 0.00 0.00 0.00 0.00 19.45 16.51 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 1.94 0.74 0.04 0.00 -4.23 -1.26 -0.70 115.64 112.16 1rla s THR 244 Ca 0.60 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.24 1rla s THR 244 Cb 0.17 -2.24 -0.02 0.00 1.34 0.00 0.00 72.50 71.74 1rla s THR 244 CO -0.07 -0.38 1.46 1.23 -0.54 0.00 0.00 174.62 176.32 1rla h GLY 245 N 2.60 0.00 -5.96 3.99 0.00 -1.90 -3.39 103.07 98.42 1rla h GLY 245 Ca -0.37 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.40 1rla h GLY 245 CO 0.63 0.00 -0.96 2.41 0.00 0.00 0.00 176.54 178.61 1rla n THR 246 N -3.38 0.53 -2.37 4.70 -1.04 -1.26 -5.10 114.28 106.37 1rla n THR 246 Ca 0.01 -4.59 -0.41 0.00 -2.04 0.00 0.00 64.05 57.02 1rla n THR 246 Cb 0.75 -1.54 -0.03 0.00 -1.82 0.00 0.00 70.33 67.69 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 -2.02 4.51 -0.10 -2.82 0.04 -1.26 -4.93 135.00 128.42 1rla s PRO 247 Ca 0.39 1.90 0.00 0.00 0.04 0.00 0.00 61.00 63.33 1rla s PRO 247 Cb 0.22 -3.21 0.02 0.00 0.04 0.00 0.00 34.50 31.57 1rla s PRO 247 CO -0.08 -0.03 -0.10 0.08 0.04 0.00 0.00 177.00 176.91 1rla s VAL 248 N -0.43 1.13 0.71 -0.36 1.01 -1.26 -5.04 120.40 116.16 1rla s VAL 248 Ca 0.50 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.94 1rla s VAL 248 Cb -0.33 -1.10 0.03 0.00 0.00 0.00 0.00 36.38 34.97 1rla s VAL 248 CO 0.39 0.38 1.20 0.68 0.00 0.00 0.00 175.10 177.75 1rla s VAL 249 N 1.37 2.44 0.00 2.92 -7.23 -1.26 -4.08 120.40 114.56 1rla s VAL 249 Ca -0.01 0.22 0.00 0.00 -1.81 0.00 0.00 61.98 60.38 1rla s VAL 249 Cb -0.14 -2.81 0.00 0.00 0.56 0.00 0.00 36.38 34.00 1rla s VAL 249 CO -0.05 -0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 1rla n GLY 250 N 0.30 0.88 0.00 2.32 0.00 -1.26 -5.05 105.19 102.38 1rla n GLY 250 Ca 0.13 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.56 1.20 3.77 -0.02 0.00 -1.26 -4.95 105.19 103.37 1rla n GLY 251 Ca 0.00 -1.99 -0.37 0.00 0.00 0.00 0.00 46.02 43.66 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 3.99 0.59 0.99 1.43 -1.00 -4.41 118.68 120.28 1rla s LEU 252 Ca 0.00 2.32 -0.04 0.00 -1.03 0.00 0.00 54.13 55.39 1rla s LEU 252 Cb 0.00 -4.26 0.03 0.00 0.03 0.00 0.00 46.19 41.99 1rla s LEU 252 CO 0.00 -0.96 0.88 -0.94 0.23 0.00 0.00 176.35 175.55 1rla s SER 253 N -1.35 5.35 0.24 2.29 1.04 -1.26 -0.56 113.70 119.44 1rla s SER 253 Ca 0.64 0.44 -0.05 0.00 0.48 0.00 0.00 55.95 57.47 1rla s SER 253 Cb -0.29 -1.36 0.38 0.00 0.10 0.00 0.00 66.02 64.85 1rla s SER 253 CO 0.35 -1.18 1.81 0.22 0.98 0.00 0.00 173.24 175.42 1rla h TYR 254 N -0.17 0.81 -0.30 5.02 3.20 -1.95 -0.06 116.97 123.52 1rla h TYR 254 Ca -0.45 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1rla h TYR 254 Cb 1.28 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 1rla h TYR 254 CO 0.41 0.33 0.19 0.00 -1.64 0.00 0.00 178.16 177.45 1rla h ARG 255 N 0.76 0.40 -0.54 1.82 3.08 -1.99 -1.23 114.38 116.67 1rla h ARG 255 Ca 0.38 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 60.30 1rla h ARG 255 Cb 0.35 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1rla h ARG 255 CO -0.25 0.29 -0.07 0.93 -1.07 0.00 0.00 179.97 179.80 1rla h GLU 256 N 0.39 0.98 -0.24 0.04 5.08 -1.73 -0.01 114.58 119.09 1rla h GLU 256 Ca 0.11 -0.34 0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1rla h GLU 256 Cb -0.01 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1rla h GLU 256 CO -0.02 1.01 0.10 0.78 -1.00 0.00 0.00 179.01 179.88 1rla h GLY 257 N 0.97 0.30 1.39 -3.84 0.00 -0.84 -0.74 103.07 100.31 1rla h GLY 257 Ca 0.15 -0.07 -0.06 0.00 0.00 0.00 0.00 47.33 47.34 1rla h GLY 257 CO 0.04 0.05 0.02 1.41 0.00 0.00 0.00 176.54 178.06 1rla h LEU 258 N 0.22 0.71 -1.10 3.11 3.38 -0.99 -2.44 115.31 118.21 1rla h LEU 258 Ca 0.10 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1rla h LEU 258 Cb 0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1rla h LEU 258 CO -0.09 0.76 0.11 0.22 0.09 0.00 0.00 178.44 179.54 1rla h TYR 259 N 0.70 0.77 0.12 1.13 3.20 -0.52 -0.02 116.97 122.36 1rla h TYR 259 Ca 0.14 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1rla h TYR 259 Cb 0.40 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1rla h TYR 259 CO 0.02 0.66 -0.06 0.82 -1.64 0.00 0.00 178.16 177.96 1rla h ILE 260 N 0.73 1.00 -0.58 1.81 2.04 -0.69 -2.17 117.51 119.64 1rla h ILE 260 Ca 0.16 -0.45 -0.06 0.00 1.00 0.00 0.00 64.86 65.51 1rla h ILE 260 Cb 0.29 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 1rla h ILE 260 CO -0.00 0.11 0.12 0.71 0.00 0.00 0.00 178.15 179.09 1rla h THR 261 N -0.37 1.24 -0.80 -0.27 1.35 -1.27 -1.92 112.91 110.88 1rla h THR 261 Ca -0.02 -0.88 -0.05 0.00 -0.55 0.00 0.00 66.41 64.92 1rla h THR 261 Cb 0.30 0.66 -0.04 0.00 -1.73 0.00 0.00 68.15 67.35 1rla h THR 261 CO 0.03 0.33 0.32 -0.33 -0.25 0.00 0.00 175.52 175.61 1rla h GLU 262 N 0.86 1.19 -0.22 4.72 5.08 -0.99 0.15 114.58 125.38 1rla h GLU 262 Ca 0.18 -0.22 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 1rla h GLU 262 Cb 0.34 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1rla h GLU 262 CO 0.00 0.96 -0.45 0.93 -1.00 0.00 0.00 179.01 179.46 1rla h GLU 263 N 1.16 0.54 -0.36 2.33 4.39 -1.10 -2.39 114.58 119.14 1rla h GLU 263 Ca 0.27 -0.29 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 1rla h GLU 263 Cb 0.22 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1rla h GLU 263 CO -0.02 0.88 -0.10 0.82 -1.16 0.00 0.00 179.01 179.43 1rla h ILE 264 N 0.44 1.28 -0.84 3.13 2.04 -1.01 -2.59 117.51 119.95 1rla h ILE 264 Ca 0.03 -1.17 0.09 0.00 1.00 0.00 0.00 64.86 64.81 1rla h ILE 264 Cb 0.96 1.30 -0.07 0.00 -0.74 0.00 0.00 36.82 38.26 1rla h ILE 264 CO 0.09 0.39 0.50 0.22 0.00 0.00 0.00 178.15 179.34 1rla h TYR 265 N 0.49 0.90 0.00 1.37 3.20 -0.89 -1.75 116.97 120.29 1rla h TYR 265 Ca 0.09 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1rla h TYR 265 Cb 0.61 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1rla h TYR 265 CO 0.05 0.39 0.00 0.87 -1.64 0.00 0.00 178.16 177.83 1rla h LYS 266 N 0.84 0.00 0.00 1.82 1.57 -1.04 -2.36 116.57 117.40 1rla h LYS 266 Ca 0.40 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.11 1rla h LYS 266 Cb 0.33 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 1rla h LYS 266 CO -0.23 0.00 -0.32 1.79 -0.57 0.00 0.00 179.45 180.12 1rla h THR 267 N 0.00 0.72 0.00 -0.16 1.35 -1.11 -3.46 112.91 110.25 1rla h THR 267 Ca 0.00 -1.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.43 1rla h THR 267 Cb 0.18 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 1rla h THR 267 CO 0.00 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 1rla n GLY 268 N 0.35 0.56 0.63 5.82 0.00 -0.89 -4.89 105.19 106.76 1rla n GLY 268 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.10 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 2.37 -4.68 0.99 4.77 -1.26 -4.99 117.00 114.19 1rla n LEU 269 Ca 0.00 -1.14 -0.42 0.00 -0.03 0.00 0.00 56.01 54.42 1rla n LEU 269 Cb 0.06 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1rla n LEU 269 CO 0.00 0.46 1.51 -0.22 -1.33 0.00 0.00 177.39 177.81 1rla s LEU 270 N -1.20 4.41 0.00 2.23 2.96 -1.26 -1.16 118.68 124.66 1rla s LEU 270 Ca 0.19 2.76 0.00 0.00 -0.22 0.00 0.00 54.13 56.86 1rla s LEU 270 Cb 0.13 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.26 1rla s LEU 270 CO 0.19 -1.02 0.00 -0.24 -1.32 0.00 0.00 176.35 173.95 1rla n SER 271 N 6.14 4.58 -3.83 3.68 2.88 0.05 -4.85 113.62 122.26 1rla n SER 271 Ca 0.18 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.60 1rla n SER 271 Cb 0.39 0.43 -0.10 0.00 -0.75 0.00 0.00 64.21 64.18 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 -2.93 -0.05 -0.00 0.46 0.00 -0.96 -2.87 107.32 100.96 1rla s GLY 272 Ca 0.00 0.17 -0.02 0.00 0.00 0.00 0.00 44.72 44.87 1rla s GLY 272 CO 0.00 0.04 0.04 -2.27 0.00 0.00 0.00 173.10 170.91 1rla s LEU 273 N -0.88 1.91 -0.06 0.66 0.20 -0.35 -0.73 118.68 119.43 1rla s LEU 273 Ca -0.10 -0.14 0.03 0.00 0.69 0.00 0.00 54.13 54.61 1rla s LEU 273 Cb -0.05 0.23 0.01 0.00 -0.43 0.00 0.00 46.19 45.95 1rla s LEU 273 CO 0.02 -0.16 -0.13 -1.81 -0.29 0.00 0.00 176.35 173.98 1rla s ASP 274 N -0.68 1.76 -0.43 3.68 1.01 0.02 -0.86 116.67 121.18 1rla s ASP 274 Ca -0.08 -0.29 0.01 0.00 0.71 0.00 0.00 52.55 52.90 1rla s ASP 274 Cb -0.05 -0.74 0.12 0.00 1.01 0.00 0.00 42.92 43.26 1rla s ASP 274 CO -0.00 0.05 0.19 -0.63 0.21 0.00 0.00 175.17 174.99 1rla s ILE 275 N 0.53 2.83 0.29 0.77 -1.09 -0.18 -0.65 121.20 123.70 1rla s ILE 275 Ca -0.12 -2.53 0.08 0.00 -2.23 0.00 0.00 60.65 55.85 1rla s ILE 275 Cb -0.14 -2.98 -0.04 0.00 -1.58 0.00 0.00 42.46 37.72 1rla s ILE 275 CO 0.03 -0.70 0.14 -0.04 -1.23 0.00 0.00 174.94 173.14 1rla s MET 276 N 0.62 2.55 -1.16 2.79 -1.94 0.04 -1.22 119.30 120.99 1rla s MET 276 Ca 0.12 -1.34 0.00 0.00 -1.71 0.00 0.00 55.69 52.76 1rla s MET 276 Cb -0.22 -2.32 0.00 0.00 2.01 0.00 0.00 34.83 34.30 1rla s MET 276 CO -0.05 0.26 0.00 0.39 -0.01 0.00 0.00 175.02 175.61 1rla n GLU 277 N -1.12 -0.83 -2.78 2.03 -0.58 -0.35 -2.02 120.64 115.00 1rla n GLU 277 Ca -0.05 0.82 -0.43 0.00 -0.42 0.00 0.00 57.16 57.08 1rla n GLU 277 Cb 0.59 -4.84 -0.03 0.00 -0.57 0.00 0.00 31.44 26.59 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 -2.46 4.60 -0.40 2.62 1.01 -1.26 -4.40 120.40 120.11 1rla s VAL 278 Ca 0.00 1.38 0.01 0.00 0.00 0.00 0.00 61.98 63.37 1rla s VAL 278 Cb 0.00 -4.32 0.11 0.00 0.00 0.00 0.00 36.38 32.17 1rla s VAL 278 CO 0.00 -0.46 0.14 0.21 0.00 0.00 0.00 175.10 175.00 1rla s ASN 279 N 1.75 4.93 0.57 3.32 3.84 0.12 -4.08 114.94 125.39 1rla s ASN 279 Ca 0.39 -2.23 0.27 0.00 0.21 0.00 0.00 52.86 51.51 1rla s ASN 279 Cb -0.12 -1.71 1.55 0.00 -0.55 0.00 0.00 41.25 40.41 1rla s ASN 279 CO 0.16 -0.43 2.06 -0.65 -2.79 0.00 0.00 177.10 175.46 1rla h PRO 280 N 7.64 0.00 -0.00 0.43 0.11 -1.78 -2.00 132.00 136.39 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 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1rla h PRO 280 CO 0.61 0.00 -0.08 0.25 -0.21 0.00 0.00 178.00 178.56 1rla n THR 281 N -3.98 0.00 0.52 -1.15 -2.24 -1.26 -3.68 114.28 102.48 1rla n THR 281 Ca 0.04 -0.05 0.11 0.00 -2.27 0.00 0.00 64.05 61.88 1rla n THR 281 Cb 0.40 -0.18 0.27 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.01 2.86 -4.71 3.22 4.77 -0.75 -4.90 117.00 116.47 1rla n LEU 282 Ca 0.15 -1.29 -0.42 0.00 -0.03 0.00 0.00 56.01 54.42 1rla n LEU 282 Cb 0.26 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1rla n LEU 282 CO 0.23 0.65 0.71 -0.83 -1.33 0.00 0.00 177.39 176.82 1rla s GLY 283 N -1.35 2.80 0.45 -0.72 0.00 -1.24 -4.67 107.32 102.59 1rla s GLY 283 Ca 0.37 0.55 0.21 0.00 0.00 0.00 0.00 44.72 45.84 1rla s GLY 283 CO 0.28 1.75 1.95 0.50 0.00 0.00 0.00 173.10 177.58 1rla h LYS 284 N 6.84 0.00 -4.19 2.90 1.57 -1.93 -3.44 116.57 118.31 1rla h LYS 284 Ca -0.40 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.23 1rla h LYS 284 Cb 1.21 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.35 1rla h LYS 284 CO 0.77 0.22 -0.69 0.95 -0.57 0.00 0.00 179.45 180.13 1rla s THR 285 N -4.16 0.22 0.31 -0.16 -4.23 -1.26 -5.03 115.64 101.33 1rla s THR 285 Ca -0.02 -1.49 0.03 0.00 -1.18 0.00 0.00 61.69 59.02 1rla s THR 285 Cb 0.13 -1.08 0.29 0.00 1.34 0.00 0.00 72.50 73.19 1rla s THR 285 CO 0.65 -0.80 1.89 -0.65 -0.54 0.00 0.00 174.62 175.16 1rla h PRO 286 N 3.68 0.90 -0.23 3.99 0.11 -1.99 0.11 132.00 138.57 1rla h PRO 286 Ca -0.33 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1rla h PRO 286 Cb 1.17 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1rla h PRO 286 CO 0.57 0.59 0.15 1.49 -0.21 0.00 0.00 178.00 180.59 1rla h GLU 287 N 0.92 0.29 -0.41 1.05 4.57 -1.97 -0.30 114.58 118.73 1rla h GLU 287 Ca 0.43 -0.02 -0.11 0.00 -1.18 0.00 0.00 59.36 58.48 1rla h GLU 287 Cb 0.40 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 1rla h GLU 287 CO -0.19 0.19 -0.19 0.93 -1.18 0.00 0.00 179.01 178.57 1rla h GLU 288 N 0.30 0.80 -0.32 1.92 5.08 -1.36 0.25 114.58 121.25 1rla h GLU 288 Ca 0.09 -0.31 -0.12 0.00 -1.00 0.00 0.00 59.36 58.02 1rla h GLU 288 Cb -0.02 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1rla h GLU 288 CO -0.02 0.93 -0.25 0.28 -1.00 0.00 0.00 179.01 178.95 1rla h VAL 289 N 0.70 1.29 -0.37 3.13 2.07 -1.18 -2.25 116.25 119.64 1rla h VAL 289 Ca 0.10 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.22 1rla h VAL 289 Cb 0.70 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1rla h VAL 289 CO 0.05 0.45 0.24 0.74 0.02 0.00 0.00 177.57 179.08 1rla h THR 290 N 0.49 1.10 -0.24 2.57 2.02 -0.74 -0.73 112.91 117.37 1rla h THR 290 Ca 0.06 -0.18 0.03 0.00 0.77 0.00 0.00 66.41 67.09 1rla h THR 290 Cb 0.81 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.75 1rla h THR 290 CO 0.07 0.09 0.08 -0.09 0.37 0.00 0.00 175.52 176.04 1rla h ARG 291 N 0.50 0.18 0.45 6.66 2.43 -0.47 -0.59 114.38 123.54 1rla h ARG 291 Ca 0.13 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1rla h ARG 291 Cb -0.06 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1rla h ARG 291 CO -0.03 0.12 -0.22 1.15 -1.51 0.00 0.00 179.97 179.48 1rla h THR 292 N 0.19 0.55 -0.11 0.20 2.02 -1.05 -2.09 112.91 112.61 1rla h THR 292 Ca 0.11 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.32 1rla h THR 292 Cb 0.08 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 1rla h THR 292 CO -0.11 0.00 -0.08 0.58 0.37 0.00 0.00 175.52 176.28 1rla h VAL 293 N -0.61 0.76 -0.84 3.16 2.07 -1.09 -2.09 116.25 117.61 1rla h VAL 293 Ca -0.06 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.58 1rla h VAL 293 Cb 0.47 0.76 -0.08 0.00 -1.52 0.00 0.00 31.29 30.92 1rla h VAL 293 CO 0.09 0.00 0.46 0.78 0.02 0.00 0.00 177.57 178.92 1rla h ASN 294 N -0.08 0.60 0.62 0.57 2.35 -1.03 -0.23 115.58 118.38 1rla h ASN 294 Ca 0.07 0.07 -0.14 0.00 -0.55 0.00 0.00 56.30 55.75 1rla h ASN 294 Cb 0.19 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1rla h ASN 294 CO -0.16 0.30 -0.66 0.00 -1.65 0.00 0.00 177.43 175.25 1rla h THR 295 N 0.70 1.46 -0.21 2.81 1.03 -1.00 -1.88 112.91 115.83 1rla h THR 295 Ca 0.44 -2.24 -0.02 0.00 -0.01 0.00 0.00 66.41 64.58 1rla h THR 295 Cb 0.53 2.20 -0.01 0.00 -1.07 0.00 0.00 68.15 69.80 1rla h THR 295 CO -0.31 0.64 0.06 0.00 -0.01 0.00 0.00 175.52 175.90 1rla h ALA 296 N 1.31 0.27 -0.23 0.00 0.00 -0.49 -0.45 119.26 119.67 1rla h ALA 296 Ca -0.01 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.79 1rla h ALA 296 Cb 1.17 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1rla h ALA 296 CO 0.09 -0.10 0.06 0.28 0.00 0.00 0.00 179.25 179.58 1rla h VAL 297 N 0.16 0.92 -0.94 0.00 2.07 -1.04 -1.77 116.25 115.65 1rla h VAL 297 Ca 0.07 -0.06 0.07 0.00 0.82 0.00 0.00 66.70 67.60 1rla h VAL 297 Cb 0.24 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 1rla h VAL 297 CO -0.00 0.03 0.61 0.00 0.02 0.00 0.00 177.57 178.23 1rla h ALA 298 N 1.15 1.48 -0.43 1.67 0.00 -0.86 -0.24 119.26 122.03 1rla h ALA 298 Ca 0.10 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1rla h ALA 298 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1rla h ALA 298 CO -0.12 0.38 -0.20 -0.07 0.00 0.00 0.00 179.25 179.24 1rla h LEU 299 N 1.08 0.92 0.14 0.00 3.38 -0.79 -1.83 115.31 118.21 1rla h LEU 299 Ca 0.41 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1rla h LEU 299 Cb 0.20 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1rla h LEU 299 CO -0.16 1.12 -0.07 0.74 0.09 0.00 0.00 178.44 180.16 1rla h THR 300 N 0.72 0.93 -0.88 0.22 2.02 -0.40 -1.94 112.91 113.57 1rla h THR 300 Ca 0.10 -0.25 0.06 0.00 0.77 0.00 0.00 66.41 67.09 1rla h THR 300 Cb 0.77 1.09 -0.06 0.00 -1.74 0.00 0.00 68.15 68.21 1rla h THR 300 CO 0.06 0.06 0.58 -0.07 0.37 0.00 0.00 175.52 176.52 1rla h LEU 301 N -0.30 0.88 -1.23 2.58 3.38 -1.09 -0.87 115.31 118.66 1rla h LEU 301 Ca -0.02 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1rla h LEU 301 Cb 0.24 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1rla h LEU 301 CO 0.03 0.56 -0.05 -1.28 0.09 0.00 0.00 178.44 177.79 1rla h SER 302 N 0.99 0.44 0.16 -0.43 0.87 -0.97 -1.36 113.55 113.25 1rla h SER 302 Ca 0.38 -0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.82 1rla h SER 302 Cb 0.21 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1rla h SER 302 CO -0.14 0.55 -0.16 0.00 -0.53 0.00 0.00 176.83 176.55 1rla n PHE 304 N -4.34 2.59 0.00 0.00 3.72 -0.55 -4.37 117.46 114.51 1rla n PHE 304 Ca -0.03 -1.74 0.00 0.00 -0.05 0.00 0.00 57.45 55.64 1rla n PHE 304 Cb 0.22 -0.83 0.00 0.00 -0.94 0.00 0.00 39.48 37.94 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 -1.06 2.62 3.65 1.37 0.00 -1.00 -4.75 105.19 106.02 1rla n GLY 305 Ca 0.52 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.52 3.65 0.07 2.61 2.01 -0.95 -4.98 115.64 115.52 1rla s THR 306 Ca 0.00 0.76 0.02 0.00 0.31 0.00 0.00 61.69 62.78 1rla s THR 306 Cb 0.00 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1rla s THR 306 CO 0.00 -0.16 0.10 -0.54 -0.69 0.00 0.00 174.62 173.33 1rla s LYS 307 N 4.35 2.99 0.34 4.92 1.02 -1.26 -4.29 119.74 127.80 1rla s LYS 307 Ca 0.72 -0.63 0.16 0.00 0.02 0.00 0.00 55.97 56.25 1rla s LYS 307 Cb -0.29 -2.79 0.54 0.00 -0.52 0.00 0.00 37.83 34.77 1rla s LYS 307 CO 0.29 0.58 1.67 0.00 -0.92 0.00 0.00 175.35 176.97 1rla h ARG 308 N 3.34 0.00 0.00 1.68 3.08 -1.99 -2.50 114.38 117.99 1rla h ARG 308 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1rla h ARG 308 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1rla h ARG 308 CO 0.67 0.45 0.00 1.05 -1.07 0.00 0.00 179.97 181.08 1rla h GLU 309 N 0.00 0.00 0.00 0.04 4.11 -2.01 -3.48 114.58 113.24 1rla h GLU 309 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1rla h GLU 309 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1rla h GLU 309 CO 0.06 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.55 1rla n GLY 310 N 0.31 2.21 3.07 1.06 0.00 -0.94 -5.10 105.19 105.79 1rla n GLY 310 Ca 0.02 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.09 -0.01 1.61 0.01 -1.26 -4.54 114.94 110.66 1rla s ASN 311 Ca 0.00 0.11 -0.00 0.00 -0.71 0.00 0.00 52.86 52.26 1rla s ASN 311 Cb 0.00 0.28 0.00 0.00 0.41 0.00 0.00 41.25 41.95 1rla s ASN 311 CO 0.00 -0.19 0.01 -1.38 -1.51 0.00 0.00 177.10 174.03 1rla s HIS 312 N -0.53 -0.01 0.22 2.20 -3.43 -1.26 -5.13 115.29 107.36 1rla s HIS 312 Ca -0.06 0.04 -0.30 0.00 -0.80 0.00 0.00 55.06 53.94 1rla s HIS 312 Cb -0.04 -0.02 -0.10 0.00 -1.43 0.00 0.00 32.58 30.99 1rla s HIS 312 CO 0.01 -0.02 1.42 0.21 -2.00 0.00 0.00 174.74 174.37 1rla s LYS 313 N 0.13 4.29 0.56 -0.38 2.20 -1.26 -4.98 119.74 120.30 1rla s LYS 313 Ca -0.01 2.24 -0.20 0.00 -0.36 0.00 0.00 55.97 57.64 1rla s LYS 313 Cb -0.02 -3.14 -0.04 0.00 -1.51 0.00 0.00 37.83 33.12 1rla s LYS 313 CO -0.00 -0.41 1.28 -2.14 -0.36 0.00 0.00 175.35 173.72 1rla s PRO 314 N -0.04 3.07 0.00 4.03 0.02 -1.26 -3.11 135.00 137.71 1rla s PRO 314 Ca 0.60 2.03 0.00 0.00 0.02 0.00 0.00 61.00 63.66 1rla s PRO 314 Cb -0.41 -2.12 0.00 0.00 0.02 0.00 0.00 34.50 32.00 1rla s PRO 314 CO 0.40 -1.18 0.00 0.39 -0.33 0.00 0.00 177.00 176.28 1rla n GLU 315 N -1.26 -0.05 -3.33 5.54 1.02 -1.26 -4.97 120.64 116.32 1rla n GLU 315 Ca 0.12 0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.84 1rla n GLU 315 Cb 0.47 -3.52 -0.09 0.00 -0.02 0.00 0.00 31.44 28.29 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 -2.46 5.10 -0.69 2.62 2.01 -1.18 -5.01 115.64 116.03 1rla s THR 316 Ca 0.00 -0.34 -0.25 0.00 0.31 0.00 0.00 61.69 61.40 1rla s THR 316 Cb 0.00 -4.02 0.05 0.00 0.01 0.00 0.00 72.50 68.54 1rla s THR 316 CO 0.00 -0.40 1.14 -0.62 -0.69 0.00 0.00 174.62 174.05 1rla s ASP 317 N 1.80 6.20 0.00 3.53 2.15 -1.26 -4.87 116.67 124.22 1rla s ASP 317 Ca 0.12 -0.60 0.19 0.00 0.43 0.00 0.00 52.55 52.69 1rla s ASP 317 Cb -0.17 -2.50 1.10 0.00 -0.30 0.00 0.00 42.92 41.04 1rla s ASP 317 CO 0.13 -1.63 1.55 -1.22 -0.17 0.00 0.00 175.17 173.83 1rla n TYR 318 N 8.58 0.00 0.39 -5.34 4.02 -1.26 -5.26 117.16 118.30 1rla n TYR 318 Ca 0.01 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.95 1rla n TYR 318 Cb 0.48 -0.08 0.04 0.00 -0.02 0.00 0.00 39.34 39.76 1rla n TYR 318 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13