#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4rla s PRO 7 N 0.00 3.54 -0.00 1.97 0.04 -1.26 -4.28 135.00 135.01 4rla s PRO 7 Ca 0.00 0.87 0.04 0.00 0.04 0.00 0.00 61.00 61.95 4rla s PRO 7 Cb 0.00 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.44 4rla s PRO 7 CO 0.00 -0.61 -0.11 0.42 0.04 0.00 0.00 177.00 176.74 4rla s ILE 8 N -2.96 3.34 -0.27 0.56 1.01 0.12 -0.89 121.20 122.11 4rla s ILE 8 Ca 0.57 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 60.39 4rla s ILE 8 Cb -0.12 -2.41 0.08 0.00 0.01 0.00 0.00 42.46 40.02 4rla s ILE 8 CO 0.47 0.44 0.02 -0.70 0.00 0.00 0.00 174.94 175.17 4rla s GLU 9 N -1.23 1.22 0.08 2.79 2.56 0.43 -1.22 118.70 123.33 4rla s GLU 9 Ca 0.15 -1.10 -0.30 0.00 0.00 0.00 0.00 54.97 53.72 4rla s GLU 9 Cb -0.11 -2.46 -0.05 0.00 2.00 0.00 0.00 34.13 33.51 4rla s GLU 9 CO 0.05 -0.78 1.00 0.42 -0.56 0.00 0.00 175.26 175.40 4rla s ILE 10 N 1.43 4.49 -0.09 -3.70 1.09 0.23 -1.28 121.20 123.37 4rla s ILE 10 Ca 0.02 1.96 -0.00 0.00 -1.10 0.00 0.00 60.65 61.53 4rla s ILE 10 Cb -0.18 -4.25 0.03 0.00 -1.06 0.00 0.00 42.46 36.99 4rla s ILE 10 CO -0.12 0.25 -0.04 -0.63 -0.10 0.00 0.00 174.94 174.29 4rla s ILE 11 N 0.35 0.71 -0.09 2.92 1.01 0.34 -0.65 121.20 125.80 4rla s ILE 11 Ca 0.50 -0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.84 4rla s ILE 11 Cb -0.24 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 4rla s ILE 11 CO 0.30 0.31 0.52 -0.83 0.00 0.00 0.00 174.94 175.24 4rla s GLY 12 N 1.67 2.47 -0.67 6.18 0.00 -0.51 -1.01 107.32 115.45 4rla s GLY 12 Ca 0.02 -0.11 0.05 0.00 0.00 0.00 0.00 44.72 44.68 4rla s GLY 12 CO -0.05 0.80 0.55 0.00 0.00 0.00 0.00 173.10 174.39 4rla n ALA 13 N 3.45 3.53 -1.46 3.20 0.00 -0.37 -2.01 120.51 126.86 4rla n ALA 13 Ca -0.07 -4.50 -0.42 0.00 0.00 0.00 0.00 53.44 48.46 4rla n ALA 13 Cb 0.52 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.96 4rla n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 4rla n PRO 14 N 1.72 2.30 -4.57 0.00 -0.04 -1.26 -3.25 135.00 129.90 4rla n PRO 14 Ca 0.23 -2.25 -0.27 0.00 -0.04 0.00 0.00 63.50 61.17 4rla n PRO 14 Cb 0.37 -3.10 -0.14 0.00 -0.04 0.00 0.00 33.50 30.59 4rla n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 4rla s PHE 15 N 3.91 2.05 0.00 0.54 5.36 -1.26 -4.68 117.98 123.90 4rla s PHE 15 Ca 0.52 -0.39 0.00 0.00 -0.96 0.00 0.00 56.93 56.09 4rla s PHE 15 Cb 0.14 -1.17 0.00 0.00 -0.34 0.00 0.00 43.02 41.65 4rla s PHE 15 CO -0.00 0.18 0.10 -1.13 -1.46 0.00 0.00 175.22 172.91 4rla n SER 16 N 1.45 0.00 0.00 6.13 3.41 -1.26 -2.42 113.62 120.93 4rla n SER 16 Ca -0.18 -1.00 0.04 0.00 -0.26 0.00 0.00 58.87 57.47 4rla n SER 16 Cb 0.53 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.69 4rla n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 4rla n LYS 17 N 0.00 0.25 0.00 4.33 4.01 -1.26 -2.00 118.16 123.50 4rla n LYS 17 Ca 0.00 0.00 0.15 0.00 -0.51 0.00 0.00 58.31 57.95 4rla n LYS 17 Cb 0.30 -1.43 0.73 0.00 -0.51 0.00 0.00 35.03 34.12 4rla n LYS 17 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 4rla n GLY 18 N -0.46 -0.75 3.28 0.72 0.00 -1.26 -4.71 105.19 102.02 4rla n GLY 18 Ca 0.05 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 4rla n GLY 18 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 4rla s GLN 19 N -2.17 0.98 0.00 1.61 -2.07 -0.84 -0.09 119.66 117.07 4rla s GLN 19 Ca 0.39 -0.71 0.00 0.00 -1.82 0.00 0.00 55.36 53.22 4rla s GLN 19 Cb 0.21 0.42 0.00 0.00 -1.09 0.00 0.00 33.01 32.55 4rla s GLN 19 CO 0.40 -0.36 0.57 -0.35 -1.32 0.00 0.00 175.29 174.23 4rla n PRO 20 N -0.04 0.00 -2.76 9.60 -0.04 -1.26 -4.71 135.00 135.79 4rla n PRO 20 Ca -0.16 0.35 -0.38 0.00 -0.04 0.00 0.00 63.50 63.27 4rla n PRO 20 Cb 0.63 -1.07 -0.06 0.00 -0.04 0.00 0.00 33.50 32.95 4rla n PRO 20 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 4rla s ARG 21 N -1.30 4.70 0.83 0.54 1.04 -1.26 -5.03 118.95 118.48 4rla s ARG 21 Ca 0.00 1.41 -0.14 0.00 -1.04 0.00 0.00 55.73 55.96 4rla s ARG 21 Cb 0.00 -3.02 0.19 0.00 -2.04 0.00 0.00 34.95 30.08 4rla s ARG 21 CO 0.00 0.38 1.12 0.41 -0.04 0.00 0.00 175.30 177.17 4rla n GLY 22 N 0.98 -1.50 0.00 3.88 0.00 -1.26 -4.75 105.19 102.55 4rla n GLY 22 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.33 4rla n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4rla n GLY 23 N -2.39 4.15 0.35 -0.02 0.00 -1.26 -4.95 105.19 101.07 4rla n GLY 23 Ca 0.14 -0.83 0.17 0.00 0.00 0.00 0.00 46.02 45.50 4rla n GLY 23 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 4rla h VAL 24 N 0.00 0.80 0.00 1.61 2.07 -1.85 0.00 116.25 118.88 4rla h VAL 24 Ca 0.00 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.51 4rla h VAL 24 Cb 0.00 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 4rla h VAL 24 CO 0.00 0.01 0.00 1.05 0.02 0.00 0.00 177.57 178.65 4rla h GLU 25 N 0.04 0.00 -0.00 1.57 9.09 -1.84 -0.23 114.58 123.21 4rla h GLU 25 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 4rla h GLU 25 Cb 0.77 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.87 4rla h GLU 25 CO -0.01 0.00 -0.34 1.63 0.05 0.00 0.00 179.01 180.34 4rla n LYS 26 N -2.67 0.33 -0.07 1.06 5.02 -0.01 -4.46 118.16 117.36 4rla n LYS 26 Ca -0.01 -0.18 -0.11 0.00 -2.02 0.00 0.00 58.31 55.99 4rla n LYS 26 Cb 0.12 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.56 4rla n LYS 26 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 4rla h GLY 27 N 4.97 -1.23 0.47 0.72 0.00 -1.15 -1.74 103.07 105.11 4rla h GLY 27 Ca 0.00 0.72 0.19 0.00 0.00 0.00 0.00 47.33 48.25 4rla h GLY 27 CO 0.00 -0.28 0.55 -0.56 0.00 0.00 0.00 176.54 176.26 4rla h PRO 28 N -0.36 0.27 -0.25 4.80 0.13 -1.77 -0.85 132.00 133.97 4rla h PRO 28 Ca 0.04 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 65.10 4rla h PRO 28 Cb 0.48 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.54 4rla h PRO 28 CO -0.41 0.18 -0.08 0.00 -0.23 0.00 0.00 178.00 177.46 4rla h ALA 29 N 1.63 0.35 -0.43 -0.56 0.00 -1.62 -0.88 119.26 117.74 4rla h ALA 29 Ca 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 4rla h ALA 29 Cb 1.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 4rla h ALA 29 CO -0.11 0.17 0.21 0.00 0.00 0.00 0.00 179.25 179.52 4rla h ALA 30 N 0.75 0.55 -0.50 0.00 0.00 -0.52 0.44 119.26 119.98 4rla h ALA 30 Ca 0.06 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 4rla h ALA 30 Cb 0.56 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 4rla h ALA 30 CO 0.03 0.12 0.14 -0.07 0.00 0.00 0.00 179.25 179.46 4rla h LEU 31 N 0.55 0.75 -0.62 0.00 3.38 -1.17 -1.23 115.31 116.98 4rla h LEU 31 Ca 0.15 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 4rla h LEU 31 Cb 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 4rla h LEU 31 CO -0.02 0.78 0.04 0.03 0.09 0.00 0.00 178.44 179.35 4rla h ARG 32 N 0.69 1.06 0.00 1.13 3.08 -0.99 -2.60 114.38 116.75 4rla h ARG 32 Ca 0.16 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 4rla h ARG 32 Cb 0.31 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 4rla h ARG 32 CO -0.00 1.02 -0.10 -0.22 -1.07 0.00 0.00 179.97 179.60 4rla h LYS 33 N 0.97 0.00 -0.36 0.04 1.63 -0.59 -0.30 116.57 117.96 4rla h LYS 33 Ca 0.18 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.98 4rla h LYS 33 Cb 0.52 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 4rla h LYS 33 CO 0.02 0.10 0.00 0.00 -3.45 0.00 0.00 179.45 176.13 4rla n ALA 34 N -2.25 2.56 -2.68 5.00 0.00 -0.49 -4.89 120.51 117.75 4rla n ALA 34 Ca -0.02 -0.45 -0.07 0.00 0.00 0.00 0.00 53.44 52.90 4rla n ALA 34 Cb 0.23 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 18.71 4rla n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4rla n GLY 35 N 0.74 0.38 0.45 0.00 0.00 -0.12 -4.99 105.19 101.65 4rla n GLY 35 Ca 0.08 -0.43 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 4rla n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 4rla h LEU 36 N -0.66 -0.96 -0.61 0.99 5.85 -1.54 -2.13 115.31 116.24 4rla h LEU 36 Ca -0.18 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.67 4rla h LEU 36 Cb 1.12 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 42.33 4rla h LEU 36 CO 0.18 -0.66 0.24 0.58 -0.34 0.00 0.00 178.44 178.43 4rla h VAL 37 N -1.19 0.78 0.31 1.05 2.07 -1.84 -0.37 116.25 117.05 4rla h VAL 37 Ca -0.12 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 4rla h VAL 37 Cb 0.87 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 4rla h VAL 37 CO 0.19 0.08 -0.21 -0.33 0.02 0.00 0.00 177.57 177.32 4rla h GLU 38 N 0.42 -0.49 -0.44 1.57 3.07 -1.92 -2.00 114.58 114.80 4rla h GLU 38 Ca 0.31 0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.26 4rla h GLU 38 Cb 0.38 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.37 4rla h GLU 38 CO -0.30 -0.33 0.30 0.87 -1.40 0.00 0.00 179.01 178.14 4rla h LYS 39 N -0.51 0.36 -0.41 2.33 1.57 -0.83 -1.35 116.57 117.73 4rla h LYS 39 Ca -0.03 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 4rla h LYS 39 Cb 0.44 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 4rla h LYS 39 CO 0.01 0.24 0.09 -0.07 -0.57 0.00 0.00 179.45 179.16 4rla h LEU 40 N 0.37 0.63 -1.45 2.94 3.38 -0.68 -3.01 115.31 117.50 4rla h LEU 40 Ca 0.19 -0.24 0.22 0.00 0.09 0.00 0.00 57.88 58.14 4rla h LEU 40 Cb 0.28 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 4rla h LEU 40 CO -0.04 0.71 0.62 0.11 0.09 0.00 0.00 178.44 179.93 4rla h LYS 41 N 0.53 0.42 0.00 1.13 1.57 -0.50 -1.33 116.57 118.38 4rla h LYS 41 Ca 0.13 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 4rla h LYS 41 Cb 0.33 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.55 4rla h LYS 41 CO 0.00 0.27 0.00 0.39 -0.57 0.00 0.00 179.45 179.55 4rla n GLU 42 N -4.55 0.57 -1.38 3.15 1.02 -1.14 -4.77 120.64 113.54 4rla n GLU 42 Ca 0.21 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.29 4rla n GLU 42 Cb 0.74 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 30.72 4rla n GLU 42 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 4rla n THR 43 N -0.97 0.00 -0.40 2.62 -2.24 -0.50 -4.97 114.28 107.82 4rla n THR 43 Ca 0.13 -0.52 -0.10 0.00 -2.27 0.00 0.00 64.05 61.29 4rla n THR 43 Cb 0.06 -1.06 0.04 0.00 -2.10 0.00 0.00 70.33 67.27 4rla n THR 43 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 4rla n GLU 44 N -1.47 1.49 -4.06 -0.78 0.28 -1.26 -4.84 120.64 110.00 4rla n GLU 44 Ca 0.05 -1.01 -0.14 0.00 -0.16 0.00 0.00 57.16 55.90 4rla n GLU 44 Cb 0.18 -1.40 -0.14 0.00 1.43 0.00 0.00 31.44 31.51 4rla n GLU 44 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 4rla s TYR 45 N -1.15 0.34 0.11 -1.84 1.51 -1.26 -4.86 117.35 110.20 4rla s TYR 45 Ca 0.20 -0.13 -0.30 0.00 -1.01 0.00 0.00 57.07 55.83 4rla s TYR 45 Cb 0.16 -0.22 -0.06 0.00 -0.11 0.00 0.00 41.96 41.73 4rla s TYR 45 CO 0.01 -0.02 0.97 -0.80 -1.11 0.00 0.00 175.55 174.59 4rla s ASN 46 N -0.32 7.49 -0.10 2.29 0.01 -1.26 -4.73 114.94 118.33 4rla s ASN 46 Ca -0.01 1.80 0.04 0.00 -0.71 0.00 0.00 52.86 53.98 4rla s ASN 46 Cb -0.03 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.05 4rla s ASN 46 CO -0.00 -0.07 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.61 4rla s VAL 47 N -0.01 1.93 -0.09 1.60 1.01 -1.26 0.15 120.40 123.74 4rla s VAL 47 Ca 0.47 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.52 4rla s VAL 47 Cb -0.23 -1.68 0.02 0.00 0.00 0.00 0.00 36.38 34.49 4rla s VAL 47 CO 0.30 0.53 -0.10 -0.60 0.00 0.00 0.00 175.10 175.23 4rla s ARG 48 N 0.40 1.59 -0.52 2.72 3.52 -0.35 -4.98 118.95 121.33 4rla s ARG 48 Ca -0.18 -0.33 -0.17 0.00 -0.13 0.00 0.00 55.73 54.92 4rla s ARG 48 Cb -0.18 -1.49 0.09 0.00 -1.56 0.00 0.00 34.95 31.82 4rla s ARG 48 CO 0.08 -0.13 0.54 0.34 -0.81 0.00 0.00 175.30 175.32 4rla s ASP 49 N 1.21 6.18 0.33 -2.12 2.15 -1.26 -0.60 116.67 122.56 4rla s ASP 49 Ca -0.04 -1.40 0.24 0.00 0.43 0.00 0.00 52.55 51.79 4rla s ASP 49 Cb -0.14 -2.24 1.18 0.00 -0.30 0.00 0.00 42.92 41.42 4rla s ASP 49 CO -0.03 -0.85 1.74 -0.74 -0.17 0.00 0.00 175.17 175.12 4rla h HIS 50 N 8.93 0.00 0.00 -5.34 -0.00 -1.24 -3.48 115.15 114.02 4rla h HIS 50 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.08 4rla h HIS 50 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.51 4rla h HIS 50 CO 0.73 0.00 0.00 0.41 -0.00 0.00 0.00 177.93 179.07 4rla n GLY 51 N -0.69 -1.86 3.70 5.26 0.00 -1.26 -4.92 105.19 105.42 4rla n GLY 51 Ca -0.00 -1.77 -0.35 0.00 0.00 0.00 0.00 46.02 43.90 4rla n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4rla s ASP 52 N -4.00 5.84 0.55 1.61 1.01 -1.26 -1.42 116.67 119.00 4rla s ASP 52 Ca 0.00 0.19 -0.20 0.00 0.71 0.00 0.00 52.55 53.25 4rla s ASP 52 Cb 0.00 -1.95 -0.05 0.00 1.01 0.00 0.00 42.92 41.93 4rla s ASP 52 CO 0.00 0.24 1.18 -0.76 0.21 0.00 0.00 175.17 176.04 4rla s LEU 53 N -0.04 3.75 -0.38 1.23 1.43 -0.85 -4.96 118.68 118.86 4rla s LEU 53 Ca 0.07 2.31 -0.15 0.00 -1.03 0.00 0.00 54.13 55.34 4rla s LEU 53 Cb -0.12 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 41.57 4rla s LEU 53 CO 0.01 -1.36 0.32 0.00 0.23 0.00 0.00 176.35 175.54 4rla s ALA 54 N -1.64 3.48 -0.08 4.21 0.00 -1.26 -4.72 121.76 121.74 4rla s ALA 54 Ca 0.74 -1.48 -0.13 0.00 0.00 0.00 0.00 51.96 51.08 4rla s ALA 54 Cb -0.28 -2.83 -0.05 0.00 0.00 0.00 0.00 23.12 19.96 4rla s ALA 54 CO 0.31 -1.25 0.33 -0.06 0.00 0.00 0.00 175.76 175.09 4rla s PHE 55 N 1.83 3.60 -0.15 0.00 0.08 -1.26 -5.08 117.98 117.01 4rla s PHE 55 Ca 0.08 0.77 -0.08 0.00 0.12 0.00 0.00 56.93 57.82 4rla s PHE 55 Cb -0.18 -2.26 -0.04 0.00 -0.57 0.00 0.00 43.02 39.97 4rla s PHE 55 CO 0.11 0.50 0.12 0.54 -0.10 0.00 0.00 175.22 176.39 4rla s VAL 56 N -0.45 5.29 -0.29 -0.44 0.11 -1.26 -5.06 120.40 118.30 4rla s VAL 56 Ca 0.20 0.14 -0.28 0.00 -2.93 0.00 0.00 61.98 59.11 4rla s VAL 56 Cb -0.14 -3.35 0.01 0.00 -1.53 0.00 0.00 36.38 31.37 4rla s VAL 56 CO 0.08 0.54 1.00 -0.62 -3.33 0.00 0.00 175.10 172.78 4rla s ASP 57 N -0.41 6.92 -0.20 3.54 2.15 -1.26 -4.92 116.67 122.50 4rla s ASP 57 Ca 0.11 1.06 -0.29 0.00 0.43 0.00 0.00 52.55 53.86 4rla s ASP 57 Cb -0.12 -2.51 -0.02 0.00 -0.30 0.00 0.00 42.92 39.97 4rla s ASP 57 CO 0.01 -0.76 1.42 -0.69 -0.17 0.00 0.00 175.17 174.98 4rla s VAL 58 N 3.38 4.00 0.55 1.11 1.01 -1.26 -5.00 120.40 124.19 4rla s VAL 58 Ca 0.42 1.17 -0.21 0.00 0.00 0.00 0.00 61.98 63.36 4rla s VAL 58 Cb -0.13 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 4rla s VAL 58 CO 0.12 -0.25 1.27 -2.16 0.00 0.00 0.00 175.10 174.08 4rla s PRO 59 N 4.04 3.17 -1.55 2.72 0.04 -1.26 -3.55 135.00 138.62 4rla s PRO 59 Ca 0.62 2.01 -0.08 0.00 0.04 0.00 0.00 61.00 63.58 4rla s PRO 59 Cb -0.23 -2.16 0.07 0.00 0.04 0.00 0.00 34.50 32.22 4rla s PRO 59 CO 0.23 -1.09 0.56 -1.71 0.04 0.00 0.00 177.00 175.02 4rla n ASN 60 N -1.14 -1.63 -4.58 6.66 5.15 -1.26 -4.83 115.26 113.64 4rla n ASN 60 Ca 0.11 -1.02 -0.33 0.00 -0.60 0.00 0.00 54.58 52.74 4rla n ASN 60 Cb 0.47 -2.85 -0.04 0.00 -0.53 0.00 0.00 39.78 36.83 4rla n ASN 60 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 4rla s ASP 61 N -3.88 5.63 0.23 1.20 -1.08 -1.23 -4.94 116.67 112.60 4rla s ASP 61 Ca 0.34 -1.71 -0.31 0.00 -0.52 0.00 0.00 52.55 50.35 4rla s ASP 61 Cb -0.18 -2.58 -0.11 0.00 -1.46 0.00 0.00 42.92 38.59 4rla s ASP 61 CO 0.91 -2.42 1.58 -0.44 0.52 0.00 0.00 175.17 175.32 4rla s SER 62 N 6.02 6.49 -0.15 -0.34 0.01 -1.26 -4.51 113.70 119.96 4rla s SER 62 Ca 0.63 2.79 -0.29 0.00 1.31 0.00 0.00 55.95 60.39 4rla s SER 62 Cb -0.00 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.55 4rla s SER 62 CO 0.08 -0.86 2.15 -2.65 0.41 0.00 0.00 173.24 172.38 4rla n PRO 63 N 3.02 2.20 -2.05 12.44 -0.02 -1.26 -4.68 135.00 144.64 4rla n PRO 63 Ca 0.11 0.68 -0.29 0.00 -2.02 0.00 0.00 63.50 61.97 4rla n PRO 63 Cb 0.38 -3.16 -0.05 0.00 -0.02 0.00 0.00 33.50 30.65 4rla n PRO 63 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 4rla s PHE 64 N 7.22 1.79 0.00 6.00 5.36 -0.45 -4.64 117.98 133.25 4rla s PHE 64 Ca 0.98 0.65 0.00 0.00 -0.96 0.00 0.00 56.93 57.59 4rla s PHE 64 Cb -0.37 -4.06 0.00 0.00 -0.34 0.00 0.00 43.02 38.25 4rla s PHE 64 CO 0.37 -1.86 0.00 1.04 -1.46 0.00 0.00 175.22 173.32 4rla n GLN 65 N 8.92 0.00 -0.06 10.12 6.02 -1.26 -1.63 117.38 139.50 4rla n GLN 65 Ca 0.36 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 57.32 4rla n GLN 65 Cb 0.48 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.62 4rla n GLN 65 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56 4rla n ILE 66 N 0.00 0.76 -1.82 5.09 3.06 -1.26 -4.97 119.36 120.22 4rla n ILE 66 Ca 0.00 -0.56 -0.42 0.00 -2.50 0.00 0.00 62.75 59.27 4rla n ILE 66 Cb 0.00 -0.42 -0.03 0.00 0.54 0.00 0.00 39.64 39.73 4rla n ILE 66 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 4rla s VAL 67 N -2.55 2.41 0.07 9.51 1.01 -0.64 -3.14 120.40 127.08 4rla s VAL 67 Ca -0.07 0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.13 4rla s VAL 67 Cb 0.06 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 4rla s VAL 67 CO 0.62 0.01 0.18 -0.54 0.00 0.00 0.00 175.10 175.37 4rla s LYS 68 N 1.58 3.31 -1.52 2.72 1.02 -0.88 -1.35 119.74 124.62 4rla s LYS 68 Ca 0.74 -0.50 -0.06 0.00 0.02 0.00 0.00 55.97 56.17 4rla s LYS 68 Cb -0.46 -2.97 0.05 0.00 -0.52 0.00 0.00 37.83 33.93 4rla s LYS 68 CO 0.32 0.60 0.45 0.09 -0.92 0.00 0.00 175.35 175.89 4rla n ASN 69 N 0.29 -0.95 0.17 2.83 3.02 -1.26 -4.66 115.26 114.69 4rla n ASN 69 Ca -0.06 -1.06 -0.14 0.00 -0.03 0.00 0.00 54.58 53.29 4rla n ASN 69 Cb 0.51 -2.69 -0.07 0.00 -0.61 0.00 0.00 39.78 36.92 4rla n ASN 69 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 4rla h PRO 70 N -1.71 -0.49 -0.15 3.52 0.11 -1.83 -2.67 132.00 128.78 4rla h PRO 70 Ca -0.62 0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.46 4rla h PRO 70 Cb 1.38 0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.59 4rla h PRO 70 CO 0.69 -0.32 -0.18 0.00 -0.21 0.00 0.00 178.00 177.98 4rla h ARG 71 N -0.50 0.25 -0.04 1.05 3.08 -1.88 -0.78 114.38 115.54 4rla h ARG 71 Ca -0.00 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 4rla h ARG 71 Cb 0.47 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.49 4rla h ARG 71 CO -0.05 0.42 -0.09 0.77 -1.07 0.00 0.00 179.97 179.95 4rla h SER 72 N 0.23 0.15 -0.64 7.04 0.02 -1.87 -0.88 113.55 117.60 4rla h SER 72 Ca 0.04 -0.57 -0.06 0.00 -0.84 0.00 0.00 61.79 60.37 4rla h SER 72 Cb 0.45 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 4rla h SER 72 CO 0.03 0.69 0.19 0.58 -1.14 0.00 0.00 176.83 177.18 4rla h VAL 73 N -0.38 1.25 -0.40 2.27 2.07 -1.41 -0.02 116.25 119.64 4rla h VAL 73 Ca 0.00 -0.87 -0.15 0.00 0.82 0.00 0.00 66.70 66.50 4rla h VAL 73 Cb 0.67 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 4rla h VAL 73 CO 0.02 0.34 -0.34 1.23 0.02 0.00 0.00 177.57 178.84 4rla h GLY 74 N 1.06 0.99 0.81 2.17 0.00 -1.14 -1.10 103.07 105.85 4rla h GLY 74 Ca 0.22 -0.96 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 4rla h GLY 74 CO -0.01 0.87 -0.02 1.70 0.00 0.00 0.00 176.54 179.09 4rla h LYS 75 N 0.75 -0.05 -0.38 4.80 1.63 -0.81 -0.86 116.57 121.65 4rla h LYS 75 Ca 0.07 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 59.91 4rla h LYS 75 Cb 0.91 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.52 4rla h LYS 75 CO 0.08 0.16 0.18 0.00 -3.45 0.00 0.00 179.45 176.42 4rla h ALA 76 N 0.71 0.47 -0.31 5.00 0.00 -0.99 -1.53 119.26 122.61 4rla h ALA 76 Ca -0.00 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 4rla h ALA 76 Cb 0.22 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 4rla h ALA 76 CO 0.01 -0.19 -0.07 -0.91 0.00 0.00 0.00 179.25 178.10 4rla h ASN 77 N 0.37 0.47 -0.23 0.00 2.35 -1.08 -0.90 115.58 116.57 4rla h ASN 77 Ca 0.16 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 4rla h ASN 77 Cb 0.08 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 4rla h ASN 77 CO -0.12 0.59 -0.01 -0.08 -1.65 0.00 0.00 177.43 176.16 4rla h GLU 78 N 0.47 0.41 -0.77 0.81 4.81 -0.66 -1.33 114.58 118.32 4rla h GLU 78 Ca 0.09 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 4rla h GLU 78 Cb 0.41 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 4rla h GLU 78 CO 0.02 0.61 0.49 0.37 -0.73 0.00 0.00 179.01 179.76 4rla h GLN 79 N 0.17 1.03 0.31 1.92 4.15 -1.00 -2.41 115.11 119.27 4rla h GLN 79 Ca 0.06 -0.08 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 4rla h GLN 79 Cb 0.43 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.90 4rla h GLN 79 CO 0.01 0.71 -0.15 1.25 -1.93 0.00 0.00 178.83 178.72 4rla h LEU 80 N 1.05 -0.35 -1.61 -2.39 5.85 -1.07 -2.76 115.31 114.03 4rla h LEU 80 Ca 0.28 -0.10 0.27 0.00 0.84 0.00 0.00 57.88 59.16 4rla h LEU 80 Cb -0.08 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 4rla h LEU 80 CO -0.06 -0.10 0.69 0.00 -0.34 0.00 0.00 178.44 178.63 4rla h ALA 81 N 0.04 2.49 0.09 1.25 0.00 -1.04 0.26 119.26 122.35 4rla h ALA 81 Ca -0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 4rla h ALA 81 Cb 0.43 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 4rla h ALA 81 CO 0.07 -0.84 -0.04 0.00 0.00 0.00 0.00 179.25 178.44 4rla h ALA 82 N 1.57 -0.12 -0.62 0.00 0.00 -1.28 -1.89 119.26 116.91 4rla h ALA 82 Ca 0.54 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 4rla h ALA 82 Cb 1.61 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.42 4rla h ALA 82 CO -0.17 -0.38 0.34 0.28 0.00 0.00 0.00 179.25 179.32 4rla h VAL 83 N -0.49 1.20 0.36 0.00 2.07 -0.35 -1.20 116.25 117.84 4rla h VAL 83 Ca -0.01 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 4rla h VAL 83 Cb 0.41 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 4rla h VAL 83 CO 0.02 0.21 -0.18 0.58 0.02 0.00 0.00 177.57 178.23 4rla h VAL 84 N 0.85 0.65 -0.83 2.57 2.07 -0.79 -2.42 116.25 118.34 4rla h VAL 84 Ca 0.22 -0.05 0.10 0.00 0.82 0.00 0.00 66.70 67.78 4rla h VAL 84 Cb 0.04 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.43 4rla h VAL 84 CO -0.04 0.01 0.54 0.00 0.02 0.00 0.00 177.57 178.11 4rla h ALA 85 N 0.11 1.71 0.13 1.67 0.00 -1.13 -0.87 119.26 120.89 4rla h ALA 85 Ca -0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 4rla h ALA 85 Cb 0.39 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.00 4rla h ALA 85 CO 0.08 0.11 -0.06 1.49 0.00 0.00 0.00 179.25 180.87 4rla h GLU 86 N 0.79 -0.17 -0.54 0.00 4.57 -0.99 0.46 114.58 118.70 4rla h GLU 86 Ca 0.39 0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.48 4rla h GLU 86 Cb 0.44 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.04 4rla h GLU 86 CO -0.15 -0.02 -0.04 1.79 -1.18 0.00 0.00 179.01 179.41 4rla h THR 87 N -0.29 1.26 -0.77 0.32 1.35 -0.93 -2.49 112.91 111.36 4rla h THR 87 Ca -0.02 -1.15 -0.01 0.00 -0.55 0.00 0.00 66.41 64.68 4rla h THR 87 Cb 0.24 0.89 -0.04 0.00 -1.73 0.00 0.00 68.15 67.50 4rla h THR 87 CO 0.03 0.41 0.42 1.56 -0.25 0.00 0.00 175.52 177.69 4rla h GLN 88 N 0.87 1.07 -0.91 4.72 1.08 -1.09 -1.65 115.11 119.19 4rla h GLN 88 Ca 0.15 -0.12 0.09 0.00 -1.45 0.00 0.00 58.65 57.32 4rla h GLN 88 Cb 0.57 -0.21 -0.06 0.00 -0.05 0.00 0.00 27.48 27.72 4rla h GLN 88 CO 0.03 0.79 0.59 -0.22 -0.95 0.00 0.00 178.83 179.07 4rla h LYS 89 N 1.06 0.93 -0.05 1.46 3.64 -0.49 -0.01 116.57 123.12 4rla h LYS 89 Ca 0.27 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 4rla h LYS 89 Cb 0.03 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 4rla h LYS 89 CO -0.04 0.62 0.00 0.09 -2.27 0.00 0.00 179.45 177.84 4rla n ASN 90 N -4.52 0.05 -1.12 4.20 3.02 -0.65 -4.87 115.26 111.37 4rla n ASN 90 Ca 0.15 -1.93 -0.08 0.00 -0.03 0.00 0.00 54.58 52.69 4rla n ASN 90 Cb 0.27 -0.03 0.01 0.00 -0.61 0.00 0.00 39.78 39.42 4rla n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 4rla n GLY 91 N 0.44 0.15 3.60 7.41 0.00 -0.02 -5.05 105.19 111.72 4rla n GLY 91 Ca 0.00 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 4rla n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4rla s THR 92 N -2.61 3.11 -0.15 2.61 -4.23 -1.04 -4.43 115.64 108.89 4rla s THR 92 Ca 0.07 -2.05 -0.15 0.00 -1.18 0.00 0.00 61.69 58.37 4rla s THR 92 Cb -0.03 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 71.08 4rla s THR 92 CO 0.08 -0.37 0.36 -0.63 -0.54 0.00 0.00 174.62 173.53 4rla s ILE 93 N -2.39 5.26 -0.08 2.99 1.01 -0.07 -4.30 121.20 123.62 4rla s ILE 93 Ca 0.31 0.69 -0.14 0.00 0.00 0.00 0.00 60.65 61.52 4rla s ILE 93 Cb -0.05 -3.70 -0.05 0.00 0.01 0.00 0.00 42.46 38.66 4rla s ILE 93 CO 0.19 0.35 0.35 -0.94 0.00 0.00 0.00 174.94 174.88 4rla s SER 94 N 0.61 6.63 -0.30 3.58 1.04 -1.15 -0.43 113.70 123.69 4rla s SER 94 Ca 0.20 0.75 0.01 0.00 0.48 0.00 0.00 55.95 57.39 4rla s SER 94 Cb -0.14 -2.21 0.09 0.00 0.10 0.00 0.00 66.02 63.86 4rla s SER 94 CO 0.06 0.24 0.03 -0.69 0.98 0.00 0.00 173.24 173.86 4rla s VAL 95 N -0.44 1.60 -0.11 5.02 1.01 -0.40 -1.20 120.40 125.88 4rla s VAL 95 Ca 0.21 -1.69 -0.16 0.00 0.00 0.00 0.00 61.98 60.33 4rla s VAL 95 Cb -0.15 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 4rla s VAL 95 CO 0.09 -0.47 0.41 -0.69 0.00 0.00 0.00 175.10 174.45 4rla s VAL 96 N 1.28 5.19 -0.40 2.92 1.01 -0.04 -0.50 120.40 129.86 4rla s VAL 96 Ca 0.05 0.82 -0.07 0.00 0.00 0.00 0.00 61.98 62.79 4rla s VAL 96 Cb -0.18 -3.75 0.09 0.00 0.00 0.00 0.00 36.38 32.54 4rla s VAL 96 CO -0.13 0.39 0.22 -0.76 0.00 0.00 0.00 175.10 174.82 4rla s LEU 97 N 0.24 5.05 1.07 3.92 1.43 -0.18 -1.61 118.68 128.60 4rla s LEU 97 Ca 0.23 -1.63 -0.18 0.00 -1.03 0.00 0.00 54.13 51.52 4rla s LEU 97 Cb -0.15 -1.91 0.24 0.00 0.03 0.00 0.00 46.19 44.40 4rla s LEU 97 CO 0.09 -0.51 1.26 -0.83 0.23 0.00 0.00 176.35 176.59 4rla s GLY 98 N 1.97 1.73 0.00 -3.19 0.00 -0.32 -1.24 107.32 106.27 4rla s GLY 98 Ca 0.03 -1.18 0.00 0.00 0.00 0.00 0.00 44.72 43.58 4rla s GLY 98 CO -0.00 -0.33 0.00 0.61 0.00 0.00 0.00 173.10 173.38 4rla n GLY 99 N -2.78 -0.15 3.93 0.20 0.00 -0.87 -3.34 105.19 102.18 4rla n GLY 99 Ca 0.15 -1.57 -0.26 0.00 0.00 0.00 0.00 46.02 44.34 4rla n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 4rla s ASP 100 N -1.56 5.58 0.65 1.61 -4.77 -1.01 -1.17 116.67 116.00 4rla s ASP 100 Ca 0.00 0.61 0.21 0.00 -3.30 0.00 0.00 52.55 50.07 4rla s ASP 100 Cb 0.00 -1.62 1.08 0.00 -1.09 0.00 0.00 42.92 41.29 4rla s ASP 100 CO 0.00 -1.03 1.60 -1.13 0.70 0.00 0.00 175.17 175.31 4rla h ASN 101 N -0.09 0.00 -0.83 2.11 -0.73 -1.94 -1.87 115.58 112.23 4rla h ASN 101 Ca -0.45 0.00 0.07 0.00 1.87 0.00 0.00 56.30 57.79 4rla h ASN 101 Cb 1.26 0.00 -0.06 0.00 0.27 0.00 0.00 38.32 39.79 4rla h ASN 101 CO 0.60 0.00 0.50 0.77 -0.37 0.00 0.00 177.43 178.93 4rla h SER 102 N 0.00 0.76 0.00 1.15 4.64 -1.77 -0.75 113.55 117.58 4rla h SER 102 Ca 0.07 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 4rla h SER 102 Cb 1.31 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 4rla h SER 102 CO -0.00 0.47 0.03 0.23 -0.87 0.00 0.00 176.83 176.69 4rla n MET 103 N -4.67 0.00 0.16 4.77 2.00 -0.70 -1.42 117.12 117.25 4rla n MET 103 Ca 0.12 0.39 0.13 0.00 0.00 0.00 0.00 57.70 58.34 4rla n MET 103 Cb 0.21 -1.53 0.51 0.00 0.00 0.00 0.00 33.22 32.41 4rla n MET 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 4rla h ALA 104 N 1.87 1.00 0.16 3.04 0.00 -1.34 -2.53 119.26 121.45 4rla h ALA 104 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 4rla h ALA 104 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 4rla h ALA 104 CO 0.00 0.00 -0.07 0.82 0.00 0.00 0.00 179.25 180.00 4rla h ILE 105 N 0.00 0.97 0.10 0.00 2.04 -1.45 -2.42 117.51 116.76 4rla h ILE 105 Ca 0.00 -0.98 0.01 0.00 1.00 0.00 0.00 64.86 64.89 4rla h ILE 105 Cb 0.46 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 4rla h ILE 105 CO 0.00 0.21 -0.13 1.23 0.00 0.00 0.00 178.15 179.46 4rla h GLY 106 N -0.72 -0.25 0.36 5.37 0.00 -1.70 -1.23 103.07 104.91 4rla h GLY 106 Ca -0.02 0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.48 4rla h GLY 106 CO 0.04 -0.13 -0.37 0.23 0.00 0.00 0.00 176.54 176.30 4rla h SER 107 N -0.27 -1.09 -0.39 0.19 0.87 -1.54 -0.78 113.55 110.54 4rla h SER 107 Ca 0.01 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 4rla h SER 107 Cb 0.28 0.41 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 4rla h SER 107 CO -0.06 -0.46 0.16 0.40 -0.53 0.00 0.00 176.83 176.34 4rla h ILE 108 N -0.61 1.19 0.43 2.23 2.04 -1.41 -2.21 117.51 119.17 4rla h ILE 108 Ca 0.02 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 4rla h ILE 108 Cb 0.64 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 4rla h ILE 108 CO -0.21 0.22 -0.48 0.28 0.00 0.00 0.00 178.15 177.96 4rla h SER 109 N 0.49 -1.32 -0.93 1.72 0.02 -1.01 0.76 113.55 113.28 4rla h SER 109 Ca 0.13 0.11 0.18 0.00 -0.84 0.00 0.00 61.79 61.37 4rla h SER 109 Cb 0.19 0.44 -0.11 0.00 0.14 0.00 0.00 62.40 63.06 4rla h SER 109 CO -0.01 -0.61 0.51 1.23 -1.14 0.00 0.00 176.83 176.81 4rla h GLY 110 N -0.92 1.61 1.00 -3.77 0.00 -1.17 0.18 103.07 100.01 4rla h GLY 110 Ca -0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 4rla h GLY 110 CO -0.08 -0.10 0.28 0.84 0.00 0.00 0.00 176.54 177.48 4rla h HIS 111 N 0.64 0.92 -0.36 5.60 6.17 -0.72 -2.94 115.15 124.46 4rla h HIS 111 Ca 0.54 -0.05 -0.04 0.00 0.71 0.00 0.00 60.37 61.52 4rla h HIS 111 Cb 0.87 -0.28 -0.02 0.00 2.52 0.00 0.00 27.41 30.50 4rla h HIS 111 CO -0.06 0.71 0.04 0.00 0.71 0.00 0.00 177.93 179.33 4rla h ALA 112 N 1.12 1.41 -0.44 5.26 0.00 0.17 -1.43 119.26 125.35 4rla h ALA 112 Ca 0.21 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 55.05 4rla h ALA 112 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 4rla h ALA 112 CO -0.02 0.42 0.30 0.00 0.00 0.00 0.00 179.25 179.95 4rla h ARG 113 N 0.52 0.13 0.00 0.00 3.08 -1.19 -0.79 114.38 116.13 4rla h ARG 113 Ca 0.12 -0.01 -0.36 0.00 0.07 0.00 0.00 59.98 59.80 4rla h ARG 113 Cb 0.28 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.23 4rla h ARG 113 CO 0.00 0.09 -2.25 0.28 -1.07 0.00 0.00 179.97 177.02 4rla n VAL 114 N -4.44 1.46 -3.46 2.04 0.31 -1.02 -4.74 118.33 108.48 4rla n VAL 114 Ca 0.07 -0.81 -0.27 0.00 -0.01 0.00 0.00 64.34 63.32 4rla n VAL 114 Cb 0.42 -0.72 -0.10 0.00 -0.91 0.00 0.00 33.84 32.53 4rla n VAL 114 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 4rla n HIS 115 N -2.89 0.53 0.06 3.52 8.25 -0.57 -4.98 115.22 119.14 4rla n HIS 115 Ca -0.31 -3.66 0.04 0.00 -0.26 0.00 0.00 57.72 53.53 4rla n HIS 115 Cb 1.12 -0.14 0.20 0.00 1.12 0.00 0.00 29.99 32.29 4rla n HIS 115 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 4rla n PRO 116 N 2.14 0.05 -0.61 -0.41 -0.04 -0.35 -2.03 135.00 133.74 4rla n PRO 116 Ca 0.26 0.54 0.10 0.00 -0.04 0.00 0.00 63.50 64.36 4rla n PRO 116 Cb 0.46 -1.65 0.36 0.00 -0.04 0.00 0.00 33.50 32.62 4rla n PRO 116 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 4rla n ASP 117 N -1.75 4.77 -4.63 3.54 5.75 -1.26 -5.00 116.55 117.96 4rla n ASP 117 Ca -0.00 -2.44 -0.30 0.00 -0.01 0.00 0.00 54.79 52.04 4rla n ASP 117 Cb 0.01 -0.58 0.18 0.00 -1.03 0.00 0.00 41.12 39.71 4rla n ASP 117 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 4rla s LEU 118 N -1.84 1.91 0.06 -2.12 0.05 -0.86 -4.47 118.68 111.40 4rla s LEU 118 Ca 0.51 1.66 0.05 0.00 0.05 0.00 0.00 54.13 56.41 4rla s LEU 118 Cb 0.33 -3.90 -0.03 0.00 -2.05 0.00 0.00 46.19 40.55 4rla s LEU 118 CO 0.25 -3.29 -0.15 0.00 -0.55 0.00 0.00 176.35 172.61 4rla s VAL 120 N -1.03 3.21 -0.31 0.00 1.01 -0.53 -0.24 120.40 122.50 4rla s VAL 120 Ca 0.01 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.34 4rla s VAL 120 Cb -0.09 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 33.97 4rla s VAL 120 CO 0.02 0.51 0.05 -0.63 0.00 0.00 0.00 175.10 175.05 4rla s ILE 121 N 0.43 3.41 -0.49 2.22 1.01 -0.87 -1.16 121.20 125.75 4rla s ILE 121 Ca -0.09 -1.18 -0.14 0.00 0.00 0.00 0.00 60.65 59.25 4rla s ILE 121 Cb -0.15 -2.91 0.10 0.00 0.01 0.00 0.00 42.46 39.51 4rla s ILE 121 CO 0.04 -0.09 0.41 0.86 0.00 0.00 0.00 174.94 176.16 4rla s TRP 122 N 1.35 3.29 -0.39 3.97 -0.11 0.54 -2.01 118.94 125.58 4rla s TRP 122 Ca -0.03 -1.31 -0.19 0.00 1.22 0.00 0.00 56.10 55.79 4rla s TRP 122 Cb -0.19 -3.44 0.01 0.00 -1.50 0.00 0.00 33.47 28.34 4rla s TRP 122 CO 0.01 -0.92 0.55 0.08 -4.62 0.00 0.00 176.95 172.04 4rla s VAL 123 N 1.55 4.96 0.08 5.86 1.01 -0.82 -0.82 120.40 132.22 4rla s VAL 123 Ca 0.04 0.19 -0.26 0.00 0.00 0.00 0.00 61.98 61.94 4rla s VAL 123 Cb -0.27 -4.05 0.08 0.00 0.00 0.00 0.00 36.38 32.14 4rla s VAL 123 CO 0.03 -0.37 0.86 -0.62 0.00 0.00 0.00 175.10 175.01 4rla s ASP 124 N 1.84 -0.32 0.00 3.32 -1.08 -0.65 -0.99 116.67 118.79 4rla s ASP 124 Ca 0.19 -0.16 0.26 0.00 -0.52 0.00 0.00 52.55 52.31 4rla s ASP 124 Cb -0.15 0.46 0.60 0.00 -1.46 0.00 0.00 42.92 42.37 4rla s ASP 124 CO 0.15 -0.80 1.47 0.00 0.52 0.00 0.00 175.17 176.51 4rla n ALA 125 N -0.35 3.14 -2.38 3.66 0.00 -1.26 -3.04 120.51 120.29 4rla n ALA 125 Ca -0.09 -0.47 -0.16 0.00 0.00 0.00 0.00 53.44 52.73 4rla n ALA 125 Cb 0.62 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 18.91 4rla n ALA 125 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 4rla s HIS 126 N -2.45 1.36 -0.01 0.00 3.76 -1.26 -1.27 115.29 115.42 4rla s HIS 126 Ca 0.24 -0.65 0.03 0.00 -0.15 0.00 0.00 55.06 54.53 4rla s HIS 126 Cb 0.19 -0.69 -0.25 0.00 1.11 0.00 0.00 32.58 32.94 4rla s HIS 126 CO 0.52 0.14 0.81 1.79 -0.85 0.00 0.00 174.74 177.14 4rla h THR 127 N 3.09 1.08 -6.32 1.30 1.35 -1.91 -3.47 112.91 108.04 4rla h THR 127 Ca -0.38 -2.81 -0.48 0.00 -0.55 0.00 0.00 66.41 62.20 4rla h THR 127 Cb 1.20 2.64 -0.04 0.00 -1.73 0.00 0.00 68.15 70.22 4rla h THR 127 CO 0.58 0.75 -0.77 0.47 -0.25 0.00 0.00 175.52 176.30 4rla n ASP 128 N -3.32 -4.50 -0.92 5.36 8.00 -1.26 -4.77 116.55 115.13 4rla n ASP 128 Ca -0.16 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.55 4rla n ASP 128 Cb 1.03 -3.83 0.20 0.00 -0.02 0.00 0.00 41.12 38.51 4rla n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4rla n ILE 129 N -4.65 2.41 -2.71 0.53 3.06 -1.13 -2.60 119.36 114.27 4rla n ILE 129 Ca 0.02 -2.93 -0.37 0.00 -2.50 0.00 0.00 62.75 56.97 4rla n ILE 129 Cb 0.53 -0.29 -0.06 0.00 0.54 0.00 0.00 39.64 40.37 4rla n ILE 129 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 4rla s ASN 130 N -2.82 7.17 0.33 9.51 0.01 -0.81 -4.63 114.94 123.71 4rla s ASN 130 Ca 0.42 1.90 0.07 0.00 -0.71 0.00 0.00 52.86 54.54 4rla s ASN 130 Cb 0.39 -2.58 -0.02 0.00 0.41 0.00 0.00 41.25 39.45 4rla s ASN 130 CO -0.03 -0.19 0.35 0.42 -1.51 0.00 0.00 177.10 176.14 4rla s THR 131 N -1.63 3.77 0.63 1.60 -4.23 -1.26 -4.21 115.64 110.31 4rla s THR 131 Ca 0.52 -1.24 0.25 0.00 -1.18 0.00 0.00 61.69 60.05 4rla s THR 131 Cb -0.20 -3.28 0.31 0.00 1.34 0.00 0.00 72.50 70.67 4rla s THR 131 CO 0.25 -0.18 1.73 -0.65 -0.54 0.00 0.00 174.62 175.23 4rla h PRO 132 N 1.14 0.00 0.01 3.99 0.11 -1.96 0.24 132.00 135.53 4rla h PRO 132 Ca -0.45 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.38 4rla h PRO 132 Cb 1.25 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 4rla h PRO 132 CO 0.57 0.00 -1.55 -0.07 -0.21 0.00 0.00 178.00 176.74 4rla h LEU 133 N 0.00 0.03 0.00 2.35 3.38 -1.94 -3.38 115.31 115.75 4rla h LEU 133 Ca 0.14 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.06 4rla h LEU 133 Cb 1.29 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.04 4rla h LEU 133 CO -0.00 1.04 -1.05 0.35 0.09 0.00 0.00 178.44 178.87 4rla n THR 134 N -3.14 0.10 -1.76 0.22 -2.24 0.72 -4.96 114.28 103.22 4rla n THR 134 Ca -0.13 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.04 4rla n THR 134 Cb 1.03 0.37 -0.02 0.00 -2.10 0.00 0.00 70.33 69.61 4rla n THR 134 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 4rla s THR 135 N -3.16 2.07 -0.82 4.28 -4.23 -0.37 -4.83 115.64 108.58 4rla s THR 135 Ca 0.04 0.06 0.26 0.00 -1.18 0.00 0.00 61.69 60.87 4rla s THR 135 Cb 0.15 -3.04 0.18 0.00 1.34 0.00 0.00 72.50 71.13 4rla s THR 135 CO 0.82 0.01 1.66 -0.24 -0.54 0.00 0.00 174.62 176.32 4rla n SER 136 N 3.26 0.53 -3.77 3.99 2.88 -1.26 -4.72 113.62 114.53 4rla n SER 136 Ca 0.13 0.33 -0.13 0.00 -1.33 0.00 0.00 58.87 57.88 4rla n SER 136 Cb 0.36 -0.35 -0.12 0.00 -0.75 0.00 0.00 64.21 63.36 4rla n SER 136 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 4rla s SER 137 N -3.85 -0.29 0.00 -3.46 1.04 -1.26 -5.04 113.70 100.84 4rla s SER 137 Ca 0.11 0.56 0.08 0.00 0.48 0.00 0.00 55.95 57.18 4rla s SER 137 Cb 0.15 0.54 0.47 0.00 0.10 0.00 0.00 66.02 67.28 4rla s SER 137 CO 0.62 -0.11 0.89 0.61 0.98 0.00 0.00 173.24 176.24 4rla n GLY 138 N 3.22 -0.29 3.60 7.32 0.00 -1.19 -4.78 105.19 113.07 4rla n GLY 138 Ca -0.15 -0.05 -0.47 0.00 0.00 0.00 0.00 46.02 45.35 4rla n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4rla n ASN 139 N -0.93 3.13 0.00 1.61 3.02 -1.26 -2.06 115.26 118.77 4rla n ASN 139 Ca 0.06 0.60 0.07 0.00 -0.03 0.00 0.00 54.58 55.28 4rla n ASN 139 Cb 0.03 -1.41 0.38 0.00 -0.61 0.00 0.00 39.78 38.16 4rla n ASN 139 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 4rla n LEU 140 N 9.03 0.00 0.15 3.41 4.77 -1.06 -2.99 117.00 130.32 4rla n LEU 140 Ca 0.29 0.31 0.13 0.00 -0.03 0.00 0.00 56.01 56.72 4rla n LEU 140 Cb 0.33 -0.31 0.50 0.00 -2.33 0.00 0.00 43.42 41.61 4rla n LEU 140 CO 0.71 -0.15 0.88 1.12 -1.33 0.00 0.00 177.39 178.62 4rla h HIS 141 N 0.00 0.00 -0.54 -1.77 2.07 -0.84 -2.85 115.15 111.22 4rla h HIS 141 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 4rla h HIS 141 Cb 0.16 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.14 4rla h HIS 141 CO 0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 4rla n GLY 142 N 0.21 1.92 0.00 6.13 0.00 -1.16 -4.40 105.19 107.89 4rla n GLY 142 Ca 0.02 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.32 4rla n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4rla n GLN 143 N 1.44 -0.55 -0.29 1.61 6.02 -1.08 -1.91 117.38 122.61 4rla n GLN 143 Ca 0.21 -0.41 0.03 0.00 -0.01 0.00 0.00 57.00 56.83 4rla n GLN 143 Cb 0.58 -0.90 0.11 0.00 1.02 0.00 0.00 30.24 31.04 4rla n GLN 143 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 4rla h PRO 144 N 0.00 0.00 0.00 -1.09 0.13 -1.63 0.36 132.00 129.77 4rla h PRO 144 Ca 0.00 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 4rla h PRO 144 Cb 0.07 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.20 4rla h PRO 144 CO 0.00 0.00 -0.17 0.28 -0.23 0.00 0.00 178.00 177.88 4rla h VAL 145 N 0.00 0.67 0.00 1.56 2.07 -1.80 -2.35 116.25 116.40 4rla h VAL 145 Ca 0.40 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 4rla h VAL 145 Cb 0.62 1.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 4rla h VAL 145 CO -0.85 0.17 -0.33 0.00 0.02 0.00 0.00 177.57 176.58 4rla h ALA 146 N 1.83 1.33 0.00 1.67 0.00 -1.08 -2.50 119.26 120.51 4rla h ALA 146 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 4rla h ALA 146 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 4rla h ALA 146 CO 0.02 0.41 -0.14 0.74 0.00 0.00 0.00 179.25 180.28 4rla h PHE 147 N 0.00 0.00 0.00 0.00 -1.00 -1.34 -3.36 116.94 111.25 4rla h PHE 147 Ca -0.00 0.00 -0.36 0.00 2.81 0.00 0.00 57.97 60.42 4rla h PHE 147 Cb 0.63 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 40.13 4rla h PHE 147 CO 0.00 0.00 -2.29 1.28 -1.61 0.00 0.00 178.31 175.69 4rla n LEU 148 N -2.40 0.72 -4.71 1.54 4.77 -0.97 -4.30 117.00 111.65 4rla n LEU 148 Ca 0.05 0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 4rla n LEU 148 Cb 0.45 0.16 -0.03 0.00 -2.33 0.00 0.00 43.42 41.67 4rla n LEU 148 CO 0.32 0.57 1.27 -0.76 -1.33 0.00 0.00 177.39 177.46 4rla s LEU 149 N -5.81 4.37 0.18 2.23 1.43 -1.01 -1.08 118.68 118.99 4rla s LEU 149 Ca -0.14 2.61 -0.09 0.00 -1.03 0.00 0.00 54.13 55.48 4rla s LEU 149 Cb 0.07 -3.59 0.08 0.00 0.03 0.00 0.00 46.19 42.78 4rla s LEU 149 CO 0.79 -0.85 1.64 0.11 0.23 0.00 0.00 176.35 178.27 4rla h LYS 150 N 7.19 1.06 0.00 1.70 1.57 -1.15 -2.67 116.57 124.27 4rla h LYS 150 Ca -0.43 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.01 4rla h LYS 150 Cb 1.20 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.42 4rla h LYS 150 CO 0.92 1.05 0.00 0.39 -0.57 0.00 0.00 179.45 181.24 4rla n GLU 151 N -4.17 0.03 -0.19 3.15 4.71 -1.26 -1.37 120.64 121.54 4rla n GLU 151 Ca 0.03 0.32 0.06 0.00 -0.01 0.00 0.00 57.16 57.56 4rla n GLU 151 Cb 0.36 -1.50 0.17 0.00 -1.01 0.00 0.00 31.44 29.46 4rla n GLU 151 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 4rla n LEU 152 N -1.44 3.00 -4.66 -4.62 4.32 -1.01 -4.93 117.00 107.66 4rla n LEU 152 Ca 0.03 -1.93 -0.42 0.00 -0.02 0.00 0.00 56.01 53.67 4rla n LEU 152 Cb 0.09 -0.25 -0.03 0.00 -1.62 0.00 0.00 43.42 41.61 4rla n LEU 152 CO 0.07 0.74 1.36 -0.75 -1.22 0.00 0.00 177.39 177.59 4rla s LYS 153 N -1.01 4.18 0.00 3.23 2.47 -0.47 -2.24 119.74 125.91 4rla s LYS 153 Ca 0.26 2.18 0.00 0.00 -1.56 0.00 0.00 55.97 56.85 4rla s LYS 153 Cb 0.14 -3.97 0.00 0.00 -1.46 0.00 0.00 37.83 32.54 4rla s LYS 153 CO 0.18 -0.84 0.00 0.41 0.16 0.00 0.00 175.35 175.26 4rla n GLY 154 N 4.11 0.68 0.18 5.54 0.00 -1.26 -4.89 105.19 109.54 4rla n GLY 154 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 4rla n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 4rla n LYS 155 N -2.62 0.74 -3.73 1.61 4.76 -0.95 -4.85 118.16 113.12 4rla n LYS 155 Ca 0.00 -0.35 -0.14 0.00 -2.87 0.00 0.00 58.31 54.95 4rla n LYS 155 Cb 0.00 -1.49 -0.08 0.00 -1.84 0.00 0.00 35.03 31.61 4rla n LYS 155 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 4rla s PHE 156 N -2.51 -0.25 1.02 2.13 -0.71 -1.26 -5.00 117.98 111.40 4rla s PHE 156 Ca 0.26 0.40 -0.13 0.00 -1.04 0.00 0.00 56.93 56.42 4rla s PHE 156 Cb 0.20 0.14 0.12 0.00 -1.21 0.00 0.00 43.02 42.26 4rla s PHE 156 CO 0.50 -0.41 0.58 -0.35 -1.34 0.00 0.00 175.22 174.20 4rla n PRO 157 N 1.29 -0.98 -2.54 1.99 -0.04 -1.26 -4.95 135.00 128.51 4rla n PRO 157 Ca -0.21 -0.25 -0.41 0.00 -0.04 0.00 0.00 63.50 62.59 4rla n PRO 157 Cb 0.56 -1.99 -0.04 0.00 -0.04 0.00 0.00 33.50 32.00 4rla n PRO 157 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 4rla s ASP 158 N -2.18 7.25 -0.19 3.54 1.01 -1.26 -5.01 116.67 119.83 4rla s ASP 158 Ca 0.61 1.97 -0.08 0.00 0.71 0.00 0.00 52.55 55.75 4rla s ASP 158 Cb -0.20 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.10 4rla s ASP 158 CO 0.65 -0.29 0.08 -0.69 0.21 0.00 0.00 175.17 175.12 4rla s VAL 159 N 0.41 4.93 -0.22 -1.27 1.01 -1.26 -5.05 120.40 118.96 4rla s VAL 159 Ca 0.53 0.02 -0.37 0.00 0.00 0.00 0.00 61.98 62.15 4rla s VAL 159 Cb -0.27 -3.23 -0.13 0.00 0.00 0.00 0.00 36.38 32.74 4rla s VAL 159 CO 0.31 0.45 1.88 -2.65 0.00 0.00 0.00 175.10 175.09 4rla n PRO 160 N 3.57 1.57 0.00 2.72 -0.02 -1.26 -1.80 135.00 139.78 4rla n PRO 160 Ca -0.16 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 4rla n PRO 160 Cb 0.52 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 4rla n PRO 160 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4rla n GLY 161 N 4.67 2.57 1.33 -1.23 0.00 -1.26 -2.96 105.19 108.31 4rla n GLY 161 Ca 0.27 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.38 4rla n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 4rla n PHE 162 N -1.06 1.28 0.09 1.61 3.72 -0.74 -4.31 117.46 118.04 4rla n PHE 162 Ca 0.00 -0.66 0.15 0.00 -0.05 0.00 0.00 57.45 56.88 4rla n PHE 162 Cb 0.00 -0.25 0.65 0.00 -0.94 0.00 0.00 39.48 38.94 4rla n PHE 162 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 4rla h SER 163 N 3.29 0.04 1.15 4.37 4.64 -1.93 -1.57 113.55 123.54 4rla h SER 163 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 4rla h SER 163 Cb 1.40 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.47 4rla h SER 163 CO 0.22 0.03 -0.14 4.11 -0.87 0.00 0.00 176.83 180.18 4rla h TRP 164 N 0.05 0.00 -3.53 4.77 5.08 -1.97 -3.45 115.95 116.89 4rla h TRP 164 Ca 0.16 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.61 4rla h TRP 164 Cb 0.58 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.76 4rla h TRP 164 CO -0.00 0.14 0.53 0.08 -1.28 0.00 0.00 178.44 177.91 4rla s VAL 165 N -3.54 3.63 -0.13 0.12 1.01 -0.59 -5.04 120.40 115.85 4rla s VAL 165 Ca 0.02 1.40 -0.01 0.00 0.00 0.00 0.00 61.98 63.38 4rla s VAL 165 Cb 0.09 -3.89 0.04 0.00 0.00 0.00 0.00 36.38 32.61 4rla s VAL 165 CO 0.62 0.24 -0.01 0.42 0.00 0.00 0.00 175.10 176.36 4rla s THR 166 N -0.19 0.69 -0.45 3.92 -4.23 -1.26 -5.09 115.64 109.03 4rla s THR 166 Ca 0.51 -0.31 -0.42 0.00 -1.18 0.00 0.00 61.69 60.29 4rla s THR 166 Cb -0.32 -0.93 -0.18 0.00 1.34 0.00 0.00 72.50 72.41 4rla s THR 166 CO 0.37 0.12 1.53 -2.65 -0.54 0.00 0.00 174.62 173.44 4rla n PRO 167 N 5.02 0.00 0.00 3.99 -0.02 -1.26 -4.87 135.00 137.87 4rla n PRO 167 Ca -0.09 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.43 4rla n PRO 167 Cb 0.49 -1.36 0.04 0.00 -0.02 0.00 0.00 33.50 32.64 4rla n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4rla s ILE 169 N -0.88 0.11 0.26 0.00 -4.36 -0.99 -5.00 121.20 110.35 4rla s ILE 169 Ca 0.11 -0.95 0.08 0.00 -0.26 0.00 0.00 60.65 59.63 4rla s ILE 169 Cb 0.08 -0.32 -0.04 0.00 1.25 0.00 0.00 42.46 43.43 4rla s ILE 169 CO 0.14 -0.52 0.13 -0.94 0.24 0.00 0.00 174.94 173.99 4rla s SER 170 N -1.53 5.16 0.45 4.36 1.04 -1.26 -0.61 113.70 121.31 4rla s SER 170 Ca -0.15 -0.41 0.28 0.00 0.48 0.00 0.00 55.95 56.15 4rla s SER 170 Cb -0.09 -1.18 1.34 0.00 0.10 0.00 0.00 66.02 66.19 4rla s SER 170 CO -0.01 -0.04 1.72 0.00 0.98 0.00 0.00 173.24 175.89 4rla h ALA 171 N 1.62 2.68 0.00 5.32 0.00 -1.96 0.47 119.26 127.39 4rla h ALA 171 Ca -0.47 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.49 4rla h ALA 171 Cb 1.24 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.13 4rla h ALA 171 CO 0.61 -1.15 0.00 1.17 0.00 0.00 0.00 179.25 179.88 4rla n LYS 172 N -4.50 0.69 0.00 0.00 3.00 -1.26 -3.34 118.16 112.75 4rla n LYS 172 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.61 4rla n LYS 172 Cb 1.19 -1.22 0.00 0.00 0.00 0.00 0.00 35.03 35.01 4rla n LYS 172 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 4rla n ASP 173 N -0.72 1.30 -4.19 3.14 8.00 0.16 -4.95 116.55 119.29 4rla n ASP 173 Ca 0.07 -1.42 -0.26 0.00 0.71 0.00 0.00 54.79 53.89 4rla n ASP 173 Cb 0.03 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 40.98 4rla n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 4rla s ILE 174 N -0.42 1.51 -0.09 0.53 2.07 -1.21 -1.46 121.20 122.12 4rla s ILE 174 Ca 0.00 -0.83 0.00 0.00 -1.41 0.00 0.00 60.65 58.41 4rla s ILE 174 Cb 0.00 -1.26 0.02 0.00 0.13 0.00 0.00 42.46 41.36 4rla s ILE 174 CO 0.00 0.41 -0.09 -0.69 -1.91 0.00 0.00 174.94 172.66 4rla s VAL 175 N -0.47 1.00 -0.01 4.00 1.01 -0.31 -4.09 120.40 121.53 4rla s VAL 175 Ca 0.07 -0.32 -0.14 0.00 0.00 0.00 0.00 61.98 61.59 4rla s VAL 175 Cb -0.07 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.26 4rla s VAL 175 CO -0.01 0.35 0.39 -0.31 0.00 0.00 0.00 175.10 175.53 4rla s TYR 176 N 1.33 3.72 -0.05 5.22 2.02 -1.04 -0.34 117.35 128.20 4rla s TYR 176 Ca -0.02 0.97 -0.00 0.00 -0.37 0.00 0.00 57.07 57.64 4rla s TYR 176 Cb -0.14 -2.27 0.03 0.00 -0.40 0.00 0.00 41.96 39.18 4rla s TYR 176 CO -0.04 0.65 -0.02 0.42 -1.57 0.00 0.00 175.55 175.00 4rla s ILE 177 N -1.07 0.38 0.00 2.71 1.01 0.00 -0.07 121.20 124.16 4rla s ILE 177 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.91 4rla s ILE 177 Cb -0.16 -0.48 0.00 0.00 0.01 0.00 0.00 42.46 41.83 4rla s ILE 177 CO 0.13 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.90 4rla n GLY 178 N 4.50 0.91 3.74 6.18 0.00 -0.07 -1.64 105.19 118.81 4rla n GLY 178 Ca -0.18 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 4rla n GLY 178 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4rla s LEU 179 N 0.00 4.35 0.00 0.99 1.43 -1.17 -4.04 118.68 120.24 4rla s LEU 179 Ca 0.00 2.93 0.00 0.00 -1.03 0.00 0.00 54.13 56.03 4rla s LEU 179 Cb 0.00 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.60 4rla s LEU 179 CO 0.00 -0.95 0.00 -2.11 0.23 0.00 0.00 176.35 173.53 4rla n ARG 180 N 2.82 0.00 -3.01 1.70 1.85 -0.48 -1.66 116.66 117.87 4rla n ARG 180 Ca 0.11 -0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.81 4rla n ARG 180 Cb 0.36 -0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.75 4rla n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 4rla n ASP 181 N 0.00 -1.81 -4.44 2.89 2.03 -0.40 -5.03 116.55 109.79 4rla n ASP 181 Ca 0.00 -2.82 -0.33 0.00 0.52 0.00 0.00 54.79 52.16 4rla n ASP 181 Cb 0.46 0.67 -0.13 0.00 -0.72 0.00 0.00 41.12 41.40 4rla n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 4rla s VAL 182 N 0.20 3.43 0.63 5.18 1.01 -1.26 -4.55 120.40 125.03 4rla s VAL 182 Ca 0.32 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.62 4rla s VAL 182 Cb 0.10 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 4rla s VAL 182 CO -0.15 0.52 1.08 -1.81 0.00 0.00 0.00 175.10 174.74 4rla s ASP 183 N 0.21 5.47 0.26 3.32 1.01 -1.26 -4.82 116.67 120.86 4rla s ASP 183 Ca -0.06 1.88 -0.02 0.00 0.71 0.00 0.00 52.55 55.07 4rla s ASP 183 Cb -0.15 -2.54 0.46 0.00 1.01 0.00 0.00 42.92 41.71 4rla s ASP 183 CO 0.04 -1.38 1.84 -0.65 0.21 0.00 0.00 175.17 175.23 4rla h PRO 184 N 0.20 0.93 -0.18 8.23 0.11 -1.99 0.11 132.00 139.42 4rla h PRO 184 Ca -0.47 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 4rla h PRO 184 Cb 1.23 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 4rla h PRO 184 CO 0.56 0.61 0.04 0.78 -0.21 0.00 0.00 178.00 179.79 4rla h GLY 185 N 0.96 0.30 1.45 -0.55 0.00 -1.92 -0.80 103.07 102.52 4rla h GLY 185 Ca 0.45 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.57 4rla h GLY 185 CO -0.24 0.18 0.24 0.83 0.00 0.00 0.00 176.54 177.55 4rla h GLU 186 N 0.10 0.72 -0.15 4.80 5.08 -1.60 -0.40 114.58 123.12 4rla h GLU 186 Ca 0.06 -0.08 -0.16 0.00 -1.00 0.00 0.00 59.36 58.17 4rla h GLU 186 Cb 0.26 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 4rla h GLU 186 CO 0.00 0.56 -0.57 1.25 -1.00 0.00 0.00 179.01 179.25 4rla h HIS 187 N 0.72 0.59 -0.48 4.33 2.76 -0.60 -1.21 115.15 121.26 4rla h HIS 187 Ca 0.18 -0.22 -0.03 0.00 -2.20 0.00 0.00 60.37 58.10 4rla h HIS 187 Cb 0.08 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 28.91 4rla h HIS 187 CO 0.01 0.93 0.17 -0.92 -1.30 0.00 0.00 177.93 176.82 4rla h TYR 188 N 0.35 0.76 0.14 5.26 3.20 -0.24 -1.94 116.97 124.50 4rla h TYR 188 Ca 0.00 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 4rla h TYR 188 Cb 1.10 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.15 4rla h TYR 188 CO 0.04 0.65 -0.06 0.82 -1.64 0.00 0.00 178.16 177.97 4rla h ILE 189 N 0.65 0.91 -0.27 1.81 2.04 -0.91 0.57 117.51 122.31 4rla h ILE 189 Ca 0.16 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.77 4rla h ILE 189 Cb 0.23 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 4rla h ILE 189 CO -0.01 0.04 -0.13 0.16 0.00 0.00 0.00 178.15 178.22 4rla h ILE 190 N -0.27 1.23 0.02 -0.67 3.07 -1.21 -0.90 117.51 118.78 4rla h ILE 190 Ca -0.02 -1.00 -0.00 0.00 1.55 0.00 0.00 64.86 65.39 4rla h ILE 190 Cb 0.21 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 37.92 4rla h ILE 190 CO 0.03 0.32 -0.01 0.11 -1.05 0.00 0.00 178.15 177.55 4rla h LYS 191 N 0.43 -0.03 -0.28 0.16 1.79 -1.25 -1.98 116.57 115.41 4rla h LYS 191 Ca 0.08 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.57 4rla h LYS 191 Cb 0.48 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.12 4rla h LYS 191 CO 0.03 0.53 0.16 1.15 -1.08 0.00 0.00 179.45 180.23 4rla h THR 192 N -0.61 1.02 0.00 -0.16 2.02 -0.82 -2.52 112.91 111.84 4rla h THR 192 Ca -0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 4rla h THR 192 Cb 0.57 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 4rla h THR 192 CO 0.01 0.06 0.00 0.18 0.37 0.00 0.00 175.52 176.13 4rla n LEU 193 N -4.94 0.58 -1.92 2.58 4.32 -0.35 -4.93 117.00 112.33 4rla n LEU 193 Ca -0.01 0.61 -0.11 0.00 -0.02 0.00 0.00 56.01 56.47 4rla n LEU 193 Cb 0.05 -0.49 0.04 0.00 -1.62 0.00 0.00 43.42 41.40 4rla n LEU 193 CO 0.32 -0.38 0.10 0.61 -1.22 0.00 0.00 177.39 176.83 4rla n GLY 194 N 0.47 0.23 3.75 -0.72 0.00 -0.83 -4.90 105.19 103.19 4rla n GLY 194 Ca 0.04 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 4rla n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4rla s ILE 195 N -3.11 4.01 -0.09 -0.61 1.01 -0.81 -4.86 121.20 116.74 4rla s ILE 195 Ca 0.26 2.01 -0.28 0.00 0.00 0.00 0.00 60.65 62.64 4rla s ILE 195 Cb -0.12 -4.27 -0.02 0.00 0.01 0.00 0.00 42.46 38.06 4rla s ILE 195 CO 0.33 0.47 0.91 -0.75 0.00 0.00 0.00 174.94 175.89 4rla s LYS 196 N -1.26 4.42 0.04 2.79 2.47 -1.26 -4.91 119.74 122.04 4rla s LYS 196 Ca 0.42 1.23 -0.05 0.00 -1.56 0.00 0.00 55.97 56.00 4rla s LYS 196 Cb -0.26 -3.52 -0.01 0.00 -1.46 0.00 0.00 37.83 32.58 4rla s LYS 196 CO 0.33 -0.21 0.10 1.52 0.16 0.00 0.00 175.35 177.24 4rla s TYR 197 N 1.66 0.20 -0.36 4.03 1.13 -1.26 -2.51 117.35 120.23 4rla s TYR 197 Ca 0.45 -0.50 0.01 0.00 -1.41 0.00 0.00 57.07 55.62 4rla s TYR 197 Cb -0.18 -0.14 0.11 0.00 -1.10 0.00 0.00 41.96 40.65 4rla s TYR 197 CO 0.19 -0.36 0.13 -0.06 -2.51 0.00 0.00 175.55 172.94 4rla s PHE 198 N -2.59 2.24 0.93 -3.49 0.08 0.90 -4.92 117.98 111.13 4rla s PHE 198 Ca -0.05 -2.23 -0.13 0.00 0.12 0.00 0.00 56.93 54.64 4rla s PHE 198 Cb -0.01 -2.04 0.20 0.00 -0.57 0.00 0.00 43.02 40.60 4rla s PHE 198 CO -0.04 -0.86 1.27 -1.54 -0.10 0.00 0.00 175.22 173.95 4rla s SER 199 N 1.05 3.17 0.42 1.36 1.04 -1.26 -0.89 113.70 118.59 4rla s SER 199 Ca 0.13 0.01 0.13 0.00 0.48 0.00 0.00 55.95 56.70 4rla s SER 199 Cb -0.20 -0.04 1.00 0.00 0.10 0.00 0.00 66.02 66.87 4rla s SER 199 CO -0.14 -2.68 1.95 0.24 0.98 0.00 0.00 173.24 173.60 4rla h MET 200 N -1.48 0.45 -0.28 4.02 2.86 -1.56 -1.56 114.93 117.38 4rla h MET 200 Ca -0.42 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.09 4rla h MET 200 Cb 1.23 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.77 4rla h MET 200 CO 0.34 0.30 -0.26 1.79 1.06 0.00 0.00 176.91 180.13 4rla h THR 201 N 0.46 1.27 -0.28 2.22 1.35 -1.93 0.30 112.91 116.31 4rla h THR 201 Ca 0.32 -1.31 -0.18 0.00 -0.55 0.00 0.00 66.41 64.69 4rla h THR 201 Cb 0.62 1.34 -0.00 0.00 -1.73 0.00 0.00 68.15 68.38 4rla h THR 201 CO -0.10 0.42 -0.52 -0.33 -0.25 0.00 0.00 175.52 174.74 4rla h GLU 202 N 0.48 0.81 -0.51 4.72 3.07 -1.66 -0.62 114.58 120.87 4rla h GLU 202 Ca 0.07 -0.50 -0.07 0.00 -0.50 0.00 0.00 59.36 58.36 4rla h GLU 202 Cb 0.70 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.64 4rla h GLU 202 CO 0.05 1.13 0.02 0.28 -1.40 0.00 0.00 179.01 179.09 4rla h VAL 203 N 0.63 1.24 -0.61 3.13 2.07 -1.03 0.19 116.25 121.87 4rla h VAL 203 Ca 0.02 -1.00 -0.10 0.00 0.82 0.00 0.00 66.70 66.44 4rla h VAL 203 Cb 1.11 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 4rla h VAL 203 CO 0.11 0.36 -0.01 0.44 0.02 0.00 0.00 177.57 178.49 4rla h ASP 204 N 0.79 1.06 0.09 0.57 3.32 -0.73 0.33 116.42 121.86 4rla h ASP 204 Ca 0.16 -0.31 -0.23 0.00 0.02 0.00 0.00 57.03 56.67 4rla h ASP 204 Cb 0.44 -0.29 0.01 0.00 0.22 0.00 0.00 39.33 39.71 4rla h ASP 204 CO 0.02 1.12 -0.87 0.50 -1.72 0.00 0.00 179.24 178.28 4rla h LYS 205 N 0.98 0.60 0.00 3.56 3.64 -0.50 -3.37 116.57 121.48 4rla h LYS 205 Ca 0.17 -0.56 -0.29 0.00 -1.27 0.00 0.00 60.65 58.70 4rla h LYS 205 Cb 0.58 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.48 4rla h LYS 205 CO 0.03 1.18 -2.21 1.28 -2.27 0.00 0.00 179.45 177.46 4rla n LEU 206 N -3.85 0.00 0.00 5.20 4.77 0.60 -5.09 117.00 118.63 4rla n LEU 206 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 4rla n LEU 206 Cb 0.79 0.39 0.00 0.00 -2.33 0.00 0.00 43.42 42.27 4rla n LEU 206 CO 0.52 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 4rla n GLY 207 N 1.81 -0.67 0.45 -0.72 0.00 0.12 -4.14 105.19 102.03 4rla n GLY 207 Ca -0.26 -1.43 0.27 0.00 0.00 0.00 0.00 46.02 44.60 4rla n GLY 207 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 4rla h ILE 208 N 0.00 0.58 0.52 -0.61 6.09 -1.94 -2.40 117.51 119.75 4rla h ILE 208 Ca 0.00 -0.02 -0.03 0.00 -1.37 0.00 0.00 64.86 63.45 4rla h ILE 208 Cb 0.00 0.52 0.01 0.00 0.47 0.00 0.00 36.82 37.81 4rla h ILE 208 CO 0.00 0.01 -0.25 1.23 -3.07 0.00 0.00 178.15 176.07 4rla h GLY 209 N 0.05 -0.73 1.58 8.18 0.00 -1.96 -2.43 103.07 107.77 4rla h GLY 209 Ca 0.42 0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.98 4rla h GLY 209 CO -0.03 -0.26 0.03 1.70 0.00 0.00 0.00 176.54 177.97 4rla h LYS 210 N -0.72 0.53 0.28 4.80 1.63 -1.60 -1.55 116.57 119.94 4rla h LYS 210 Ca -0.07 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.62 4rla h LYS 210 Cb 0.55 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 4rla h LYS 210 CO 0.12 0.54 -0.18 0.28 -3.45 0.00 0.00 179.45 176.75 4rla h VAL 211 N 0.52 0.61 -0.76 2.00 2.07 -1.36 -1.09 116.25 118.23 4rla h VAL 211 Ca 0.11 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.59 4rla h VAL 211 Cb 0.29 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 4rla h VAL 211 CO 0.01 0.00 0.30 0.24 0.02 0.00 0.00 177.57 178.14 4rla h MET 212 N -0.45 1.13 -0.97 1.57 2.86 -1.25 -0.29 114.93 117.53 4rla h MET 212 Ca -0.03 -0.20 0.05 0.00 -2.06 0.00 0.00 59.70 57.47 4rla h MET 212 Cb 0.38 -0.19 -0.06 0.00 0.06 0.00 0.00 31.60 31.79 4rla h MET 212 CO 0.02 0.92 0.62 1.49 1.06 0.00 0.00 176.91 181.02 4rla h GLU 213 N 1.10 1.13 0.14 1.72 4.81 -1.04 -2.29 114.58 120.16 4rla h GLU 213 Ca 0.25 -0.07 -0.31 0.00 -0.13 0.00 0.00 59.36 59.11 4rla h GLU 213 Cb 0.21 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.34 4rla h GLU 213 CO -0.02 0.75 -1.47 0.93 -0.73 0.00 0.00 179.01 178.47 4rla h GLU 214 N 1.16 0.30 -0.95 1.92 5.08 -0.78 -2.94 114.58 118.38 4rla h GLU 214 Ca 0.41 -0.52 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 4rla h GLU 214 Cb 0.10 0.19 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 4rla h GLU 214 CO -0.15 1.20 0.63 1.79 -1.00 0.00 0.00 179.01 181.47 4rla h THR 215 N 0.08 1.23 -0.09 1.13 1.35 -0.93 -0.36 112.91 115.32 4rla h THR 215 Ca -0.22 -0.44 -0.02 0.00 -0.55 0.00 0.00 66.41 65.18 4rla h THR 215 Cb 2.03 -0.15 -0.00 0.00 -1.73 0.00 0.00 68.15 68.30 4rla h THR 215 CO 0.19 0.23 -0.02 -0.26 -0.25 0.00 0.00 175.52 175.41 4rla h PHE 216 N 1.27 0.20 0.00 4.73 0.04 -1.50 -0.17 116.94 121.52 4rla h PHE 216 Ca 0.35 -0.04 -0.05 0.00 2.80 0.00 0.00 57.97 61.03 4rla h PHE 216 Cb -0.13 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 37.97 4rla h PHE 216 CO -0.00 0.49 -0.23 0.66 -0.60 0.00 0.00 178.31 178.63 4rla h SER 217 N -0.14 0.00 -0.02 2.17 4.64 -1.30 0.76 113.55 119.66 4rla h SER 217 Ca 0.02 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.31 4rla h SER 217 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 4rla h SER 217 CO 0.01 0.23 -0.13 0.22 -0.87 0.00 0.00 176.83 176.29 4rla h TYR 218 N 0.00 0.17 0.02 4.77 3.20 -0.92 -2.57 116.97 121.63 4rla h TYR 218 Ca -0.00 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 4rla h TYR 218 Cb 0.45 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.70 4rla h TYR 218 CO 0.00 0.80 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.24 4rla h LEU 219 N -0.51 -0.02 -3.12 2.82 3.38 -0.75 -3.35 115.31 113.76 4rla h LEU 219 Ca -0.01 -0.68 -0.18 0.00 0.09 0.00 0.00 57.88 57.11 4rla h LEU 219 Cb 0.82 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.47 4rla h LEU 219 CO 0.03 0.80 0.22 0.18 0.09 0.00 0.00 178.44 179.76 4rla n LEU 220 N -4.69 5.01 0.00 1.67 4.77 0.26 -4.73 117.00 119.29 4rla n LEU 220 Ca -0.07 -2.60 0.00 0.00 -0.03 0.00 0.00 56.01 53.30 4rla n LEU 220 Cb 0.34 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 4rla n LEU 220 CO 0.25 0.70 0.48 0.61 -1.33 0.00 0.00 177.39 178.10 4rla n GLY 221 N -0.08 -2.61 0.12 -0.72 0.00 -0.97 -4.32 105.19 96.60 4rla n GLY 221 Ca 0.31 0.12 -0.21 0.00 0.00 0.00 0.00 46.02 46.24 4rla n GLY 221 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 4rla h ARG 222 N 0.00 0.22 -4.85 1.61 3.08 -1.85 -3.47 114.38 109.12 4rla h ARG 222 Ca 0.00 -0.38 -0.47 0.00 0.07 0.00 0.00 59.98 59.19 4rla h ARG 222 Cb 0.00 0.14 -0.31 0.00 0.08 0.00 0.00 29.97 29.88 4rla h ARG 222 CO 0.00 1.18 -0.80 -1.59 -1.07 0.00 0.00 179.97 177.69 4rla s LYS 223 N -2.44 1.22 -0.12 0.04 0.00 -1.26 -5.11 119.74 112.08 4rla s LYS 223 Ca -0.19 -0.41 -0.30 0.00 0.00 0.00 0.00 55.97 55.08 4rla s LYS 223 Cb 0.03 -1.11 -0.01 0.00 0.00 0.00 0.00 37.83 36.74 4rla s LYS 223 CO 0.77 0.17 1.04 0.15 0.00 0.00 0.00 175.35 177.47 4rla s LYS 224 N 0.11 4.39 0.22 1.78 1.02 -1.26 -4.57 119.74 121.43 4rla s LYS 224 Ca -0.03 1.43 0.01 0.00 0.02 0.00 0.00 55.97 57.40 4rla s LYS 224 Cb -0.09 -3.56 -0.05 0.00 -0.52 0.00 0.00 37.83 33.61 4rla s LYS 224 CO 0.01 -0.39 0.08 -0.98 -0.92 0.00 0.00 175.35 173.15 4rla s ARG 225 N 2.24 1.26 0.31 1.68 1.70 -1.26 -5.13 118.95 119.74 4rla s ARG 225 Ca 0.49 -1.66 -0.30 0.00 -0.47 0.00 0.00 55.73 53.80 4rla s ARG 225 Cb -0.19 -0.12 -0.12 0.00 -0.57 0.00 0.00 34.95 33.95 4rla s ARG 225 CO 0.17 -0.27 1.55 -2.30 -1.08 0.00 0.00 175.30 173.37 4rla n PRO 226 N -0.34 2.63 -4.06 3.89 -0.02 -1.26 -4.86 135.00 130.98 4rla n PRO 226 Ca -0.02 0.93 -0.35 0.00 -2.02 0.00 0.00 63.50 62.05 4rla n PRO 226 Cb 0.65 -2.69 -0.09 0.00 -0.02 0.00 0.00 33.50 31.35 4rla n PRO 226 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 4rla s ILE 227 N -0.24 4.75 -0.29 4.25 1.01 -0.45 -1.18 121.20 129.06 4rla s ILE 227 Ca 0.62 -0.05 -0.01 0.00 0.00 0.00 0.00 60.65 61.20 4rla s ILE 227 Cb -0.51 -3.12 0.04 0.00 0.01 0.00 0.00 42.46 38.89 4rla s ILE 227 CO 0.52 0.49 -0.02 -2.28 0.00 0.00 0.00 174.94 173.65 4rla s HIS 228 N 0.11 3.22 -0.36 3.97 5.65 0.67 -1.06 115.29 127.49 4rla s HIS 228 Ca 0.05 -1.82 -0.17 0.00 0.25 0.00 0.00 55.06 53.37 4rla s HIS 228 Cb -0.12 -2.09 -0.00 0.00 -1.18 0.00 0.00 32.58 29.19 4rla s HIS 228 CO 0.01 -0.79 0.44 -1.17 -0.65 0.00 0.00 174.74 172.57 4rla s LEU 229 N 1.26 4.46 -0.31 8.88 2.96 0.50 -2.04 118.68 134.38 4rla s LEU 229 Ca -0.04 -0.21 -0.09 0.00 -0.22 0.00 0.00 54.13 53.56 4rla s LEU 229 Cb -0.19 -2.45 -0.00 0.00 0.50 0.00 0.00 46.19 44.05 4rla s LEU 229 CO -0.02 -0.43 0.15 -0.55 -1.32 0.00 0.00 176.35 174.18 4rla s SER 230 N 1.76 5.53 -0.32 3.68 0.15 -0.85 -0.99 113.70 122.65 4rla s SER 230 Ca 0.15 -0.56 -0.04 0.00 0.70 0.00 0.00 55.95 56.20 4rla s SER 230 Cb -0.16 -1.99 0.05 0.00 -1.71 0.00 0.00 66.02 62.20 4rla s SER 230 CO 0.13 -0.20 0.05 0.12 1.20 0.00 0.00 173.24 174.53 4rla s PHE 231 N 1.60 3.26 -0.21 3.44 2.19 0.46 -1.95 117.98 126.77 4rla s PHE 231 Ca 0.04 -1.69 -0.20 0.00 0.33 0.00 0.00 56.93 55.41 4rla s PHE 231 Cb -0.17 -2.19 -0.03 0.00 -1.31 0.00 0.00 43.02 39.32 4rla s PHE 231 CO 0.06 -0.78 0.58 0.34 1.83 0.00 0.00 175.22 177.26 4rla s ASP 232 N 1.33 6.60 0.58 6.13 -1.08 -0.16 -1.39 116.67 128.68 4rla s ASP 232 Ca -0.04 0.73 0.29 0.00 -0.52 0.00 0.00 52.55 53.01 4rla s ASP 232 Cb -0.20 -2.32 1.49 0.00 -1.46 0.00 0.00 42.92 40.43 4rla s ASP 232 CO 0.00 -0.26 1.93 0.58 0.52 0.00 0.00 175.17 177.94 4rla h VAL 233 N 5.23 0.42 0.00 1.11 2.07 -1.75 -0.46 116.25 122.87 4rla h VAL 233 Ca -0.31 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.21 4rla h VAL 233 Cb 1.14 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 4rla h VAL 233 CO 0.76 0.00 0.00 -0.90 0.02 0.00 0.00 177.57 177.45 4rla n ASP 234 N -3.83 0.00 0.23 0.57 5.68 -1.26 -2.63 116.55 115.32 4rla n ASP 234 Ca 0.08 -1.24 0.12 0.00 -0.50 0.00 0.00 54.79 53.26 4rla n ASP 234 Cb 0.65 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 40.98 4rla n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 4rla h GLY 235 N 4.12 0.00 -2.72 6.12 0.00 -1.34 -3.34 103.07 105.90 4rla h GLY 235 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.85 4rla h GLY 235 CO 0.00 0.00 -0.20 1.08 0.00 0.00 0.00 176.54 177.42 4rla s LEU 236 N -6.32 4.03 0.55 3.11 1.43 -1.08 -1.95 118.68 118.46 4rla s LEU 236 Ca 0.04 0.44 -0.21 0.00 -1.03 0.00 0.00 54.13 53.37 4rla s LEU 236 Cb 0.07 -3.29 -0.05 0.00 0.03 0.00 0.00 46.19 42.95 4rla s LEU 236 CO 0.64 -0.28 1.29 -0.62 0.23 0.00 0.00 176.35 177.61 4rla s ASP 237 N -4.01 5.32 0.48 2.29 2.15 0.15 -4.61 116.67 118.45 4rla s ASP 237 Ca 0.40 2.61 0.26 0.00 0.43 0.00 0.00 52.55 56.25 4rla s ASP 237 Cb -0.10 -2.62 1.42 0.00 -0.30 0.00 0.00 42.92 41.33 4rla s ASP 237 CO 0.36 -1.52 1.77 -0.65 -0.17 0.00 0.00 175.17 174.96 4rla h PRO 238 N 1.36 0.00 0.00 4.34 0.11 -1.86 0.22 132.00 136.17 4rla h PRO 238 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 4rla h PRO 238 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 4rla h PRO 238 CO 0.57 0.00 0.00 1.55 -0.21 0.00 0.00 178.00 179.91 4rla n VAL 239 N -2.53 0.70 -0.09 3.15 3.14 -1.26 -2.37 118.33 119.06 4rla n VAL 239 Ca -0.02 -0.05 -0.16 0.00 -2.96 0.00 0.00 64.34 61.15 4rla n VAL 239 Cb 0.21 -0.84 -0.07 0.00 -1.06 0.00 0.00 33.84 32.07 4rla n VAL 239 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 4rla n PHE 240 N -2.25 0.00 -3.03 1.45 3.72 0.73 -4.81 117.46 113.26 4rla n PHE 240 Ca 0.04 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.19 4rla n PHE 240 Cb 0.34 -0.68 -0.04 0.00 -0.94 0.00 0.00 39.48 38.16 4rla n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 4rla n THR 241 N -3.43 2.26 0.10 4.37 -2.24 -0.93 -3.89 114.28 110.53 4rla n THR 241 Ca -0.34 -5.32 0.08 0.00 -2.27 0.00 0.00 64.05 56.20 4rla n THR 241 Cb 0.80 -1.21 0.54 0.00 -2.10 0.00 0.00 70.33 68.36 4rla n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 4rla h PRO 242 N 3.08 0.26 -5.38 -0.78 0.13 -1.73 -3.37 132.00 124.21 4rla h PRO 242 Ca 0.13 -0.02 -0.69 0.00 -0.87 0.00 0.00 66.00 64.55 4rla h PRO 242 Cb 0.62 -0.06 -0.09 0.00 0.13 0.00 0.00 31.00 31.60 4rla h PRO 242 CO 0.74 0.17 2.22 0.00 -0.23 0.00 0.00 178.00 180.91 4rla n ALA 243 N -2.52 3.93 -2.96 -0.56 0.00 -1.26 -4.81 120.51 112.33 4rla n ALA 243 Ca 0.02 -3.92 -0.10 0.00 0.00 0.00 0.00 53.44 49.43 4rla n ALA 243 Cb 0.14 -3.51 -0.06 0.00 0.00 0.00 0.00 19.45 16.02 4rla n ALA 243 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 4rla s THR 244 N 3.62 0.00 0.07 0.00 -4.23 -1.26 -1.61 115.64 112.23 4rla s THR 244 Ca 0.51 -1.54 -0.14 0.00 -1.18 0.00 0.00 61.69 59.34 4rla s THR 244 Cb 0.05 -2.33 -0.25 0.00 1.34 0.00 0.00 72.50 71.31 4rla s THR 244 CO 0.04 0.00 1.17 1.23 -0.54 0.00 0.00 174.62 176.52 4rla h GLY 245 N 2.30 0.76 -6.29 3.99 0.00 -1.90 -3.41 103.07 98.52 4rla h GLY 245 Ca -0.28 -1.39 -0.59 0.00 0.00 0.00 0.00 47.33 45.08 4rla h GLY 245 CO 0.39 1.22 -0.88 2.41 0.00 0.00 0.00 176.54 179.69 4rla n THR 246 N -3.86 0.27 -2.38 4.70 -1.04 -1.26 -5.11 114.28 105.61 4rla n THR 246 Ca -0.12 -4.30 -0.39 0.00 -2.04 0.00 0.00 64.05 57.21 4rla n THR 246 Cb 0.90 -1.96 -0.03 0.00 -1.82 0.00 0.00 70.33 67.42 4rla n THR 246 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 4rla s PRO 247 N -1.26 4.28 -0.04 -2.82 0.04 -1.26 -4.96 135.00 128.97 4rla s PRO 247 Ca 0.34 1.80 0.02 0.00 0.04 0.00 0.00 61.00 63.20 4rla s PRO 247 Cb 0.10 -2.84 0.01 0.00 0.04 0.00 0.00 34.50 31.81 4rla s PRO 247 CO -0.11 -0.11 -0.08 0.08 0.04 0.00 0.00 177.00 176.81 4rla s VAL 248 N -1.36 0.79 0.79 -0.36 1.01 -1.26 -5.04 120.40 114.97 4rla s VAL 248 Ca 0.53 -0.32 -0.11 0.00 0.00 0.00 0.00 61.98 62.08 4rla s VAL 248 Cb -0.30 -0.74 0.07 0.00 0.00 0.00 0.00 36.38 35.41 4rla s VAL 248 CO 0.39 0.26 1.11 0.68 0.00 0.00 0.00 175.10 177.54 4rla s VAL 249 N 0.51 2.99 -0.25 2.92 -7.23 -1.26 -4.02 120.40 114.06 4rla s VAL 249 Ca -0.09 0.34 -0.00 0.00 -1.81 0.00 0.00 61.98 60.43 4rla s VAL 249 Cb -0.12 -2.73 0.00 0.00 0.56 0.00 0.00 36.38 34.09 4rla s VAL 249 CO 0.01 -0.40 0.03 0.61 -0.31 0.00 0.00 175.10 175.04 4rla n GLY 250 N -0.75 0.32 1.69 2.32 0.00 -1.26 -5.03 105.19 102.48 4rla n GLY 250 Ca 0.10 -0.73 -0.12 0.00 0.00 0.00 0.00 46.02 45.28 4rla n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4rla n GLY 251 N -0.96 -0.57 3.76 -0.02 0.00 -1.26 -4.95 105.19 101.20 4rla n GLY 251 Ca -0.03 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.84 4rla n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4rla s LEU 252 N 0.00 3.66 0.56 0.99 1.43 -0.82 -4.28 118.68 120.23 4rla s LEU 252 Ca 0.31 2.23 -0.03 0.00 -1.03 0.00 0.00 54.13 55.62 4rla s LEU 252 Cb -0.01 -4.58 0.02 0.00 0.03 0.00 0.00 46.19 41.64 4rla s LEU 252 CO 0.22 -1.43 0.84 -0.94 0.23 0.00 0.00 176.35 175.26 4rla s SER 253 N -1.81 5.49 0.26 2.29 1.04 -1.26 -0.67 113.70 119.04 4rla s SER 253 Ca 0.74 0.45 -0.02 0.00 0.48 0.00 0.00 55.95 57.59 4rla s SER 253 Cb -0.26 -1.44 0.44 0.00 0.10 0.00 0.00 66.02 64.86 4rla s SER 253 CO 0.31 -1.06 1.85 0.22 0.98 0.00 0.00 173.24 175.55 4rla h TYR 254 N -0.04 1.11 -0.06 5.02 3.20 -1.96 0.20 116.97 124.43 4rla h TYR 254 Ca -0.45 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.45 4rla h TYR 254 Cb 1.27 -0.36 -0.00 0.00 1.54 0.00 0.00 36.73 39.18 4rla h TYR 254 CO 0.43 0.52 0.02 0.00 -1.64 0.00 0.00 178.16 177.49 4rla h ARG 255 N 1.04 0.10 -0.95 1.82 3.08 -1.99 -1.59 114.38 115.89 4rla h ARG 255 Ca 0.44 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.47 4rla h ARG 255 Cb 0.29 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.28 4rla h ARG 255 CO -0.21 0.27 0.59 0.93 -1.07 0.00 0.00 179.97 180.47 4rla h GLU 256 N -0.09 1.28 -0.90 0.04 5.08 -1.71 0.86 114.58 119.15 4rla h GLU 256 Ca 0.02 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 4rla h GLU 256 Cb 0.21 -0.27 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 4rla h GLU 256 CO -0.00 0.88 0.50 0.78 -1.00 0.00 0.00 179.01 180.17 4rla h GLY 257 N 1.30 1.33 1.73 -3.84 0.00 -0.43 -2.12 103.07 101.05 4rla h GLY 257 Ca 0.34 -0.60 -0.20 0.00 0.00 0.00 0.00 47.33 46.87 4rla h GLY 257 CO -0.07 0.57 -0.88 1.41 0.00 0.00 0.00 176.54 177.57 4rla h LEU 258 N 1.25 0.31 -0.81 3.11 3.38 -0.54 -3.09 115.31 118.93 4rla h LEU 258 Ca 0.32 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 4rla h LEU 258 Cb 0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 4rla h LEU 258 CO -0.05 1.05 0.37 0.22 0.09 0.00 0.00 178.44 180.12 4rla h TYR 259 N 0.14 1.18 0.66 1.13 3.20 -0.47 -0.18 116.97 122.62 4rla h TYR 259 Ca -0.05 -0.07 -0.03 0.00 3.14 0.00 0.00 58.73 61.72 4rla h TYR 259 Cb 1.51 -0.36 0.01 0.00 1.54 0.00 0.00 36.73 39.42 4rla h TYR 259 CO 0.04 0.87 -0.33 0.82 -1.64 0.00 0.00 178.16 177.92 4rla h ILE 260 N 1.15 0.34 -0.24 1.81 2.04 -1.41 -1.24 117.51 119.96 4rla h ILE 260 Ca 0.27 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.13 4rla h ILE 260 Cb 0.15 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 4rla h ILE 260 CO -0.03 0.00 0.13 0.71 0.00 0.00 0.00 178.15 178.96 4rla h THR 261 N -0.90 1.08 -0.60 -0.27 1.35 -1.45 -1.55 112.91 110.57 4rla h THR 261 Ca -0.09 -0.21 -0.08 0.00 -0.55 0.00 0.00 66.41 65.48 4rla h THR 261 Cb 0.69 0.76 -0.02 0.00 -1.73 0.00 0.00 68.15 67.85 4rla h THR 261 CO 0.14 0.09 0.06 -0.33 -0.25 0.00 0.00 175.52 175.23 4rla h GLU 262 N 0.33 1.02 0.00 4.72 5.08 -0.72 -1.81 114.58 123.20 4rla h GLU 262 Ca 0.09 -0.29 -0.12 0.00 -1.00 0.00 0.00 59.36 58.03 4rla h GLU 262 Cb 0.02 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 4rla h GLU 262 CO -0.01 0.98 -0.58 0.93 -1.00 0.00 0.00 179.01 179.32 4rla h GLU 263 N 0.92 0.00 -0.45 2.33 4.39 -0.62 -2.79 114.58 118.37 4rla h GLU 263 Ca 0.18 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.81 4rla h GLU 263 Cb 0.48 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 4rla h GLU 263 CO 0.02 0.58 0.02 0.82 -1.16 0.00 0.00 179.01 179.29 4rla h ILE 264 N 0.00 1.26 -0.73 3.13 1.08 -0.92 -2.93 117.51 118.40 4rla h ILE 264 Ca -0.01 -1.01 -0.03 0.00 -0.39 0.00 0.00 64.86 63.42 4rla h ILE 264 Cb 1.08 1.04 -0.03 0.00 -3.07 0.00 0.00 36.82 35.84 4rla h ILE 264 CO 0.08 0.35 0.34 0.22 -0.69 0.00 0.00 178.15 178.45 4rla h TYR 265 N 0.62 1.06 -0.57 1.37 3.20 -1.24 -2.96 116.97 118.46 4rla h TYR 265 Ca 0.13 -0.06 0.11 0.00 3.14 0.00 0.00 58.73 62.06 4rla h TYR 265 Cb 0.47 -0.33 -0.09 0.00 1.54 0.00 0.00 36.73 38.32 4rla h TYR 265 CO 0.04 0.79 0.05 0.87 -1.64 0.00 0.00 178.16 178.26 4rla h LYS 266 N 1.02 0.16 -0.46 1.82 6.56 -1.32 -0.65 116.57 123.70 4rla h LYS 266 Ca 0.25 -0.01 0.08 0.00 -1.06 0.00 0.00 60.65 59.91 4rla h LYS 266 Cb 0.13 -0.04 -0.03 0.00 -0.57 0.00 0.00 32.23 31.73 4rla h LYS 266 CO -0.03 0.11 0.31 1.79 -2.06 0.00 0.00 179.45 179.57 4rla h THR 267 N 0.17 0.90 -1.17 -0.16 1.35 -1.39 -3.46 112.91 109.15 4rla h THR 267 Ca 0.30 -0.09 -0.26 0.00 -0.55 0.00 0.00 66.41 65.81 4rla h THR 267 Cb 0.46 0.61 -0.06 0.00 -1.73 0.00 0.00 68.15 67.43 4rla h THR 267 CO -0.45 0.05 -0.28 0.61 -0.25 0.00 0.00 175.52 175.20 4rla n GLY 268 N -1.54 0.64 0.35 5.82 0.00 -0.25 -4.89 105.19 105.31 4rla n GLY 268 Ca 0.07 -0.40 0.03 0.00 0.00 0.00 0.00 46.02 45.72 4rla n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 4rla n LEU 269 N -1.62 2.43 -4.70 0.99 4.32 -1.26 -5.02 117.00 112.14 4rla n LEU 269 Ca -0.14 -1.90 -0.42 0.00 -0.02 0.00 0.00 56.01 53.54 4rla n LEU 269 Cb 0.51 -0.12 -0.03 0.00 -1.62 0.00 0.00 43.42 42.16 4rla n LEU 269 CO 0.18 0.60 1.27 -0.22 -1.22 0.00 0.00 177.39 178.00 4rla s LEU 270 N -0.95 4.37 0.00 2.23 2.96 -1.26 -1.34 118.68 124.69 4rla s LEU 270 Ca 0.13 2.53 0.00 0.00 -0.22 0.00 0.00 54.13 56.57 4rla s LEU 270 Cb 0.07 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.18 4rla s LEU 270 CO 0.09 -0.84 0.00 -0.24 -1.32 0.00 0.00 176.35 174.04 4rla n SER 271 N 4.77 4.35 -3.78 3.68 2.88 -0.22 -4.88 113.62 120.42 4rla n SER 271 Ca 0.15 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.56 4rla n SER 271 Cb 0.40 0.51 -0.11 0.00 -0.75 0.00 0.00 64.21 64.26 4rla n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 4rla s GLY 272 N -2.56 -0.20 -0.02 0.46 0.00 -1.19 -2.93 107.32 100.88 4rla s GLY 272 Ca 0.00 0.72 0.01 0.00 0.00 0.00 0.00 44.72 45.45 4rla s GLY 272 CO 0.00 0.61 -0.02 -2.27 0.00 0.00 0.00 173.10 171.42 4rla s LEU 273 N -0.02 1.57 -0.13 0.66 1.98 -0.34 -0.37 118.68 122.03 4rla s LEU 273 Ca -0.02 -0.05 0.02 0.00 -2.89 0.00 0.00 54.13 51.19 4rla s LEU 273 Cb -0.02 -0.22 0.01 0.00 0.66 0.00 0.00 46.19 46.62 4rla s LEU 273 CO 0.01 -0.03 -0.20 -1.81 -1.89 0.00 0.00 176.35 172.43 4rla s ASP 274 N 0.50 2.93 -0.50 3.68 1.01 -0.16 -0.86 116.67 123.26 4rla s ASP 274 Ca -0.05 -0.56 -0.04 0.00 0.71 0.00 0.00 52.55 52.61 4rla s ASP 274 Cb -0.08 -1.35 0.13 0.00 1.01 0.00 0.00 42.92 42.63 4rla s ASP 274 CO -0.01 0.05 0.32 -0.63 0.21 0.00 0.00 175.17 175.12 4rla s ILE 275 N 0.91 3.66 0.45 0.77 -1.09 -0.63 -0.41 121.20 124.85 4rla s ILE 275 Ca -0.06 -2.30 0.07 0.00 -2.23 0.00 0.00 60.65 56.13 4rla s ILE 275 Cb -0.15 -3.44 -0.02 0.00 -1.58 0.00 0.00 42.46 37.27 4rla s ILE 275 CO -0.03 -0.78 0.32 -0.04 -1.23 0.00 0.00 174.94 173.19 4rla s MET 276 N 0.77 2.37 -0.07 2.79 -1.94 -0.49 -1.17 119.30 121.57 4rla s MET 276 Ca 0.11 -1.75 0.00 0.00 -1.71 0.00 0.00 55.69 52.34 4rla s MET 276 Cb -0.22 -2.18 0.00 0.00 2.01 0.00 0.00 34.83 34.43 4rla s MET 276 CO -0.03 -0.27 0.00 0.39 -0.01 0.00 0.00 175.02 175.09 4rla n GLU 277 N -1.50 -1.67 -2.39 2.03 -0.58 -0.32 -2.27 120.64 113.94 4rla n GLU 277 Ca 0.01 0.45 -0.41 0.00 -0.42 0.00 0.00 57.16 56.79 4rla n GLU 277 Cb 0.63 -4.72 -0.03 0.00 -0.57 0.00 0.00 31.44 26.76 4rla n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 4rla s VAL 278 N -1.21 3.72 -0.49 2.62 1.01 -1.26 -4.36 120.40 120.43 4rla s VAL 278 Ca 0.00 0.55 -0.10 0.00 0.00 0.00 0.00 61.98 62.43 4rla s VAL 278 Cb 0.00 -4.49 0.12 0.00 0.00 0.00 0.00 36.38 32.01 4rla s VAL 278 CO 0.00 -1.30 0.38 0.21 0.00 0.00 0.00 175.10 174.39 4rla s ASN 279 N 4.71 5.80 0.62 3.32 3.84 -0.63 -3.79 114.94 128.81 4rla s ASN 279 Ca 0.50 -1.91 0.36 0.00 0.21 0.00 0.00 52.86 52.02 4rla s ASN 279 Cb -0.10 -2.05 2.08 0.00 -0.55 0.00 0.00 41.25 40.63 4rla s ASN 279 CO 0.22 -0.72 2.30 -0.65 -2.79 0.00 0.00 177.10 175.46 4rla h PRO 280 N 8.51 0.00 -0.00 0.43 0.11 -1.81 -2.60 132.00 136.63 4rla h PRO 280 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 4rla h PRO 280 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 4rla h PRO 280 CO 0.89 0.00 -0.32 0.25 -0.21 0.00 0.00 178.00 178.62 4rla n THR 281 N -3.50 0.00 1.29 -1.15 -2.24 -1.26 -3.78 114.28 103.65 4rla n THR 281 Ca -0.03 -0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.88 4rla n THR 281 Cb 0.09 -0.01 0.44 0.00 -2.10 0.00 0.00 70.33 68.75 4rla n THR 281 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 4rla n LEU 282 N -1.47 0.92 -4.70 3.22 4.77 -0.98 -4.88 117.00 113.88 4rla n LEU 282 Ca 0.06 -0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.41 4rla n LEU 282 Cb 0.34 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 4rla n LEU 282 CO 0.32 0.17 1.00 -0.83 -1.33 0.00 0.00 177.39 176.72 4rla s GLY 283 N -2.47 2.09 0.30 -0.72 0.00 -1.25 -4.71 107.32 100.55 4rla s GLY 283 Ca 0.26 0.82 -0.01 0.00 0.00 0.00 0.00 44.72 45.79 4rla s GLY 283 CO 0.50 2.28 1.94 1.70 0.00 0.00 0.00 173.10 179.52 4rla h LYS 284 N 7.34 1.05 -4.58 2.90 3.64 -1.92 -3.44 116.57 121.56 4rla h LYS 284 Ca -0.38 -0.06 -0.21 0.00 -1.27 0.00 0.00 60.65 58.73 4rla h LYS 284 Cb 1.19 -0.24 -0.15 0.00 -0.41 0.00 0.00 32.23 32.62 4rla h LYS 284 CO 0.87 0.70 -0.69 0.95 -2.27 0.00 0.00 179.45 179.01 4rla s THR 285 N -5.92 0.58 0.37 1.00 -4.23 -1.26 -5.04 115.64 101.13 4rla s THR 285 Ca -0.12 -1.91 0.10 0.00 -1.18 0.00 0.00 61.69 58.58 4rla s THR 285 Cb 0.19 -1.70 0.33 0.00 1.34 0.00 0.00 72.50 72.66 4rla s THR 285 CO 0.80 -0.85 1.87 -0.65 -0.54 0.00 0.00 174.62 175.24 4rla h PRO 286 N 2.98 0.62 -0.69 3.99 0.11 -1.99 -1.03 132.00 135.99 4rla h PRO 286 Ca -0.35 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.68 4rla h PRO 286 Cb 1.16 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 4rla h PRO 286 CO 0.65 0.41 0.28 1.49 -0.21 0.00 0.00 178.00 180.62 4rla h GLU 287 N 0.64 1.02 -0.95 1.05 4.22 -1.97 -1.65 114.58 116.94 4rla h GLU 287 Ca 0.45 -0.18 0.03 0.00 0.08 0.00 0.00 59.36 59.74 4rla h GLU 287 Cb 0.79 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 4rla h GLU 287 CO -0.20 0.84 0.62 0.93 -2.18 0.00 0.00 179.01 179.02 4rla h GLU 288 N 0.97 1.18 -0.09 1.92 5.08 -1.57 0.80 114.58 122.87 4rla h GLU 288 Ca 0.23 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.48 4rla h GLU 288 Cb 0.19 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 4rla h GLU 288 CO -0.02 0.78 -0.08 0.28 -1.00 0.00 0.00 179.01 178.98 4rla h VAL 289 N 1.22 1.36 -0.80 3.13 2.07 -1.37 -2.56 116.25 119.30 4rla h VAL 289 Ca 0.37 -1.20 0.10 0.00 0.82 0.00 0.00 66.70 66.78 4rla h VAL 289 Cb -0.03 1.96 -0.07 0.00 -1.52 0.00 0.00 31.29 31.62 4rla h VAL 289 CO -0.10 0.34 0.44 0.74 0.02 0.00 0.00 177.57 179.01 4rla h THR 290 N -0.20 0.88 -0.09 2.57 2.02 -0.79 -0.13 112.91 117.18 4rla h THR 290 Ca 0.02 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 4rla h THR 290 Cb 0.58 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 4rla h THR 290 CO 0.02 0.13 0.06 -0.09 0.37 0.00 0.00 175.52 176.01 4rla h ARG 291 N 0.74 0.13 0.42 6.66 2.43 -0.83 -1.12 114.38 122.80 4rla h ARG 291 Ca 0.39 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.53 4rla h ARG 291 Cb 0.38 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 4rla h ARG 291 CO -0.26 0.11 -0.20 1.15 -1.51 0.00 0.00 179.97 179.26 4rla h THR 292 N 0.10 0.59 -0.20 0.20 2.02 -0.91 -0.83 112.91 113.88 4rla h THR 292 Ca 0.03 -0.05 0.03 0.00 0.77 0.00 0.00 66.41 67.19 4rla h THR 292 Cb 0.02 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 4rla h THR 292 CO -0.01 0.01 0.03 0.58 0.37 0.00 0.00 175.52 176.50 4rla h VAL 293 N -0.59 0.90 -0.63 3.16 2.07 -1.06 -2.36 116.25 117.74 4rla h VAL 293 Ca -0.06 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.45 4rla h VAL 293 Cb 0.45 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 4rla h VAL 293 CO 0.09 0.02 0.40 0.78 0.02 0.00 0.00 177.57 178.88 4rla h ASN 294 N 0.11 0.66 0.14 0.57 2.35 -1.10 -1.81 115.58 116.49 4rla h ASN 294 Ca 0.09 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 4rla h ASN 294 Cb 0.09 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 4rla h ASN 294 CO -0.12 0.47 -0.19 0.00 -1.65 0.00 0.00 177.43 175.93 4rla h THR 295 N 0.79 1.18 -0.25 2.81 1.03 -0.94 -1.06 112.91 116.47 4rla h THR 295 Ca 0.25 -0.81 -0.05 0.00 -0.01 0.00 0.00 66.41 65.78 4rla h THR 295 Cb -0.02 1.34 -0.01 0.00 -1.07 0.00 0.00 68.15 68.39 4rla h THR 295 CO -0.09 0.24 -0.05 0.00 -0.01 0.00 0.00 175.52 175.62 4rla h ALA 296 N 1.70 0.34 -0.49 0.00 0.00 -0.85 -1.72 119.26 118.24 4rla h ALA 296 Ca 0.02 -0.26 0.06 0.00 0.00 0.00 0.00 54.91 54.73 4rla h ALA 296 Cb 0.41 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 4rla h ALA 296 CO 0.03 0.12 0.20 0.28 0.00 0.00 0.00 179.25 179.87 4rla h VAL 297 N 0.21 0.88 -0.42 0.00 2.07 -0.66 -1.49 116.25 116.84 4rla h VAL 297 Ca 0.06 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.48 4rla h VAL 297 Cb 0.50 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 4rla h VAL 297 CO 0.02 0.07 0.23 0.00 0.02 0.00 0.00 177.57 177.91 4rla h ALA 298 N 1.30 0.53 -0.72 1.67 0.00 -1.01 -1.26 119.26 119.79 4rla h ALA 298 Ca 0.23 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.18 4rla h ALA 298 Cb 0.21 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 4rla h ALA 298 CO -0.21 -0.11 0.44 -0.07 0.00 0.00 0.00 179.25 179.29 4rla h LEU 299 N 0.46 0.69 -0.12 0.00 3.38 -0.61 -0.53 115.31 118.59 4rla h LEU 299 Ca 0.18 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 4rla h LEU 299 Cb 0.05 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 4rla h LEU 299 CO -0.10 0.47 0.02 0.74 0.09 0.00 0.00 178.44 179.65 4rla h THR 300 N 0.83 1.22 -0.81 0.22 2.02 -0.81 -2.33 112.91 113.25 4rla h THR 300 Ca 0.30 -0.70 0.01 0.00 0.77 0.00 0.00 66.41 66.79 4rla h THR 300 Cb 0.09 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 4rla h THR 300 CO -0.14 0.20 0.53 -0.07 0.37 0.00 0.00 175.52 176.42 4rla h LEU 301 N -0.04 0.92 -0.78 2.58 3.38 -0.93 -1.50 115.31 118.94 4rla h LEU 301 Ca 0.04 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 4rla h LEU 301 Cb 0.30 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 4rla h LEU 301 CO 0.00 0.66 0.43 -1.28 0.09 0.00 0.00 178.44 178.35 4rla h SER 302 N 1.08 0.97 -0.16 -0.43 0.87 -0.99 -1.95 113.55 112.95 4rla h SER 302 Ca 0.30 -0.10 0.04 0.00 -1.23 0.00 0.00 61.79 60.80 4rla h SER 302 Cb -0.11 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.59 4rla h SER 302 CO -0.07 0.79 0.11 0.00 -0.53 0.00 0.00 176.83 177.13 4rla n PHE 304 N -4.50 2.95 0.00 0.00 3.72 -0.78 -4.42 117.46 114.44 4rla n PHE 304 Ca 0.00 -2.64 0.00 0.00 -0.05 0.00 0.00 57.45 54.76 4rla n PHE 304 Cb 0.21 -1.02 0.00 0.00 -0.94 0.00 0.00 39.48 37.73 4rla n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 4rla n GLY 305 N -0.87 2.28 3.66 1.37 0.00 -1.14 -4.65 105.19 105.83 4rla n GLY 305 Ca 0.55 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.15 4rla n GLY 305 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4rla s THR 306 N -2.31 3.50 0.13 2.61 2.01 -0.94 -4.98 115.64 115.65 4rla s THR 306 Ca 0.00 0.60 0.08 0.00 0.31 0.00 0.00 61.69 62.67 4rla s THR 306 Cb 0.00 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 4rla s THR 306 CO 0.00 -0.07 -0.09 -0.54 -0.69 0.00 0.00 174.62 173.24 4rla s LYS 307 N 4.18 2.13 0.45 4.92 1.02 -1.26 -4.33 119.74 126.85 4rla s LYS 307 Ca 0.76 -1.09 0.29 0.00 0.02 0.00 0.00 55.97 55.95 4rla s LYS 307 Cb -0.34 -2.28 1.02 0.00 -0.52 0.00 0.00 37.83 35.71 4rla s LYS 307 CO 0.31 0.49 1.84 0.00 -0.92 0.00 0.00 175.35 177.06 4rla h ARG 308 N 3.35 0.00 0.00 1.68 3.08 -1.99 -2.63 114.38 117.88 4rla h ARG 308 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 4rla h ARG 308 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 4rla h ARG 308 CO 0.53 0.00 0.00 -0.85 -1.07 0.00 0.00 179.97 178.58 4rla n GLU 309 N -2.88 0.13 0.00 0.04 0.28 -1.26 -5.01 120.64 111.94 4rla n GLU 309 Ca 0.02 0.12 0.00 0.00 -0.16 0.00 0.00 57.16 57.15 4rla n GLU 309 Cb 0.35 -1.65 0.00 0.00 1.43 0.00 0.00 31.44 31.57 4rla n GLU 309 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 4rla n GLY 310 N 1.29 2.71 3.46 -1.84 0.00 -0.99 -5.13 105.19 104.69 4rla n GLY 310 Ca 0.06 -1.98 -0.23 0.00 0.00 0.00 0.00 46.02 43.87 4rla n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 4rla s ASN 311 N 0.00 2.43 0.00 1.61 0.01 -1.26 -4.64 114.94 113.09 4rla s ASN 311 Ca 0.00 -1.64 0.00 0.00 -0.71 0.00 0.00 52.86 50.51 4rla s ASN 311 Cb 0.00 0.44 0.00 0.00 0.41 0.00 0.00 41.25 42.10 4rla s ASN 311 CO 0.00 -0.91 0.00 0.00 -1.51 0.00 0.00 177.10 174.68 4rla n HIS 312 N -0.81 0.00 -2.30 2.20 1.44 -1.26 -5.14 115.22 109.35 4rla n HIS 312 Ca -0.03 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.29 4rla n HIS 312 Cb 0.65 0.00 -0.02 0.00 0.12 0.00 0.00 29.99 30.74 4rla n HIS 312 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 4rla s LYS 313 N -1.60 4.09 0.67 -1.40 -0.14 -1.26 -5.04 119.74 115.07 4rla s LYS 313 Ca 0.00 1.84 -0.11 0.00 -1.36 0.00 0.00 55.97 56.34 4rla s LYS 313 Cb 0.00 -2.71 -0.01 0.00 -1.68 0.00 0.00 37.83 33.44 4rla s LYS 313 CO 0.00 -0.29 1.06 -1.25 -0.76 0.00 0.00 175.35 174.12 4rla s PRO 314 N -2.25 3.17 0.00 -1.68 0.04 -1.26 -3.87 135.00 129.15 4rla s PRO 314 Ca 0.56 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.27 4rla s PRO 314 Cb -0.31 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.19 4rla s PRO 314 CO 0.39 -0.86 0.00 0.39 0.04 0.00 0.00 177.00 176.96 4rla n GLU 315 N -2.93 0.00 -3.52 4.56 1.02 -1.26 -4.95 120.64 113.57 4rla n GLU 315 Ca 0.07 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.84 4rla n GLU 315 Cb 0.55 -3.30 -0.07 0.00 -0.02 0.00 0.00 31.44 28.60 4rla n GLU 315 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 4rla s THR 316 N -1.70 5.25 -0.25 2.62 2.01 -1.25 -5.06 115.64 117.26 4rla s THR 316 Ca 0.00 0.64 -0.11 0.00 0.31 0.00 0.00 61.69 62.54 4rla s THR 316 Cb 0.00 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 4rla s THR 316 CO 0.00 0.43 0.17 -0.62 -0.69 0.00 0.00 174.62 173.91 4rla s ASP 317 N 0.11 6.10 0.06 3.53 -1.08 -1.26 -4.97 116.67 119.16 4rla s ASP 317 Ca 0.19 0.09 0.20 0.00 -0.52 0.00 0.00 52.55 52.51 4rla s ASP 317 Cb -0.14 -2.11 -0.15 0.00 -1.46 0.00 0.00 42.92 39.06 4rla s ASP 317 CO 0.07 0.04 0.74 -1.22 0.52 0.00 0.00 175.17 175.31 4rla n TYR 318 N 4.46 0.63 1.89 -5.34 4.02 -1.26 -5.23 117.16 116.34 4rla n TYR 318 Ca -0.15 0.20 0.16 0.00 -0.01 0.00 0.00 57.90 58.09 4rla n TYR 318 Cb 0.52 -0.88 0.86 0.00 -0.02 0.00 0.00 39.34 39.81 4rla n TYR 318 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13