#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 3.23 -0.01 1.97 0.04 -1.26 -4.27 135.00 134.70 4rla s PRO 7 Ca 0.00 0.90 0.04 0.00 0.04 0.00 0.00 61.00 61.97 4rla s PRO 7 Cb 0.00 -2.03 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 4rla s PRO 7 CO 0.00 -0.86 -0.10 0.42 0.04 0.00 0.00 177.00 176.50 4rla s ILE 8 N -3.04 3.43 -0.28 0.56 1.01 0.15 -1.15 121.20 121.86 4rla s ILE 8 Ca 0.57 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 60.45 4rla s ILE 8 Cb -0.13 -2.45 0.08 0.00 0.01 0.00 0.00 42.46 39.98 4rla s ILE 8 CO 0.53 0.45 0.03 -0.70 0.00 0.00 0.00 174.94 175.25 4rla s GLU 9 N -1.21 1.19 -0.02 2.79 2.56 0.25 -1.24 118.70 123.02 4rla s GLU 9 Ca 0.15 -1.19 -0.30 0.00 0.00 0.00 0.00 54.97 53.63 4rla s GLU 9 Cb -0.11 -2.48 -0.03 0.00 2.00 0.00 0.00 34.13 33.51 4rla s GLU 9 CO 0.05 -0.82 1.03 0.42 -0.56 0.00 0.00 175.26 175.37 4rla s ILE 10 N 1.39 4.70 -0.10 -3.70 1.09 0.07 -1.29 121.20 123.36 4rla s ILE 10 Ca 0.04 1.95 0.01 0.00 -1.10 0.00 0.00 60.65 61.55 4rla s ILE 10 Cb -0.18 -4.25 0.02 0.00 -1.06 0.00 0.00 42.46 36.99 4rla s ILE 10 CO -0.14 0.10 -0.12 -0.63 -0.10 0.00 0.00 174.94 174.06 4rla s ILE 11 N 1.35 1.26 -0.13 2.92 1.01 0.39 -0.58 121.20 127.42 4rla s ILE 11 Ca 0.52 -0.49 -0.16 0.00 0.00 0.00 0.00 60.65 60.52 4rla s ILE 11 Cb -0.22 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.02 4rla s ILE 11 CO 0.25 0.40 0.39 -0.83 0.00 0.00 0.00 174.94 175.15 4rla s GLY 12 N 1.18 2.32 -0.68 6.18 0.00 -0.77 -0.85 107.32 114.70 4rla s GLY 12 Ca -0.04 -0.30 0.05 0.00 0.00 0.00 0.00 44.72 44.43 4rla s GLY 12 CO -0.03 0.59 0.59 0.00 0.00 0.00 0.00 173.10 174.25 4rla n ALA 13 N 3.53 3.64 -1.17 3.20 0.00 -0.27 -2.03 120.51 127.41 4rla n ALA 13 Ca -0.09 -4.58 -0.39 0.00 0.00 0.00 0.00 53.44 48.37 4rla n ALA 13 Cb 0.52 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.95 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 1.56 1.94 -4.79 0.00 -0.04 -1.26 -3.43 135.00 128.98 4rla n PRO 14 Ca 0.24 -1.91 -0.29 0.00 -0.04 0.00 0.00 63.50 61.50 4rla n PRO 14 Cb 0.38 -2.88 -0.14 0.00 -0.04 0.00 0.00 33.50 30.81 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 4.26 2.20 0.00 0.54 5.36 -1.26 -4.67 117.98 124.41 4rla s PHE 15 Ca 0.53 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.09 4rla s PHE 15 Cb 0.14 -1.30 0.00 0.00 -0.34 0.00 0.00 43.02 41.52 4rla s PHE 15 CO 0.04 0.14 0.07 -1.13 -1.46 0.00 0.00 175.22 172.88 4rla n SER 16 N 1.70 0.00 0.00 6.13 3.41 -1.26 -2.27 113.62 121.33 4rla n SER 16 Ca -0.17 -1.00 0.02 0.00 -0.26 0.00 0.00 58.87 57.46 4rla n SER 16 Cb 0.52 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.59 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 0.11 -0.01 4.33 4.01 -1.26 -2.01 118.16 123.33 4rla n LYS 17 Ca 0.00 0.10 0.13 0.00 -0.51 0.00 0.00 58.31 58.03 4rla n LYS 17 Cb 0.28 -1.50 0.72 0.00 -0.51 0.00 0.00 35.03 34.03 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 -0.81 -0.74 3.36 0.72 0.00 -1.26 -4.71 105.19 101.75 4rla n GLY 18 Ca 0.03 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.98 1.08 0.00 1.61 -2.07 -0.85 -0.34 119.66 117.11 4rla s GLN 19 Ca 0.39 -0.49 0.00 0.00 -1.82 0.00 0.00 55.36 53.44 4rla s GLN 19 Cb 0.19 0.49 0.00 0.00 -1.09 0.00 0.00 33.01 32.59 4rla s GLN 19 CO 0.31 -0.42 0.59 -0.35 -1.32 0.00 0.00 175.29 174.10 4rla n PRO 20 N 0.00 0.00 -2.85 9.60 -0.04 -1.26 -4.72 135.00 135.74 4rla n PRO 20 Ca -0.17 0.40 -0.38 0.00 -0.04 0.00 0.00 63.50 63.30 4rla n PRO 20 Cb 0.63 -1.09 -0.06 0.00 -0.04 0.00 0.00 33.50 32.94 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 -1.34 4.63 0.96 0.54 1.04 -1.26 -5.03 118.95 118.49 4rla s ARG 21 Ca 0.00 1.29 -0.16 0.00 -1.04 0.00 0.00 55.73 55.82 4rla s ARG 21 Cb 0.00 -3.06 0.22 0.00 -2.04 0.00 0.00 34.95 30.08 4rla s ARG 21 CO 0.00 0.43 1.30 0.41 -0.04 0.00 0.00 175.30 177.40 4rla n GLY 22 N 1.09 -1.52 0.00 3.88 0.00 -1.26 -4.73 105.19 102.64 4rla n GLY 22 Ca -0.01 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.30 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 -3.53 4.22 0.37 -0.02 0.00 -1.26 -4.95 105.19 100.02 4rla n GLY 23 Ca 0.16 -0.81 0.18 0.00 0.00 0.00 0.00 46.02 45.56 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 0.78 0.00 1.61 2.07 -1.85 -0.17 116.25 118.69 4rla h VAL 24 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 4rla h VAL 24 Cb 0.00 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 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 0.05 0.00 -0.00 1.57 9.09 -1.83 -0.69 114.58 122.76 4rla h GLU 25 Ca 0.23 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.64 4rla h GLU 25 Cb 0.86 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.96 4rla h GLU 25 CO -0.01 0.00 -0.42 1.63 0.05 0.00 0.00 179.01 180.25 4rla n LYS 26 N -2.54 0.14 -0.05 1.06 5.02 -0.08 -4.41 118.16 117.31 4rla n LYS 26 Ca -0.01 -0.08 -0.11 0.00 -2.02 0.00 0.00 58.31 56.09 4rla n LYS 26 Cb 0.13 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.58 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 4.99 -0.65 0.82 0.72 0.00 -1.24 -2.02 103.07 105.69 4rla h GLY 27 Ca 0.00 0.53 0.11 0.00 0.00 0.00 0.00 47.33 47.98 4rla h GLY 27 CO 0.00 -0.21 0.49 -0.56 0.00 0.00 0.00 176.54 176.27 4rla h PRO 28 N -0.42 0.55 -0.14 4.80 0.13 -1.76 -1.04 132.00 134.10 4rla h PRO 28 Ca 0.10 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 65.18 4rla h PRO 28 Cb 0.61 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 4rla h PRO 28 CO -0.47 0.36 0.01 0.00 -0.23 0.00 0.00 178.00 177.67 4rla h ALA 29 N 1.64 0.19 -0.33 -0.56 0.00 -1.68 -1.30 119.26 117.21 4rla h ALA 29 Ca 0.35 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 55.10 4rla h ALA 29 Cb 0.60 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 4rla h ALA 29 CO -0.13 -0.13 0.19 0.00 0.00 0.00 0.00 179.25 179.19 4rla h ALA 30 N 0.78 0.41 -0.41 0.00 0.00 -0.68 0.15 119.26 119.52 4rla h ALA 30 Ca 0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 4rla h ALA 30 Cb 0.34 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 4rla h ALA 30 CO 0.01 -0.17 0.15 -0.07 0.00 0.00 0.00 179.25 179.16 4rla h LEU 31 N 0.39 0.57 -0.60 0.00 3.38 -1.18 -1.16 115.31 116.72 4rla h LEU 31 Ca 0.13 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 4rla h LEU 31 Cb 0.01 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 4rla h LEU 31 CO -0.07 0.60 0.18 0.03 0.09 0.00 0.00 178.44 179.27 4rla h ARG 32 N 0.51 0.93 0.00 1.13 3.08 -1.01 -2.21 114.38 116.82 4rla h ARG 32 Ca 0.13 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 4rla h ARG 32 Cb 0.21 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 4rla h ARG 32 CO -0.01 0.84 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.47 4rla h LYS 33 N 0.85 0.00 -0.35 0.04 1.63 -0.38 -0.25 116.57 118.11 4rla h LYS 33 Ca 0.19 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 4rla h LYS 33 Cb 0.30 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.93 4rla h LYS 33 CO -0.00 0.04 0.00 0.00 -3.45 0.00 0.00 179.45 176.04 4rla n ALA 34 N -2.18 2.48 -2.33 5.00 0.00 -0.47 -4.90 120.51 118.11 4rla n ALA 34 Ca -0.02 -0.59 -0.05 0.00 0.00 0.00 0.00 53.44 52.78 4rla n ALA 34 Cb 0.17 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 18.65 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 0.99 0.32 0.42 0.00 0.00 -0.11 -4.99 105.19 101.83 4rla n GLY 35 Ca 0.11 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.22 -1.02 -0.76 0.99 5.85 -1.56 -1.85 115.31 116.75 4rla h LEU 36 Ca -0.12 0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.74 4rla h LEU 36 Cb 1.09 0.30 -0.07 0.00 0.37 0.00 0.00 40.66 42.35 4rla h LEU 36 CO 0.14 -0.61 0.42 0.58 -0.34 0.00 0.00 178.44 178.63 4rla h VAL 37 N -0.96 0.92 0.32 1.05 2.07 -1.85 -0.74 116.25 117.06 4rla h VAL 37 Ca -0.08 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 4rla h VAL 37 Cb 0.78 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.67 4rla h VAL 37 CO 0.08 0.13 -0.18 -0.33 0.02 0.00 0.00 177.57 177.29 4rla h GLU 38 N 0.74 -0.46 -0.32 1.57 3.07 -1.91 -1.98 114.58 115.28 4rla h GLU 38 Ca 0.36 0.03 0.02 0.00 -0.50 0.00 0.00 59.36 59.27 4rla h GLU 38 Cb 0.30 0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 4rla h GLU 38 CO -0.23 -0.31 0.21 0.87 -1.40 0.00 0.00 179.01 178.16 4rla h LYS 39 N -0.48 0.33 -0.49 2.33 1.57 -0.82 -1.63 116.57 117.39 4rla h LYS 39 Ca -0.04 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 4rla h LYS 39 Cb 0.39 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 4rla h LYS 39 CO 0.05 0.22 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.02 4rla h LEU 40 N 0.34 0.90 -1.53 2.94 3.38 -0.85 -2.99 115.31 117.50 4rla h LEU 40 Ca 0.13 -0.33 0.17 0.00 0.09 0.00 0.00 57.88 57.93 4rla h LEU 40 Cb 0.09 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 4rla h LEU 40 CO -0.03 1.01 0.54 0.11 0.09 0.00 0.00 178.44 180.17 4rla h LYS 41 N 0.76 0.43 0.00 1.13 1.57 -0.53 -1.83 116.57 118.10 4rla h LYS 41 Ca 0.13 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 4rla h LYS 41 Cb 0.59 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.80 4rla h LYS 41 CO 0.04 0.28 0.00 0.39 -0.57 0.00 0.00 179.45 179.59 4rla n GLU 42 N -4.50 0.58 -1.75 3.15 1.02 -1.13 -4.78 120.64 113.23 4rla n GLU 42 Ca 0.16 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.20 4rla n GLU 42 Cb 0.58 -1.48 0.05 0.00 -0.02 0.00 0.00 31.44 30.56 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 -0.98 0.00 -0.69 2.62 -2.24 -0.69 -4.97 114.28 107.33 4rla n THR 43 Ca 0.13 -0.84 -0.10 0.00 -2.27 0.00 0.00 64.05 60.97 4rla n THR 43 Cb 0.06 -0.96 0.02 0.00 -2.10 0.00 0.00 70.33 67.35 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 -1.76 1.48 -4.01 -0.78 0.28 -1.26 -4.83 120.64 109.76 4rla n GLU 44 Ca 0.08 -0.94 -0.13 0.00 -0.16 0.00 0.00 57.16 56.00 4rla n GLU 44 Cb 0.29 -1.37 -0.14 0.00 1.43 0.00 0.00 31.44 31.65 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 -1.09 0.27 0.12 -1.84 1.51 -1.26 -4.86 117.35 110.19 4rla s TYR 45 Ca 0.19 -0.12 -0.29 0.00 -1.01 0.00 0.00 57.07 55.84 4rla s TYR 45 Cb 0.15 -0.17 -0.06 0.00 -0.11 0.00 0.00 41.96 41.76 4rla s TYR 45 CO -0.00 -0.03 0.91 -0.80 -1.11 0.00 0.00 175.55 174.52 4rla s ASN 46 N -0.30 7.46 -0.09 2.29 0.01 -1.26 -4.75 114.94 118.30 4rla s ASN 46 Ca -0.01 1.75 0.04 0.00 -0.71 0.00 0.00 52.86 53.92 4rla s ASN 46 Cb -0.02 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.07 4rla s ASN 46 CO -0.00 0.01 -0.22 -0.69 -1.51 0.00 0.00 177.10 174.69 4rla s VAL 47 N -0.29 1.89 -0.10 1.60 1.01 -1.26 0.30 120.40 123.55 4rla s VAL 47 Ca 0.44 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.50 4rla s VAL 47 Cb -0.23 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.53 4rla s VAL 47 CO 0.29 0.52 -0.09 -0.60 0.00 0.00 0.00 175.10 175.22 4rla s ARG 48 N 0.41 1.53 -0.47 2.72 3.52 -0.37 -4.98 118.95 121.31 4rla s ARG 48 Ca -0.18 -0.28 -0.17 0.00 -0.13 0.00 0.00 55.73 54.96 4rla s ARG 48 Cb -0.18 -1.50 0.05 0.00 -1.56 0.00 0.00 34.95 31.77 4rla s ARG 48 CO 0.08 -0.18 0.50 0.34 -0.81 0.00 0.00 175.30 175.22 4rla s ASP 49 N 1.41 6.19 0.21 -2.12 2.15 -1.26 -0.75 116.67 122.49 4rla s ASP 49 Ca -0.01 -0.95 0.21 0.00 0.43 0.00 0.00 52.55 52.23 4rla s ASP 49 Cb -0.13 -2.24 0.90 0.00 -0.30 0.00 0.00 42.92 41.15 4rla s ASP 49 CO -0.05 -0.72 1.63 1.57 -0.17 0.00 0.00 175.17 177.43 4rla n HIS 50 N 5.70 0.62 -1.78 -5.34 -0.00 0.26 -4.95 115.22 109.73 4rla n HIS 50 Ca -0.08 0.26 0.00 0.00 -0.00 0.00 0.00 57.72 57.89 4rla n HIS 50 Cb 0.46 -0.91 0.00 0.00 -0.00 0.00 0.00 29.99 29.53 4rla n HIS 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 4rla n GLY 51 N -0.24 -2.16 3.70 1.57 0.00 -1.26 -4.91 105.19 101.89 4rla n GLY 51 Ca 0.02 -1.73 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 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 -3.45 5.98 0.56 1.61 1.01 -1.26 -1.85 116.67 119.27 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 -2.03 -0.05 0.00 1.01 0.00 0.00 42.92 41.86 4rla s ASP 52 CO 0.00 0.20 1.22 -0.76 0.21 0.00 0.00 175.17 176.04 4rla s LEU 53 N 0.24 3.76 -0.38 1.23 1.43 -0.86 -4.97 118.68 119.14 4rla s LEU 53 Ca 0.07 2.43 -0.16 0.00 -1.03 0.00 0.00 54.13 55.44 4rla s LEU 53 Cb -0.12 -4.48 0.00 0.00 0.03 0.00 0.00 46.19 41.63 4rla s LEU 53 CO -0.01 -1.46 0.38 0.00 0.23 0.00 0.00 176.35 175.49 4rla s ALA 54 N -1.54 3.47 -0.09 4.21 0.00 -1.26 -4.71 121.76 121.83 4rla s ALA 54 Ca 0.74 -1.39 -0.13 0.00 0.00 0.00 0.00 51.96 51.18 4rla s ALA 54 Cb -0.32 -2.91 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 4rla s ALA 54 CO 0.36 -1.30 0.31 -0.06 0.00 0.00 0.00 175.76 175.07 4rla s PHE 55 N 2.01 3.58 -0.17 0.00 0.08 -1.26 -5.08 117.98 117.15 4rla s PHE 55 Ca 0.11 0.74 -0.09 0.00 0.12 0.00 0.00 56.93 57.81 4rla s PHE 55 Cb -0.17 -2.26 -0.05 0.00 -0.57 0.00 0.00 43.02 39.97 4rla s PHE 55 CO 0.12 0.47 0.13 0.54 -0.10 0.00 0.00 175.22 176.38 4rla s VAL 56 N -0.34 5.38 -0.26 -0.44 0.11 -1.26 -5.07 120.40 118.53 4rla s VAL 56 Ca 0.19 0.17 -0.29 0.00 -2.93 0.00 0.00 61.98 59.12 4rla s VAL 56 Cb -0.14 -3.41 0.01 0.00 -1.53 0.00 0.00 36.38 31.31 4rla s VAL 56 CO 0.08 0.51 1.06 -0.62 -3.33 0.00 0.00 175.10 172.79 4rla s ASP 57 N -0.14 7.04 -0.20 3.54 2.15 -1.26 -4.91 116.67 122.89 4rla s ASP 57 Ca 0.10 1.28 -0.29 0.00 0.43 0.00 0.00 52.55 54.07 4rla s ASP 57 Cb -0.11 -2.54 -0.01 0.00 -0.30 0.00 0.00 42.92 39.95 4rla s ASP 57 CO 0.00 -0.74 1.29 -0.69 -0.17 0.00 0.00 175.17 174.86 4rla s VAL 58 N 3.35 4.22 0.51 1.11 1.01 -1.26 -5.00 120.40 124.34 4rla s VAL 58 Ca 0.45 1.46 -0.22 0.00 0.00 0.00 0.00 61.98 63.66 4rla s VAL 58 Cb -0.14 -4.02 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 4rla s VAL 58 CO 0.09 -0.22 1.27 -2.16 0.00 0.00 0.00 175.10 174.08 4rla s PRO 59 N 3.70 3.42 -1.52 2.72 0.04 -1.26 -3.59 135.00 138.50 4rla s PRO 59 Ca 0.56 2.02 -0.09 0.00 0.04 0.00 0.00 61.00 63.53 4rla s PRO 59 Cb -0.21 -2.32 0.07 0.00 0.04 0.00 0.00 34.50 32.08 4rla s PRO 59 CO 0.17 -0.90 0.66 -1.71 0.04 0.00 0.00 177.00 175.25 4rla n ASN 60 N -0.79 -2.13 -4.58 6.66 5.15 -1.26 -4.83 115.26 113.48 4rla n ASN 60 Ca 0.09 -0.96 -0.33 0.00 -0.60 0.00 0.00 54.58 52.78 4rla n ASN 60 Cb 0.46 -3.16 -0.04 0.00 -0.53 0.00 0.00 39.78 36.52 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 -3.83 5.68 0.27 1.20 -1.08 -1.24 -4.94 116.67 112.73 4rla s ASP 61 Ca 0.36 -1.80 -0.30 0.00 -0.52 0.00 0.00 52.55 50.29 4rla s ASP 61 Cb -0.19 -2.58 -0.12 0.00 -1.46 0.00 0.00 42.92 38.57 4rla s ASP 61 CO 0.89 -2.38 1.63 -0.44 0.52 0.00 0.00 175.17 175.39 4rla s SER 62 N 5.86 6.36 -0.06 -0.34 0.01 -1.26 -4.50 113.70 119.77 4rla s SER 62 Ca 0.63 2.94 -0.29 0.00 1.31 0.00 0.00 55.95 60.54 4rla s SER 62 Cb 0.00 -2.63 -0.07 0.00 0.21 0.00 0.00 66.02 63.54 4rla s SER 62 CO 0.09 -0.94 1.96 -2.84 0.41 0.00 0.00 173.24 171.92 4rla s PRO 63 N -0.10 3.85 -0.83 12.44 0.02 -1.26 -4.68 135.00 144.44 4rla s PRO 63 Ca 0.66 2.32 -0.25 0.00 0.02 0.00 0.00 61.00 63.75 4rla s PRO 63 Cb -0.48 -4.19 -0.02 0.00 0.02 0.00 0.00 34.50 29.83 4rla s PRO 63 CO 0.44 -1.27 1.78 0.12 -0.33 0.00 0.00 177.00 177.75 4rla s PHE 64 N 5.47 1.93 0.00 6.54 5.36 0.02 -4.67 117.98 132.63 4rla s PHE 64 Ca 0.88 0.37 0.00 0.00 -0.96 0.00 0.00 56.93 57.22 4rla s PHE 64 Cb -0.37 -4.21 0.00 0.00 -0.34 0.00 0.00 43.02 38.09 4rla s PHE 64 CO 0.37 -1.96 0.00 1.04 -1.46 0.00 0.00 175.22 173.22 4rla n GLN 65 N 9.00 0.00 -0.04 10.12 6.02 -1.26 -1.21 117.38 140.00 4rla n GLN 65 Ca 0.30 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 57.28 4rla n GLN 65 Cb 0.49 0.00 -0.10 0.00 1.02 0.00 0.00 30.24 31.65 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 0.57 -1.90 5.09 3.06 -1.26 -4.98 119.36 119.95 4rla n ILE 66 Ca 0.00 -0.46 -0.42 0.00 -2.50 0.00 0.00 62.75 59.37 4rla n ILE 66 Cb 0.00 -0.37 -0.03 0.00 0.54 0.00 0.00 39.64 39.78 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 -2.53 2.55 0.09 9.51 1.01 -0.35 -3.06 120.40 127.63 4rla s VAL 67 Ca -0.06 0.37 0.02 0.00 0.00 0.00 0.00 61.98 62.31 4rla s VAL 67 Cb 0.05 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 4rla s VAL 67 CO 0.54 0.03 0.16 -0.54 0.00 0.00 0.00 175.10 175.28 4rla s LYS 68 N 1.29 3.16 -1.50 2.72 1.02 -1.10 -0.80 119.74 124.53 4rla s LYS 68 Ca 0.71 -0.60 -0.03 0.00 0.02 0.00 0.00 55.97 56.07 4rla s LYS 68 Cb -0.44 -2.87 0.03 0.00 -0.52 0.00 0.00 37.83 34.02 4rla s LYS 68 CO 0.31 0.57 0.33 0.09 -0.92 0.00 0.00 175.35 175.74 4rla n ASN 69 N 0.21 -0.29 0.33 2.83 3.02 -1.26 -4.67 115.26 115.43 4rla n ASN 69 Ca -0.07 -1.10 -0.17 0.00 -0.03 0.00 0.00 54.58 53.20 4rla n ASN 69 Cb 0.52 -2.50 -0.09 0.00 -0.61 0.00 0.00 39.78 37.11 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 -1.75 -0.79 -0.36 3.52 0.11 -1.83 -2.65 132.00 128.24 4rla h PRO 70 Ca -0.63 0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.51 4rla h PRO 70 Cb 1.38 0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.66 4rla h PRO 70 CO 0.68 -0.53 0.13 0.00 -0.21 0.00 0.00 178.00 178.07 4rla h ARG 71 N -0.82 0.51 -0.03 1.05 3.08 -1.87 -0.72 114.38 115.57 4rla h ARG 71 Ca -0.07 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 4rla h ARG 71 Cb 0.65 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 4rla h ARG 71 CO 0.11 0.44 -0.04 0.77 -1.07 0.00 0.00 179.97 180.18 4rla h SER 72 N 0.51 0.09 -0.44 7.04 0.02 -1.88 -0.72 113.55 118.17 4rla h SER 72 Ca 0.12 -0.49 -0.07 0.00 -0.84 0.00 0.00 61.79 60.51 4rla h SER 72 Cb 0.13 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 4rla h SER 72 CO -0.01 0.57 0.01 0.58 -1.14 0.00 0.00 176.83 176.84 4rla h VAL 73 N -0.38 1.25 -0.41 2.27 2.07 -1.33 -0.15 116.25 119.56 4rla h VAL 73 Ca 0.01 -1.01 -0.10 0.00 0.82 0.00 0.00 66.70 66.41 4rla h VAL 73 Cb 0.54 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 4rla h VAL 73 CO 0.01 0.36 -0.14 1.23 0.02 0.00 0.00 177.57 179.05 4rla h GLY 74 N 0.98 0.89 0.90 2.17 0.00 -1.13 -0.62 103.07 106.27 4rla h GLY 74 Ca 0.15 -0.76 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 4rla h GLY 74 CO 0.02 0.69 -0.18 1.70 0.00 0.00 0.00 176.54 178.77 4rla h LYS 75 N 0.64 -0.50 -0.37 4.80 1.63 -0.84 -1.00 116.57 120.93 4rla h LYS 75 Ca 0.10 0.03 0.07 0.00 -0.85 0.00 0.00 60.65 60.00 4rla h LYS 75 Cb 0.68 0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 32.36 4rla h LYS 75 CO 0.05 -0.27 -0.00 0.00 -3.45 0.00 0.00 179.45 175.78 4rla h ALA 76 N -0.04 0.34 -0.40 5.00 0.00 -1.00 -1.10 119.26 122.06 4rla h ALA 76 Ca -0.05 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 4rla h ALA 76 Cb 0.46 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 4rla h ALA 76 CO 0.09 -0.40 0.10 -0.91 0.00 0.00 0.00 179.25 178.12 4rla h ASN 77 N 0.10 0.54 -0.12 0.00 2.35 -0.99 -0.66 115.58 116.79 4rla h ASN 77 Ca 0.18 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 4rla h ASN 77 Cb 0.25 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 4rla h ASN 77 CO -0.31 0.54 0.02 -0.08 -1.65 0.00 0.00 177.43 175.95 4rla h GLU 78 N 0.57 0.21 -0.75 0.81 4.81 -0.17 -1.01 114.58 119.05 4rla h GLU 78 Ca 0.13 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 4rla h GLU 78 Cb 0.22 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 4rla h GLU 78 CO -0.00 0.41 0.48 0.37 -0.73 0.00 0.00 179.01 179.53 4rla h GLN 79 N -0.03 0.92 -0.02 1.92 4.15 -0.85 -2.38 115.11 118.83 4rla h GLN 79 Ca 0.04 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.40 4rla h GLN 79 Cb 0.30 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 27.78 4rla h GLN 79 CO 0.00 0.61 0.01 1.25 -1.93 0.00 0.00 178.83 178.77 4rla h LEU 80 N 0.95 0.03 -1.43 -2.39 5.85 -0.96 -2.79 115.31 114.56 4rla h LEU 80 Ca 0.29 -0.17 0.15 0.00 0.84 0.00 0.00 57.88 59.00 4rla h LEU 80 Cb -0.02 -0.01 -0.06 0.00 0.37 0.00 0.00 40.66 40.94 4rla h LEU 80 CO -0.10 0.19 0.55 0.00 -0.34 0.00 0.00 178.44 178.74 4rla h ALA 81 N 0.84 1.99 0.44 1.25 0.00 -0.88 0.92 119.26 123.82 4rla h ALA 81 Ca 0.01 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 4rla h ALA 81 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 4rla h ALA 81 CO -0.00 -0.22 -0.21 0.00 0.00 0.00 0.00 179.25 178.82 4rla h ALA 82 N 1.62 -0.59 -0.39 0.00 0.00 -1.25 -1.51 119.26 117.15 4rla h ALA 82 Ca 0.42 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.19 4rla h ALA 82 Cb 0.82 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 4rla h ALA 82 CO -0.17 -0.75 0.19 0.28 0.00 0.00 0.00 179.25 178.81 4rla h VAL 83 N -0.76 0.97 0.40 0.00 2.07 -0.99 -0.60 116.25 117.34 4rla h VAL 83 Ca -0.06 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 4rla h VAL 83 Cb 0.54 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 4rla h VAL 83 CO 0.10 0.07 -0.31 0.58 0.02 0.00 0.00 177.57 178.03 4rla h VAL 84 N 0.39 0.36 -0.97 2.57 2.07 -0.88 -2.13 116.25 117.66 4rla h VAL 84 Ca 0.17 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.83 4rla h VAL 84 Cb 0.08 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.12 4rla h VAL 84 CO -0.12 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.08 4rla h ALA 85 N -0.21 1.68 0.01 1.67 0.00 -1.00 -0.41 119.26 121.01 4rla h ALA 85 Ca -0.04 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 4rla h ALA 85 Cb 0.61 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.25 4rla h ALA 85 CO -0.01 0.04 -0.01 1.49 0.00 0.00 0.00 179.25 180.77 4rla h GLU 86 N 0.82 -0.02 -0.44 0.00 4.57 -0.67 0.84 114.58 119.69 4rla h GLU 86 Ca 0.50 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.56 4rla h GLU 86 Cb 0.68 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.26 4rla h GLU 86 CO -0.27 0.06 -0.20 1.79 -1.18 0.00 0.00 179.01 179.21 4rla h THR 87 N -0.09 1.27 -0.82 0.32 1.35 -0.84 -2.33 112.91 111.76 4rla h THR 87 Ca -0.00 -1.33 -0.02 0.00 -0.55 0.00 0.00 66.41 64.50 4rla h THR 87 Cb 0.09 1.15 -0.04 0.00 -1.73 0.00 0.00 68.15 67.62 4rla h THR 87 CO 0.00 0.45 0.42 1.56 -0.25 0.00 0.00 175.52 177.71 4rla h GLN 88 N 0.75 1.16 -0.79 4.72 1.08 -0.97 -1.98 115.11 119.08 4rla h GLN 88 Ca 0.11 -0.16 0.04 0.00 -1.45 0.00 0.00 58.65 57.18 4rla h GLN 88 Cb 0.74 -0.22 -0.05 0.00 -0.05 0.00 0.00 27.48 27.90 4rla h GLN 88 CO 0.06 0.88 0.52 -0.22 -0.95 0.00 0.00 178.83 179.12 4rla h LYS 89 N 1.15 0.94 -0.19 1.46 3.64 -0.42 -0.05 116.57 123.11 4rla h LYS 89 Ca 0.28 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 4rla h LYS 89 Cb 0.08 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 4rla h LYS 89 CO -0.04 0.62 0.00 0.09 -2.27 0.00 0.00 179.45 177.85 4rla n ASN 90 N -4.45 0.22 -1.31 4.20 3.02 -0.78 -4.87 115.26 111.29 4rla n ASN 90 Ca 0.10 -2.00 -0.09 0.00 -0.03 0.00 0.00 54.58 52.56 4rla n ASN 90 Cb 0.12 -0.10 0.01 0.00 -0.61 0.00 0.00 39.78 39.20 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 0.42 0.12 3.63 7.41 0.00 -0.03 -5.05 105.19 111.68 4rla n GLY 91 Ca 0.00 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.70 3.09 -0.18 2.61 -4.23 -1.00 -4.44 115.64 108.80 4rla s THR 92 Ca 0.09 -1.97 -0.14 0.00 -1.18 0.00 0.00 61.69 58.48 4rla s THR 92 Cb -0.04 -2.77 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 4rla s THR 92 CO 0.11 -0.32 0.32 -0.63 -0.54 0.00 0.00 174.62 173.56 4rla s ILE 93 N -2.40 5.27 -0.05 2.99 1.01 -0.30 -4.31 121.20 123.41 4rla s ILE 93 Ca 0.33 0.59 -0.16 0.00 0.00 0.00 0.00 60.65 61.41 4rla s ILE 93 Cb -0.04 -3.66 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 4rla s ILE 93 CO 0.19 0.34 0.41 -0.94 0.00 0.00 0.00 174.94 174.95 4rla s SER 94 N 0.70 6.74 -0.31 3.58 1.04 -1.15 -0.58 113.70 123.72 4rla s SER 94 Ca 0.17 0.88 0.02 0.00 0.48 0.00 0.00 55.95 57.49 4rla s SER 94 Cb -0.14 -2.25 0.09 0.00 0.10 0.00 0.00 66.02 63.82 4rla s SER 94 CO 0.05 0.22 0.05 -0.69 0.98 0.00 0.00 173.24 173.85 4rla s VAL 95 N -0.47 1.69 0.00 5.02 1.01 -0.41 -1.20 120.40 126.05 4rla s VAL 95 Ca 0.23 -1.84 -0.19 0.00 0.00 0.00 0.00 61.98 60.18 4rla s VAL 95 Cb -0.16 -2.20 -0.06 0.00 0.00 0.00 0.00 36.38 33.96 4rla s VAL 95 CO 0.11 -0.54 0.56 -0.69 0.00 0.00 0.00 175.10 174.55 4rla s VAL 96 N 1.22 4.91 -0.36 2.92 1.01 0.19 -0.46 120.40 129.82 4rla s VAL 96 Ca 0.08 1.17 -0.03 0.00 0.00 0.00 0.00 61.98 63.20 4rla s VAL 96 Cb -0.18 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.38 4rla s VAL 96 CO -0.13 0.46 0.12 -0.76 0.00 0.00 0.00 175.10 174.78 4rla s LEU 97 N -0.41 4.66 1.03 3.92 1.43 -0.03 -1.81 118.68 127.48 4rla s LEU 97 Ca 0.29 -1.63 -0.17 0.00 -1.03 0.00 0.00 54.13 51.59 4rla s LEU 97 Cb -0.18 -1.80 0.23 0.00 0.03 0.00 0.00 46.19 44.47 4rla s LEU 97 CO 0.17 -0.42 1.29 -0.83 0.23 0.00 0.00 176.35 176.79 4rla s GLY 98 N 1.58 1.75 0.00 -3.19 0.00 -0.47 -1.11 107.32 105.88 4rla s GLY 98 Ca 0.02 -1.21 0.00 0.00 0.00 0.00 0.00 44.72 43.53 4rla s GLY 98 CO -0.02 -0.38 0.00 0.61 0.00 0.00 0.00 173.10 173.31 4rla n GLY 99 N -3.18 -0.44 3.92 0.20 0.00 -0.80 -3.37 105.19 101.53 4rla n GLY 99 Ca 0.16 -1.53 -0.27 0.00 0.00 0.00 0.00 46.02 44.38 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 -1.68 5.55 0.62 1.61 -4.77 -0.96 -1.15 116.67 115.90 4rla s ASP 100 Ca 0.00 0.71 0.26 0.00 -3.30 0.00 0.00 52.55 50.22 4rla s ASP 100 Cb 0.00 -1.68 1.30 0.00 -1.09 0.00 0.00 42.92 41.45 4rla s ASP 100 CO 0.00 -1.10 1.73 -1.13 0.70 0.00 0.00 175.17 175.37 4rla h ASN 101 N -0.21 0.00 -0.97 2.11 -1.24 -1.94 -1.69 115.58 111.64 4rla h ASN 101 Ca -0.45 0.00 0.10 0.00 0.71 0.00 0.00 56.30 56.65 4rla h ASN 101 Cb 1.26 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 40.24 4rla h ASN 101 CO 0.61 0.00 0.62 0.77 -1.29 0.00 0.00 177.43 178.14 4rla h SER 102 N 0.00 0.93 0.01 1.15 4.64 -1.76 -0.09 113.55 118.42 4rla h SER 102 Ca 0.16 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 4rla h SER 102 Cb 1.33 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 4rla h SER 102 CO -0.00 0.54 0.00 0.23 -0.87 0.00 0.00 176.83 176.73 4rla n MET 103 N -4.55 0.00 0.24 4.77 2.81 -0.63 -1.43 117.12 118.33 4rla n MET 103 Ca 0.17 0.35 0.11 0.00 -1.81 0.00 0.00 57.70 56.52 4rla n MET 103 Cb 0.29 -1.50 0.59 0.00 -0.71 0.00 0.00 33.22 31.89 4rla n MET 103 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 4rla h ALA 104 N 2.01 1.13 0.48 3.04 0.00 -1.21 -2.61 119.26 122.10 4rla h ALA 104 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 4rla h ALA 104 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 4rla h ALA 104 CO 0.00 0.22 -0.23 0.82 0.00 0.00 0.00 179.25 180.06 4rla h ILE 105 N 0.00 0.44 0.20 0.00 2.04 -1.44 -2.08 117.51 116.67 4rla h ILE 105 Ca -0.00 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.49 4rla h ILE 105 Cb 0.56 0.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 4rla h ILE 105 CO 0.02 0.06 -0.39 1.23 0.00 0.00 0.00 178.15 179.07 4rla h GLY 106 N -0.90 -0.82 0.07 5.37 0.00 -1.72 -1.15 103.07 103.93 4rla h GLY 106 Ca -0.07 0.46 0.07 0.00 0.00 0.00 0.00 47.33 47.79 4rla h GLY 106 CO 0.11 -0.28 -0.27 0.23 0.00 0.00 0.00 176.54 176.33 4rla h SER 107 N -0.67 -0.87 -0.55 0.19 0.87 -1.53 -0.71 113.55 110.28 4rla h SER 107 Ca 0.01 0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.65 4rla h SER 107 Cb 0.67 0.40 -0.02 0.00 -0.44 0.00 0.00 62.40 63.01 4rla h SER 107 CO -0.18 -0.30 0.07 0.40 -0.53 0.00 0.00 176.83 176.30 4rla h ILE 108 N -0.26 1.26 0.87 2.23 2.04 -1.24 -1.92 117.51 120.48 4rla h ILE 108 Ca 0.14 -0.99 -0.04 0.00 1.00 0.00 0.00 64.86 64.97 4rla h ILE 108 Cb 0.49 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 4rla h ILE 108 CO -0.42 0.36 -0.47 0.28 0.00 0.00 0.00 178.15 177.90 4rla h SER 109 N 0.81 -1.14 -0.99 1.72 0.02 -0.85 0.91 113.55 114.03 4rla h SER 109 Ca 0.17 0.05 0.20 0.00 -0.84 0.00 0.00 61.79 61.37 4rla h SER 109 Cb 0.44 0.31 -0.10 0.00 0.14 0.00 0.00 62.40 63.19 4rla h SER 109 CO 0.01 -0.76 0.62 1.23 -1.14 0.00 0.00 176.83 176.79 4rla h GLY 110 N -1.23 1.56 1.04 -3.77 0.00 -1.16 0.15 103.07 99.67 4rla h GLY 110 Ca -0.12 -0.31 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 4rla h GLY 110 CO 0.16 -0.07 -0.02 0.84 0.00 0.00 0.00 176.54 177.46 4rla h HIS 111 N 0.65 1.05 -0.77 5.60 6.17 -0.84 -3.15 115.15 123.86 4rla h HIS 111 Ca 0.56 -0.19 -0.02 0.00 0.71 0.00 0.00 60.37 61.44 4rla h HIS 111 Cb 1.03 -0.27 -0.04 0.00 2.52 0.00 0.00 27.41 30.66 4rla h HIS 111 CO -0.00 0.96 0.42 0.00 0.71 0.00 0.00 177.93 180.02 4rla h ALA 112 N 0.95 0.99 -0.89 5.26 0.00 0.18 -1.10 119.26 124.64 4rla h ALA 112 Ca 0.15 -0.12 0.23 0.00 0.00 0.00 0.00 54.91 55.17 4rla h ALA 112 Cb 0.56 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 4rla h ALA 112 CO 0.03 0.50 0.61 0.00 0.00 0.00 0.00 179.25 180.39 4rla h ARG 113 N 1.07 0.21 0.02 0.00 3.08 -1.27 0.15 114.38 117.64 4rla h ARG 113 Ca 0.27 -0.01 -0.35 0.00 0.07 0.00 0.00 59.98 59.96 4rla h ARG 113 Cb 0.04 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 29.98 4rla h ARG 113 CO -0.04 0.14 -2.17 0.28 -1.07 0.00 0.00 179.97 177.11 4rla n VAL 114 N -4.41 1.52 -3.60 2.04 0.31 -1.06 -4.72 118.33 108.40 4rla n VAL 114 Ca 0.19 -0.76 -0.28 0.00 -0.01 0.00 0.00 64.34 63.48 4rla n VAL 114 Cb 0.81 -0.96 -0.11 0.00 -0.91 0.00 0.00 33.84 32.68 4rla n VAL 114 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 4rla s HIS 115 N -2.53 2.01 -1.10 3.52 3.76 -0.44 -4.97 115.29 115.54 4rla s HIS 115 Ca -0.15 -2.65 0.11 0.00 -0.15 0.00 0.00 55.06 52.23 4rla s HIS 115 Cb 0.07 -1.64 0.48 0.00 1.11 0.00 0.00 32.58 32.61 4rla s HIS 115 CO 0.78 -0.73 1.32 -0.35 -0.85 0.00 0.00 174.74 174.91 4rla n PRO 116 N 2.69 0.04 -0.55 8.40 -0.04 -0.07 -2.55 135.00 142.92 4rla n PRO 116 Ca 0.23 0.28 0.09 0.00 -0.04 0.00 0.00 63.50 64.06 4rla n PRO 116 Cb 0.41 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.70 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 -1.45 4.49 -4.64 3.54 5.75 -1.26 -5.01 116.55 117.97 4rla n ASP 117 Ca 0.03 -2.43 -0.30 0.00 -0.01 0.00 0.00 54.79 52.09 4rla n ASP 117 Cb 0.12 -0.54 0.18 0.00 -1.03 0.00 0.00 41.12 39.85 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 -1.80 1.97 0.06 -2.12 0.05 -1.06 -4.49 118.68 111.29 4rla s LEU 118 Ca 0.48 1.68 0.06 0.00 0.05 0.00 0.00 54.13 56.39 4rla s LEU 118 Cb 0.31 -3.93 -0.03 0.00 -2.05 0.00 0.00 46.19 40.49 4rla s LEU 118 CO 0.23 -3.24 -0.16 0.00 -0.55 0.00 0.00 176.35 172.63 4rla s VAL 120 N -1.01 3.20 -0.29 0.00 1.01 -0.59 -0.26 120.40 122.47 4rla s VAL 120 Ca 0.02 -0.58 -0.07 0.00 0.00 0.00 0.00 61.98 61.35 4rla s VAL 120 Cb -0.09 -2.40 0.01 0.00 0.00 0.00 0.00 36.38 33.90 4rla s VAL 120 CO 0.02 0.48 0.08 -0.63 0.00 0.00 0.00 175.10 175.05 4rla s ILE 121 N 0.88 4.00 -0.53 2.22 1.01 -0.77 -1.32 121.20 126.69 4rla s ILE 121 Ca -0.02 -0.67 -0.11 0.00 0.00 0.00 0.00 60.65 59.85 4rla s ILE 121 Cb -0.15 -3.06 0.13 0.00 0.01 0.00 0.00 42.46 39.40 4rla s ILE 121 CO 0.00 0.09 0.43 0.86 0.00 0.00 0.00 174.94 176.32 4rla s TRP 122 N 1.51 3.42 -0.42 3.97 -0.11 0.51 -1.85 118.94 125.97 4rla s TRP 122 Ca 0.03 -1.80 -0.23 0.00 1.22 0.00 0.00 56.10 55.32 4rla s TRP 122 Cb -0.17 -3.59 0.02 0.00 -1.50 0.00 0.00 33.47 28.23 4rla s TRP 122 CO 0.03 -0.99 0.77 0.08 -4.62 0.00 0.00 176.95 172.22 4rla s VAL 123 N 1.21 4.69 0.13 5.86 1.01 -0.88 -0.73 120.40 131.70 4rla s VAL 123 Ca 0.07 0.57 -0.25 0.00 0.00 0.00 0.00 61.98 62.37 4rla s VAL 123 Cb -0.25 -4.27 0.07 0.00 0.00 0.00 0.00 36.38 31.93 4rla s VAL 123 CO -0.01 -0.61 0.76 -0.62 0.00 0.00 0.00 175.10 174.63 4rla s ASP 124 N 2.03 -0.39 0.00 3.32 -1.08 -0.32 -1.21 116.67 119.01 4rla s ASP 124 Ca 0.30 -0.16 0.25 0.00 -0.52 0.00 0.00 52.55 52.42 4rla s ASP 124 Cb -0.13 0.54 0.55 0.00 -1.46 0.00 0.00 42.92 42.42 4rla s ASP 124 CO 0.20 -0.92 1.44 0.00 0.52 0.00 0.00 175.17 176.41 4rla n ALA 125 N -0.37 3.38 -2.34 3.66 0.00 -1.25 -2.99 120.51 120.61 4rla n ALA 125 Ca -0.11 -0.42 -0.18 0.00 0.00 0.00 0.00 53.44 52.74 4rla n ALA 125 Cb 0.62 -1.08 -0.10 0.00 0.00 0.00 0.00 19.45 18.89 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 -2.69 1.64 -0.02 0.00 3.76 -1.26 -1.12 115.29 115.59 4rla s HIS 126 Ca 0.18 -0.59 0.06 0.00 -0.15 0.00 0.00 55.06 54.56 4rla s HIS 126 Cb 0.18 -0.77 -0.24 0.00 1.11 0.00 0.00 32.58 32.86 4rla s HIS 126 CO 0.61 0.31 0.74 1.79 -0.85 0.00 0.00 174.74 177.33 4rla h THR 127 N 2.66 0.98 -6.45 1.30 1.35 -1.91 -3.47 112.91 107.37 4rla h THR 127 Ca -0.38 -2.76 -0.50 0.00 -0.55 0.00 0.00 66.41 62.22 4rla h THR 127 Cb 1.21 2.55 -0.09 0.00 -1.73 0.00 0.00 68.15 70.10 4rla h THR 127 CO 0.61 0.68 -0.80 0.47 -0.25 0.00 0.00 175.52 176.23 4rla n ASP 128 N -3.23 -3.77 -1.00 5.36 8.00 -1.26 -4.77 116.55 115.87 4rla n ASP 128 Ca -0.17 -0.87 0.01 0.00 0.71 0.00 0.00 54.79 54.47 4rla n ASP 128 Cb 1.04 -3.46 0.22 0.00 -0.02 0.00 0.00 41.12 38.89 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 -4.54 2.42 -2.59 0.53 3.06 -1.09 -2.69 119.36 114.46 4rla n ILE 129 Ca 0.01 -2.41 -0.37 0.00 -2.50 0.00 0.00 62.75 57.48 4rla n ILE 129 Cb 0.53 -0.29 -0.05 0.00 0.54 0.00 0.00 39.64 40.38 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 -2.35 6.95 0.39 9.51 0.01 -0.70 -4.62 114.94 124.14 4rla s ASN 130 Ca 0.43 2.02 0.08 0.00 -0.71 0.00 0.00 52.86 54.68 4rla s ASN 130 Cb 0.38 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 39.43 4rla s ASN 130 CO 0.03 -0.36 0.42 0.42 -1.51 0.00 0.00 177.10 176.11 4rla s THR 131 N -1.59 3.06 0.59 1.60 -4.23 -1.26 -4.17 115.64 109.63 4rla s THR 131 Ca 0.54 -1.22 0.29 0.00 -1.18 0.00 0.00 61.69 60.12 4rla s THR 131 Cb -0.22 -3.08 0.40 0.00 1.34 0.00 0.00 72.50 70.94 4rla s THR 131 CO 0.28 -0.05 1.82 -0.65 -0.54 0.00 0.00 174.62 175.48 4rla h PRO 132 N 0.96 0.00 0.00 3.99 0.11 -1.96 0.11 132.00 135.21 4rla h PRO 132 Ca -0.42 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.46 4rla h PRO 132 Cb 1.27 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.34 4rla h PRO 132 CO 0.54 0.00 -1.35 -0.07 -0.21 0.00 0.00 178.00 176.91 4rla h LEU 133 N 0.00 0.00 0.00 2.35 3.38 -1.94 -3.38 115.31 115.72 4rla h LEU 133 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 4rla h LEU 133 Cb 1.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.23 4rla h LEU 133 CO -0.00 0.86 -1.26 0.35 0.09 0.00 0.00 178.44 178.48 4rla n THR 134 N -3.11 0.05 -1.78 0.22 -2.24 0.24 -4.96 114.28 102.72 4rla n THR 134 Ca -0.09 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.06 4rla n THR 134 Cb 0.95 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.62 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 -3.20 2.30 -1.25 4.28 -4.23 -0.32 -4.84 115.64 108.38 4rla s THR 135 Ca 0.02 0.13 0.29 0.00 -1.18 0.00 0.00 61.69 60.95 4rla s THR 135 Cb 0.15 -3.08 0.34 0.00 1.34 0.00 0.00 72.50 71.24 4rla s THR 135 CO 0.86 0.01 1.89 -0.24 -0.54 0.00 0.00 174.62 176.59 4rla n SER 136 N 4.44 0.16 -3.72 3.99 2.88 -1.26 -4.69 113.62 115.42 4rla n SER 136 Ca 0.16 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.58 4rla n SER 136 Cb 0.37 -0.26 -0.11 0.00 -0.75 0.00 0.00 64.21 63.46 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 -2.77 -0.44 0.00 -3.46 1.04 -1.26 -5.04 113.70 101.77 4rla s SER 137 Ca 0.21 0.81 0.03 0.00 0.48 0.00 0.00 55.95 57.47 4rla s SER 137 Cb 0.19 0.75 0.14 0.00 0.10 0.00 0.00 66.02 67.21 4rla s SER 137 CO 0.52 -0.16 0.81 0.61 0.98 0.00 0.00 173.24 176.00 4rla n GLY 138 N 3.58 -0.28 3.59 7.32 0.00 -1.17 -4.78 105.19 113.45 4rla n GLY 138 Ca -0.18 -0.01 -0.51 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.19 2.67 0.00 1.61 3.02 -1.26 -2.70 115.26 117.41 4rla n ASN 139 Ca 0.01 0.73 0.07 0.00 -0.03 0.00 0.00 54.58 55.36 4rla n ASN 139 Cb 0.02 -1.28 0.34 0.00 -0.61 0.00 0.00 39.78 38.25 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 7.93 0.00 0.12 3.41 4.77 -1.09 -3.07 117.00 129.07 4rla n LEU 140 Ca 0.31 0.37 0.12 0.00 -0.03 0.00 0.00 56.01 56.79 4rla n LEU 140 Cb 0.24 -0.37 0.47 0.00 -2.33 0.00 0.00 43.42 41.42 4rla n LEU 140 CO 0.76 -0.19 0.86 0.00 -1.33 0.00 0.00 177.39 177.49 4rla n HIS 141 N -1.37 0.79 0.23 -1.77 1.44 0.54 -2.61 115.22 112.47 4rla n HIS 141 Ca 0.06 0.29 0.12 0.00 -2.01 0.00 0.00 57.72 56.18 4rla n HIS 141 Cb 0.14 -0.97 0.23 0.00 0.12 0.00 0.00 29.99 29.51 4rla n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 4rla n GLY 142 N 0.29 1.84 0.01 -1.39 0.00 -1.17 -4.39 105.19 100.38 4rla n GLY 142 Ca 0.03 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 1.54 0.57 -0.30 1.61 6.02 -1.07 -1.73 117.38 124.02 4rla n GLN 143 Ca 0.20 -0.42 0.02 0.00 -0.01 0.00 0.00 57.00 56.79 4rla n GLN 143 Cb 0.62 -0.91 0.09 0.00 1.02 0.00 0.00 30.24 31.05 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 0.06 -0.02 0.00 -1.09 0.13 -1.62 0.11 132.00 129.57 4rla h PRO 144 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 4rla h PRO 144 Cb 0.01 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.14 4rla h PRO 144 CO 0.00 -0.01 -0.13 0.28 -0.23 0.00 0.00 178.00 177.90 4rla h VAL 145 N -0.02 0.54 0.00 1.56 2.07 -1.81 -2.10 116.25 116.49 4rla h VAL 145 Ca 0.38 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 67.20 4rla h VAL 145 Cb 0.61 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 4rla h VAL 145 CO -0.86 0.13 -0.36 0.00 0.02 0.00 0.00 177.57 176.50 4rla h ALA 146 N 1.87 1.33 0.00 1.67 0.00 -0.93 -2.66 119.26 120.53 4rla h ALA 146 Ca -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 4rla h ALA 146 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 4rla h ALA 146 CO 0.02 0.45 -0.18 1.19 0.00 0.00 0.00 179.25 180.73 4rla n PHE 147 N -4.01 0.54 -0.07 0.00 3.01 -0.79 -4.11 117.46 112.02 4rla n PHE 147 Ca -0.02 0.16 -0.04 0.00 1.01 0.00 0.00 57.45 58.56 4rla n PHE 147 Cb 0.41 -0.71 -0.15 0.00 -0.01 0.00 0.00 39.48 39.02 4rla n PHE 147 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 4rla n LEU 148 N -1.98 0.00 -4.72 4.37 4.77 -1.03 -4.28 117.00 114.13 4rla n LEU 148 Ca 0.05 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 4rla n LEU 148 Cb 0.40 0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 41.82 4rla n LEU 148 CO 0.31 0.35 1.06 -0.76 -1.33 0.00 0.00 177.39 177.03 4rla s LEU 149 N -5.17 4.38 0.13 2.23 1.43 -1.03 -1.23 118.68 119.42 4rla s LEU 149 Ca -0.09 2.40 -0.13 0.00 -1.03 0.00 0.00 54.13 55.27 4rla s LEU 149 Cb 0.08 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.67 4rla s LEU 149 CO 0.81 -0.64 1.52 0.11 0.23 0.00 0.00 176.35 178.38 4rla h LYS 150 N 6.32 0.79 0.00 1.70 1.57 -1.20 -2.91 116.57 122.83 4rla h LYS 150 Ca -0.43 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.03 4rla h LYS 150 Cb 1.21 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.48 4rla h LYS 150 CO 0.84 0.93 0.00 0.39 -0.57 0.00 0.00 179.45 181.04 4rla n GLU 151 N -4.31 0.00 -0.17 3.15 4.71 -1.26 -1.10 120.64 121.66 4rla n GLU 151 Ca -0.01 0.43 0.07 0.00 -0.01 0.00 0.00 57.16 57.63 4rla n GLU 151 Cb 0.38 -1.50 0.16 0.00 -1.01 0.00 0.00 31.44 29.47 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 -1.50 2.94 -4.66 -4.62 4.32 -1.10 -4.93 117.00 107.45 4rla n LEU 152 Ca 0.01 -1.78 -0.42 0.00 -0.02 0.00 0.00 56.01 53.80 4rla n LEU 152 Cb 0.05 -0.23 -0.03 0.00 -1.62 0.00 0.00 43.42 41.60 4rla n LEU 152 CO 0.04 0.70 1.49 -0.75 -1.22 0.00 0.00 177.39 177.65 4rla s LYS 153 N -1.04 4.16 0.00 3.23 2.47 -0.26 -1.73 119.74 126.57 4rla s LYS 153 Ca 0.26 2.43 0.00 0.00 -1.56 0.00 0.00 55.97 57.10 4rla s LYS 153 Cb 0.14 -4.04 0.00 0.00 -1.46 0.00 0.00 37.83 32.48 4rla s LYS 153 CO 0.19 -0.89 0.00 0.41 0.16 0.00 0.00 175.35 175.22 4rla n GLY 154 N 4.34 0.55 0.11 5.54 0.00 -1.26 -4.87 105.19 109.60 4rla n GLY 154 Ca 0.19 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.34 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 0.57 -3.73 1.61 4.76 -0.71 -4.85 118.16 113.20 4rla n LYS 155 Ca 0.00 -0.22 -0.14 0.00 -2.87 0.00 0.00 58.31 55.08 4rla n LYS 155 Cb 0.02 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 31.64 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 -2.58 -0.25 1.03 2.13 -0.71 -1.26 -5.01 117.98 111.33 4rla s PHE 156 Ca 0.25 0.39 -0.14 0.00 -1.04 0.00 0.00 56.93 56.40 4rla s PHE 156 Cb 0.20 0.14 0.11 0.00 -1.21 0.00 0.00 43.02 42.26 4rla s PHE 156 CO 0.51 -0.42 0.52 -0.35 -1.34 0.00 0.00 175.22 174.15 4rla n PRO 157 N 1.25 -1.01 -2.64 1.99 -0.04 -1.26 -4.95 135.00 128.34 4rla n PRO 157 Ca -0.21 -0.26 -0.42 0.00 -0.04 0.00 0.00 63.50 62.57 4rla n PRO 157 Cb 0.56 -1.96 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 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 -2.14 7.28 -0.19 3.54 1.01 -1.26 -5.01 116.67 119.90 4rla s ASP 158 Ca 0.60 1.71 -0.12 0.00 0.71 0.00 0.00 52.55 55.45 4rla s ASP 158 Cb -0.20 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.12 4rla s ASP 158 CO 0.65 -0.34 0.22 -0.69 0.21 0.00 0.00 175.17 175.22 4rla s VAL 159 N 1.23 5.34 -0.22 -1.27 1.01 -1.26 -5.03 120.40 120.20 4rla s VAL 159 Ca 0.53 0.38 -0.37 0.00 0.00 0.00 0.00 61.98 62.52 4rla s VAL 159 Cb -0.22 -3.56 -0.13 0.00 0.00 0.00 0.00 36.38 32.46 4rla s VAL 159 CO 0.26 0.39 1.91 -2.65 0.00 0.00 0.00 175.10 175.01 4rla n PRO 160 N 3.73 1.55 0.00 2.72 -0.02 -1.26 -1.75 135.00 139.97 4rla n PRO 160 Ca -0.13 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 4rla n PRO 160 Cb 0.52 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 4.82 2.70 1.22 -1.23 0.00 -1.26 -2.85 105.19 108.59 4rla n GLY 161 Ca 0.28 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.39 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 -0.76 1.14 0.08 1.61 3.72 -0.72 -4.31 117.46 118.23 4rla n PHE 162 Ca 0.00 -0.64 0.18 0.00 -0.05 0.00 0.00 57.45 56.93 4rla n PHE 162 Cb 0.00 -0.21 0.71 0.00 -0.94 0.00 0.00 39.48 39.04 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 3.12 0.00 1.18 4.37 4.64 -1.93 -0.25 113.55 124.68 4rla h SER 163 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 4rla h SER 163 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 4rla h SER 163 CO 0.18 0.00 -0.18 4.11 -0.87 0.00 0.00 176.83 180.07 4rla h TRP 164 N 0.00 0.00 -3.67 4.77 5.08 -1.97 -3.45 115.95 116.71 4rla h TRP 164 Ca 0.18 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.63 4rla h TRP 164 Cb 0.78 0.00 0.04 0.00 -3.00 0.00 0.00 29.16 26.98 4rla h TRP 164 CO 0.00 0.18 0.60 0.08 -1.28 0.00 0.00 178.44 178.02 4rla s VAL 165 N -3.50 3.10 -0.14 0.12 1.01 -0.11 -5.04 120.40 115.85 4rla s VAL 165 Ca 0.02 1.02 -0.03 0.00 0.00 0.00 0.00 61.98 62.99 4rla s VAL 165 Cb 0.09 -3.65 0.05 0.00 0.00 0.00 0.00 36.38 32.87 4rla s VAL 165 CO 0.64 0.21 0.05 0.42 0.00 0.00 0.00 175.10 176.42 4rla s THR 166 N -0.65 0.17 -0.44 3.92 -4.23 -1.26 -5.10 115.64 108.05 4rla s THR 166 Ca 0.51 -0.15 -0.41 0.00 -1.18 0.00 0.00 61.69 60.47 4rla s THR 166 Cb -0.37 -0.64 -0.17 0.00 1.34 0.00 0.00 72.50 72.66 4rla s THR 166 CO 0.44 -0.10 1.51 -2.65 -0.54 0.00 0.00 174.62 173.29 4rla n PRO 167 N 5.19 0.00 0.00 3.99 -0.02 -1.26 -4.87 135.00 138.02 4rla n PRO 167 Ca -0.07 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.47 4rla n PRO 167 Cb 0.49 -1.32 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 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 -1.52 0.29 0.20 0.00 -4.36 -0.91 -4.99 121.20 109.91 4rla s ILE 169 Ca 0.10 -1.35 0.07 0.00 -0.26 0.00 0.00 60.65 59.22 4rla s ILE 169 Cb 0.10 -0.89 -0.04 0.00 1.25 0.00 0.00 42.46 42.88 4rla s ILE 169 CO 0.30 -0.68 0.05 -0.94 0.24 0.00 0.00 174.94 173.90 4rla s SER 170 N -2.13 4.95 0.47 4.36 1.04 -1.26 -0.70 113.70 120.43 4rla s SER 170 Ca -0.04 -0.38 0.32 0.00 0.48 0.00 0.00 55.95 56.33 4rla s SER 170 Cb -0.02 -1.11 1.42 0.00 0.10 0.00 0.00 66.02 66.41 4rla s SER 170 CO -0.04 0.05 1.71 0.00 0.98 0.00 0.00 173.24 175.94 4rla h ALA 171 N 2.35 2.87 0.00 5.32 0.00 -1.96 0.54 119.26 128.39 4rla h ALA 171 Ca -0.47 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.47 4rla h ALA 171 Cb 1.22 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.12 4rla h ALA 171 CO 0.60 -1.35 0.00 1.17 0.00 0.00 0.00 179.25 179.66 4rla n LYS 172 N -4.42 0.74 0.00 0.00 3.00 -1.26 -3.28 118.16 112.93 4rla n LYS 172 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.63 4rla n LYS 172 Cb 1.32 -1.24 0.00 0.00 0.00 0.00 0.00 35.03 35.10 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 -0.74 1.54 -4.15 3.14 8.00 0.19 -4.96 116.55 119.57 4rla n ASP 173 Ca 0.09 -1.66 -0.26 0.00 0.71 0.00 0.00 54.79 53.67 4rla n ASP 173 Cb 0.04 0.00 -0.16 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 -0.66 1.45 -0.12 0.53 2.07 -1.21 -1.54 121.20 121.73 4rla s ILE 174 Ca 0.00 -0.74 0.01 0.00 -1.41 0.00 0.00 60.65 58.51 4rla s ILE 174 Cb 0.00 -1.24 0.02 0.00 0.13 0.00 0.00 42.46 41.37 4rla s ILE 174 CO 0.00 0.42 -0.13 -0.69 -1.91 0.00 0.00 174.94 172.63 4rla s VAL 175 N -0.06 1.39 0.04 4.00 1.01 -0.43 -4.04 120.40 122.32 4rla s VAL 175 Ca -0.02 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.25 4rla s VAL 175 Cb -0.11 -1.31 -0.06 0.00 0.00 0.00 0.00 36.38 34.90 4rla s VAL 175 CO 0.02 0.43 0.49 -0.31 0.00 0.00 0.00 175.10 175.72 4rla s TYR 176 N 1.33 3.76 -0.04 5.22 2.02 -1.01 -0.36 117.35 128.26 4rla s TYR 176 Ca 0.00 1.13 0.01 0.00 -0.37 0.00 0.00 57.07 57.83 4rla s TYR 176 Cb -0.14 -2.39 0.02 0.00 -0.40 0.00 0.00 41.96 39.06 4rla s TYR 176 CO -0.06 0.60 -0.03 0.42 -1.57 0.00 0.00 175.55 174.92 4rla s ILE 177 N -1.12 0.40 0.00 2.71 1.01 0.10 -0.09 121.20 124.20 4rla s ILE 177 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.89 4rla s ILE 177 Cb -0.18 -0.46 0.00 0.00 0.01 0.00 0.00 42.46 41.83 4rla s ILE 177 CO 0.16 0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.92 4rla n GLY 178 N 4.18 0.79 3.74 6.18 0.00 -0.02 -1.18 105.19 118.88 4rla n GLY 178 Ca -0.24 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 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 4.36 0.00 0.99 1.43 -1.16 -3.83 118.68 120.47 4rla s LEU 179 Ca 0.00 2.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.97 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 -0.89 0.00 -2.11 0.23 0.00 0.00 176.35 173.58 4rla n ARG 180 N 2.67 0.00 -3.02 1.70 1.85 -0.27 -1.75 116.66 117.84 4rla n ARG 180 Ca 0.10 0.00 -0.16 0.00 -1.00 0.00 0.00 57.85 56.78 4rla n ARG 180 Cb 0.37 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.76 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 -1.48 -4.53 2.89 2.03 -0.45 -5.04 116.55 109.97 4rla n ASP 181 Ca 0.00 -2.86 -0.34 0.00 0.52 0.00 0.00 54.79 52.11 4rla n ASP 181 Cb 0.42 0.53 -0.12 0.00 -0.72 0.00 0.00 41.12 41.23 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 -0.05 4.08 0.54 5.18 1.01 -1.26 -4.55 120.40 125.34 4rla s VAL 182 Ca 0.33 -0.29 -0.19 0.00 0.00 0.00 0.00 61.98 61.83 4rla s VAL 182 Cb 0.14 -2.80 -0.06 0.00 0.00 0.00 0.00 36.38 33.66 4rla s VAL 182 CO -0.16 0.49 1.07 -1.81 0.00 0.00 0.00 175.10 174.69 4rla s ASP 183 N 0.33 5.98 0.25 3.32 1.01 -1.26 -4.82 116.67 121.48 4rla s ASP 183 Ca -0.02 1.96 -0.03 0.00 0.71 0.00 0.00 52.55 55.17 4rla s ASP 183 Cb -0.14 -2.56 0.48 0.00 1.01 0.00 0.00 42.92 41.71 4rla s ASP 183 CO 0.02 -1.03 1.74 -0.65 0.21 0.00 0.00 175.17 175.46 4rla h PRO 184 N 1.10 0.48 -0.01 8.23 0.11 -1.99 0.20 132.00 140.13 4rla h PRO 184 Ca -0.49 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 4rla h PRO 184 Cb 1.23 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 4rla h PRO 184 CO 0.58 0.32 0.00 0.78 -0.21 0.00 0.00 178.00 179.47 4rla h GLY 185 N 0.50 0.01 1.56 -0.55 0.00 -1.92 -0.77 103.07 101.90 4rla h GLY 185 Ca 0.43 -0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.74 4rla h GLY 185 CO -0.39 0.00 0.22 0.83 0.00 0.00 0.00 176.54 177.20 4rla h GLU 186 N -0.07 0.58 -0.19 4.80 5.08 -1.48 -0.48 114.58 122.82 4rla h GLU 186 Ca 0.00 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.16 4rla h GLU 186 Cb 0.08 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 4rla h GLU 186 CO -0.00 0.44 -0.49 1.25 -1.00 0.00 0.00 179.01 179.21 4rla h HIS 187 N 0.58 0.60 -0.43 4.33 2.76 -0.26 -0.69 115.15 122.06 4rla h HIS 187 Ca 0.15 -0.20 -0.04 0.00 -2.20 0.00 0.00 60.37 58.09 4rla h HIS 187 Cb 0.04 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 28.86 4rla h HIS 187 CO 0.00 0.89 0.12 -0.92 -1.30 0.00 0.00 177.93 176.72 4rla h TYR 188 N 0.39 0.70 0.05 5.26 3.20 0.09 -1.87 116.97 124.79 4rla h TYR 188 Ca 0.02 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 61.81 4rla h TYR 188 Cb 1.00 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.07 4rla h TYR 188 CO 0.04 0.65 -0.02 0.82 -1.64 0.00 0.00 178.16 178.00 4rla h ILE 189 N 0.55 1.00 -0.14 1.81 2.04 -0.86 0.17 117.51 122.08 4rla h ILE 189 Ca 0.14 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.75 4rla h ILE 189 Cb 0.29 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 4rla h ILE 189 CO -0.00 0.04 -0.23 0.16 0.00 0.00 0.00 178.15 178.12 4rla h ILE 190 N -0.14 1.23 0.06 -0.67 3.07 -1.11 -1.13 117.51 118.82 4rla h ILE 190 Ca -0.01 -1.07 -0.00 0.00 1.55 0.00 0.00 64.86 65.33 4rla h ILE 190 Cb 0.12 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 38.06 4rla h ILE 190 CO 0.01 0.33 -0.03 0.11 -1.05 0.00 0.00 178.15 177.52 4rla h LYS 191 N 0.23 -0.08 -0.51 0.16 1.79 -1.18 -1.84 116.57 115.14 4rla h LYS 191 Ca 0.04 0.01 0.04 0.00 -2.18 0.00 0.00 60.65 58.56 4rla h LYS 191 Cb 0.54 0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 31.17 4rla h LYS 191 CO 0.04 0.50 0.25 1.15 -1.08 0.00 0.00 179.45 180.31 4rla h THR 192 N -0.78 0.95 0.00 -0.16 2.02 -0.62 -2.09 112.91 112.22 4rla h THR 192 Ca -0.01 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.00 4rla h THR 192 Cb 0.62 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 4rla h THR 192 CO 0.01 0.09 0.00 0.18 0.37 0.00 0.00 175.52 176.17 4rla n LEU 193 N -4.89 0.21 -2.10 2.58 4.32 -0.43 -4.94 117.00 111.76 4rla n LEU 193 Ca 0.04 0.53 -0.14 0.00 -0.02 0.00 0.00 56.01 56.43 4rla n LEU 193 Cb 0.14 -0.48 0.03 0.00 -1.62 0.00 0.00 43.42 41.49 4rla n LEU 193 CO 0.29 -0.18 0.08 0.61 -1.22 0.00 0.00 177.39 176.97 4rla n GLY 194 N 0.82 0.03 3.77 -0.72 0.00 -0.79 -4.89 105.19 103.41 4rla n GLY 194 Ca 0.05 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.05 3.74 -0.08 -0.61 1.01 -0.73 -4.88 121.20 116.59 4rla s ILE 195 Ca 0.26 1.59 -0.26 0.00 0.00 0.00 0.00 60.65 62.25 4rla s ILE 195 Cb -0.12 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.38 4rla s ILE 195 CO 0.33 0.26 0.81 -0.75 0.00 0.00 0.00 174.94 175.58 4rla s LYS 196 N -1.77 4.43 0.03 2.79 2.47 -1.26 -4.91 119.74 121.53 4rla s LYS 196 Ca 0.48 1.05 -0.07 0.00 -1.56 0.00 0.00 55.97 55.87 4rla s LYS 196 Cb -0.27 -3.49 -0.01 0.00 -1.46 0.00 0.00 37.83 32.61 4rla s LYS 196 CO 0.34 -0.08 0.13 1.52 0.16 0.00 0.00 175.35 177.42 4rla s TYR 197 N 1.24 0.14 -0.37 4.03 1.13 -1.26 -2.41 117.35 119.84 4rla s TYR 197 Ca 0.41 -0.40 0.01 0.00 -1.41 0.00 0.00 57.07 55.69 4rla s TYR 197 Cb -0.18 -0.10 0.11 0.00 -1.10 0.00 0.00 41.96 40.69 4rla s TYR 197 CO 0.19 -0.38 0.14 -0.06 -2.51 0.00 0.00 175.55 172.93 4rla s PHE 198 N -2.47 2.23 0.92 -3.49 0.08 0.87 -4.92 117.98 111.20 4rla s PHE 198 Ca -0.06 -2.26 -0.13 0.00 0.12 0.00 0.00 56.93 54.60 4rla s PHE 198 Cb -0.02 -2.04 0.19 0.00 -0.57 0.00 0.00 43.02 40.59 4rla s PHE 198 CO -0.04 -0.85 1.26 -1.54 -0.10 0.00 0.00 175.22 173.95 4rla s SER 199 N 0.99 3.28 0.43 1.36 1.04 -1.26 -0.84 113.70 118.69 4rla s SER 199 Ca 0.13 0.09 0.14 0.00 0.48 0.00 0.00 55.95 56.78 4rla s SER 199 Cb -0.20 -0.16 1.01 0.00 0.10 0.00 0.00 66.02 66.77 4rla s SER 199 CO -0.13 -2.61 1.96 0.24 0.98 0.00 0.00 173.24 173.69 4rla h MET 200 N -1.45 0.42 -0.34 4.02 2.86 -1.60 -0.91 114.93 117.94 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 32.78 4rla h MET 200 CO 0.36 0.28 -0.21 1.79 1.06 0.00 0.00 176.91 180.19 4rla h THR 201 N 0.44 1.27 -0.20 2.22 1.35 -1.93 0.22 112.91 116.28 4rla h THR 201 Ca 0.31 -1.28 -0.16 0.00 -0.55 0.00 0.00 66.41 64.73 4rla h THR 201 Cb 0.62 1.24 -0.01 0.00 -1.73 0.00 0.00 68.15 68.26 4rla h THR 201 CO -0.09 0.42 -0.53 -0.33 -0.25 0.00 0.00 175.52 174.74 4rla h GLU 202 N 0.58 0.57 -0.41 4.72 3.07 -1.55 0.13 114.58 121.69 4rla h GLU 202 Ca 0.09 -0.35 -0.10 0.00 -0.50 0.00 0.00 59.36 58.50 4rla h GLU 202 Cb 0.68 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.61 4rla h GLU 202 CO 0.05 0.96 -0.14 0.28 -1.40 0.00 0.00 179.01 178.76 4rla h VAL 203 N 0.44 1.26 -0.43 3.13 2.07 -0.81 0.45 116.25 122.36 4rla h VAL 203 Ca 0.01 -1.20 -0.09 0.00 0.82 0.00 0.00 66.70 66.24 4rla h VAL 203 Cb 1.07 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 4rla h VAL 203 CO 0.10 0.41 -0.09 0.44 0.02 0.00 0.00 177.57 178.45 4rla h ASP 204 N 0.67 0.82 -0.30 0.57 3.32 -0.67 0.11 116.42 120.94 4rla h ASP 204 Ca 0.11 -0.35 -0.18 0.00 0.02 0.00 0.00 57.03 56.63 4rla h ASP 204 Cb 0.62 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 4rla h ASP 204 CO 0.04 0.99 -0.51 0.50 -1.72 0.00 0.00 179.24 178.54 4rla h LYS 205 N 0.65 0.87 0.00 3.56 3.64 -0.66 -3.37 116.57 121.26 4rla h LYS 205 Ca 0.11 -0.54 -0.36 0.00 -1.27 0.00 0.00 60.65 58.59 4rla h LYS 205 Cb 0.62 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.42 4rla h LYS 205 CO 0.04 1.17 -2.36 1.28 -2.27 0.00 0.00 179.45 177.31 4rla n LEU 206 N -4.04 0.15 0.00 5.20 4.77 0.12 -5.09 117.00 118.11 4rla n LEU 206 Ca -0.04 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 4rla n LEU 206 Cb 0.61 0.42 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 4rla n LEU 206 CO 0.50 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 4rla n GLY 207 N 1.81 0.39 0.37 -0.72 0.00 0.36 -4.18 105.19 103.22 4rla n GLY 207 Ca -0.33 -1.56 0.19 0.00 0.00 0.00 0.00 46.02 44.33 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 0.73 0.59 -0.61 6.09 -1.93 -2.54 117.51 119.83 4rla h ILE 208 Ca 0.00 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.46 4rla h ILE 208 Cb 0.00 0.75 -0.00 0.00 0.47 0.00 0.00 36.82 38.03 4rla h ILE 208 CO 0.00 0.00 -0.38 1.23 -3.07 0.00 0.00 178.15 175.93 4rla h GLY 209 N 0.00 -1.12 0.84 8.18 0.00 -1.95 -2.03 103.07 106.99 4rla h GLY 209 Ca 0.23 0.47 0.08 0.00 0.00 0.00 0.00 47.33 48.11 4rla h GLY 209 CO -0.00 -0.37 0.55 1.70 0.00 0.00 0.00 176.54 178.41 4rla h LYS 210 N -0.92 0.84 0.24 4.80 1.63 -1.66 -0.69 116.57 120.81 4rla h LYS 210 Ca -0.08 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.68 4rla h LYS 210 Cb 0.74 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 32.16 4rla h LYS 210 CO 0.07 0.55 -0.29 0.28 -3.45 0.00 0.00 179.45 176.61 4rla h VAL 211 N 0.86 0.38 -0.80 2.00 2.07 -1.25 -0.80 116.25 118.72 4rla h VAL 211 Ca 0.38 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.88 4rla h VAL 211 Cb 0.33 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 4rla h VAL 211 CO -0.15 0.00 0.43 0.24 0.02 0.00 0.00 177.57 178.11 4rla h MET 212 N -0.58 1.12 -0.91 1.57 2.86 -0.77 -0.49 114.93 117.72 4rla h MET 212 Ca 0.00 -0.14 0.09 0.00 -2.06 0.00 0.00 59.70 57.60 4rla h MET 212 Cb 0.55 -0.22 -0.07 0.00 0.06 0.00 0.00 31.60 31.93 4rla h MET 212 CO -0.09 0.83 0.59 1.49 1.06 0.00 0.00 176.91 180.78 4rla h GLU 213 N 1.11 0.90 0.04 1.72 4.81 -0.73 -2.07 114.58 120.36 4rla h GLU 213 Ca 0.28 -0.05 -0.29 0.00 -0.13 0.00 0.00 59.36 59.17 4rla h GLU 213 Cb 0.04 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 4rla h GLU 213 CO -0.04 0.60 -1.57 0.93 -0.73 0.00 0.00 179.01 178.20 4rla h GLU 214 N 0.93 0.09 -0.83 1.92 5.08 -0.65 -2.99 114.58 118.13 4rla h GLU 214 Ca 0.42 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 4rla h GLU 214 Cb 0.38 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 4rla h GLU 214 CO -0.18 0.81 0.51 1.79 -1.00 0.00 0.00 179.01 180.94 4rla h THR 215 N 0.02 1.23 0.20 1.13 1.35 -0.80 -1.04 112.91 115.00 4rla h THR 215 Ca -0.24 -0.47 -0.01 0.00 -0.55 0.00 0.00 66.41 65.14 4rla h THR 215 Cb 1.97 0.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.44 4rla h THR 215 CO 0.11 0.23 -0.10 -0.26 -0.25 0.00 0.00 175.52 175.25 4rla h PHE 216 N 1.13 -0.25 0.00 4.73 0.04 -1.49 -0.29 116.94 120.81 4rla h PHE 216 Ca 0.30 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 61.03 4rla h PHE 216 Cb -0.07 0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 4rla h PHE 216 CO -0.01 0.03 -0.16 0.66 -0.60 0.00 0.00 178.31 178.23 4rla h SER 217 N -0.53 0.00 -0.01 2.17 4.64 -1.42 0.87 113.55 119.27 4rla h SER 217 Ca -0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 4rla h SER 217 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 4rla h SER 217 CO 0.05 0.16 -0.04 0.22 -0.87 0.00 0.00 176.83 176.35 4rla h TYR 218 N 0.00 0.07 0.00 4.77 3.20 -1.09 -2.70 116.97 121.22 4rla h TYR 218 Ca -0.00 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 4rla h TYR 218 Cb 0.35 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.60 4rla h TYR 218 CO 0.00 0.68 -0.00 -0.07 -1.64 0.00 0.00 178.16 177.12 4rla h LEU 219 N -0.56 -0.00 -3.26 2.82 3.38 -0.65 -3.34 115.31 113.70 4rla h LEU 219 Ca -0.00 -0.81 -0.26 0.00 0.09 0.00 0.00 57.88 56.90 4rla h LEU 219 Cb 0.68 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.27 4rla h LEU 219 CO 0.01 0.90 0.33 0.18 0.09 0.00 0.00 178.44 179.95 4rla n LEU 220 N -4.65 5.32 0.00 1.67 4.77 0.30 -4.73 117.00 119.68 4rla n LEU 220 Ca -0.08 -2.79 0.00 0.00 -0.03 0.00 0.00 56.01 53.11 4rla n LEU 220 Cb 0.39 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 4rla n LEU 220 CO 0.28 0.78 0.45 0.61 -1.33 0.00 0.00 177.39 178.18 4rla n GLY 221 N -0.34 -2.64 0.12 -0.72 0.00 -1.02 -4.35 105.19 96.24 4rla n GLY 221 Ca 0.36 0.09 -0.20 0.00 0.00 0.00 0.00 46.02 46.26 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 0.23 -4.60 1.61 3.08 -1.84 -3.47 114.38 109.40 4rla h ARG 222 Ca 0.00 -0.40 -0.47 0.00 0.07 0.00 0.00 59.98 59.18 4rla h ARG 222 Cb 0.00 0.15 -0.32 0.00 0.08 0.00 0.00 29.97 29.88 4rla h ARG 222 CO 0.00 1.19 -0.80 -1.59 -1.07 0.00 0.00 179.97 177.70 4rla s LYS 223 N -2.43 1.27 -0.27 0.04 0.00 -1.26 -5.11 119.74 111.98 4rla s LYS 223 Ca -0.18 -0.35 -0.29 0.00 0.00 0.00 0.00 55.97 55.15 4rla s LYS 223 Cb 0.03 -1.13 0.01 0.00 0.00 0.00 0.00 37.83 36.74 4rla s LYS 223 CO 0.78 0.08 1.17 0.15 0.00 0.00 0.00 175.35 177.53 4rla s LYS 224 N 0.41 4.09 0.34 1.78 1.02 -1.26 -4.58 119.74 121.54 4rla s LYS 224 Ca -0.08 1.29 0.03 0.00 0.02 0.00 0.00 55.97 57.24 4rla s LYS 224 Cb -0.12 -3.77 -0.05 0.00 -0.52 0.00 0.00 37.83 33.37 4rla s LYS 224 CO 0.02 -0.88 0.08 -0.98 -0.92 0.00 0.00 175.35 172.66 4rla s ARG 225 N 3.69 1.69 0.24 1.68 1.70 -1.26 -5.12 118.95 121.57 4rla s ARG 225 Ca 0.50 -1.96 -0.31 0.00 -0.47 0.00 0.00 55.73 53.50 4rla s ARG 225 Cb -0.16 -0.76 -0.11 0.00 -0.57 0.00 0.00 34.95 33.35 4rla s ARG 225 CO 0.16 -0.26 1.61 -2.14 -1.08 0.00 0.00 175.30 173.59 4rla s PRO 226 N -3.87 4.16 -0.21 3.89 0.02 -1.26 -4.87 135.00 132.86 4rla s PRO 226 Ca 0.34 2.51 -0.09 0.00 0.02 0.00 0.00 61.00 63.78 4rla s PRO 226 Cb 0.07 -3.07 -0.05 0.00 0.02 0.00 0.00 34.50 31.47 4rla s PRO 226 CO 0.15 -0.64 0.12 0.42 -0.33 0.00 0.00 177.00 176.72 4rla s ILE 227 N 0.56 5.17 -0.28 2.83 1.01 -0.31 -1.00 121.20 129.19 4rla s ILE 227 Ca 0.67 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 61.39 4rla s ILE 227 Cb -0.47 -3.37 0.02 0.00 0.01 0.00 0.00 42.46 38.65 4rla s ILE 227 CO 0.39 0.42 0.02 -2.28 0.00 0.00 0.00 174.94 173.49 4rla s HIS 228 N 0.60 3.12 -0.37 3.97 5.65 0.64 -1.17 115.29 127.73 4rla s HIS 228 Ca 0.06 -1.27 -0.15 0.00 0.25 0.00 0.00 55.06 53.96 4rla s HIS 228 Cb -0.12 -2.17 -0.00 0.00 -1.18 0.00 0.00 32.58 29.11 4rla s HIS 228 CO 0.01 -0.65 0.32 -1.17 -0.65 0.00 0.00 174.74 172.60 4rla s LEU 229 N 1.41 4.70 -0.37 8.88 2.96 0.44 -1.84 118.68 134.87 4rla s LEU 229 Ca 0.01 -0.52 -0.13 0.00 -0.22 0.00 0.00 54.13 53.27 4rla s LEU 229 Cb -0.17 -2.24 0.01 0.00 0.50 0.00 0.00 46.19 44.28 4rla s LEU 229 CO -0.01 -0.38 0.24 -0.55 -1.32 0.00 0.00 176.35 174.34 4rla s SER 230 N 1.73 5.94 -0.34 3.68 0.15 -0.77 -1.13 113.70 122.95 4rla s SER 230 Ca 0.08 -0.71 -0.05 0.00 0.70 0.00 0.00 55.95 55.97 4rla s SER 230 Cb -0.17 -2.10 0.06 0.00 -1.71 0.00 0.00 66.02 62.09 4rla s SER 230 CO 0.11 -0.33 0.10 0.12 1.20 0.00 0.00 173.24 174.44 4rla s PHE 231 N 1.66 3.31 -0.27 3.44 2.19 0.31 -2.07 117.98 126.55 4rla s PHE 231 Ca 0.05 -1.71 -0.19 0.00 0.33 0.00 0.00 56.93 55.41 4rla s PHE 231 Cb -0.18 -2.42 -0.02 0.00 -1.31 0.00 0.00 43.02 39.09 4rla s PHE 231 CO 0.09 -0.80 0.57 0.34 1.83 0.00 0.00 175.22 177.26 4rla s ASP 232 N 1.49 6.49 0.47 6.13 -1.08 -0.35 -1.47 116.67 128.36 4rla s ASP 232 Ca -0.01 0.56 0.27 0.00 -0.52 0.00 0.00 52.55 52.85 4rla s ASP 232 Cb -0.20 -2.31 1.33 0.00 -1.46 0.00 0.00 42.92 40.28 4rla s ASP 232 CO 0.01 -0.35 1.80 0.58 0.52 0.00 0.00 175.17 177.73 4rla h VAL 233 N 5.43 0.49 0.00 1.11 2.07 -1.77 0.29 116.25 123.86 4rla h VAL 233 Ca -0.28 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.18 4rla h VAL 233 Cb 1.13 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 4rla h VAL 233 CO 0.75 0.03 0.00 -0.90 0.02 0.00 0.00 177.57 177.47 4rla n ASP 234 N -4.40 0.00 0.23 0.57 5.68 -1.26 -2.43 116.55 114.94 4rla n ASP 234 Ca 0.24 -0.68 0.12 0.00 -0.50 0.00 0.00 54.79 53.98 4rla n ASP 234 Cb 1.03 0.00 0.36 0.00 -1.14 0.00 0.00 41.12 41.36 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 2.38 0.00 -2.92 6.12 0.00 -1.20 -3.35 103.07 104.09 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 -0.26 1.08 0.00 0.00 0.00 176.54 177.36 4rla s LEU 236 N -6.30 4.11 0.54 3.11 1.43 -1.02 -2.08 118.68 118.47 4rla s LEU 236 Ca 0.04 0.37 -0.22 0.00 -1.03 0.00 0.00 54.13 53.29 4rla s LEU 236 Cb 0.07 -3.20 -0.05 0.00 0.03 0.00 0.00 46.19 43.04 4rla s LEU 236 CO 0.63 -0.21 1.35 -0.67 0.23 0.00 0.00 176.35 177.68 4rla n ASP 237 N -1.55 2.64 0.18 2.29 2.03 0.28 -4.64 116.55 117.77 4rla n ASP 237 Ca -0.06 0.98 0.11 0.00 0.52 0.00 0.00 54.79 56.35 4rla n ASP 237 Cb 0.56 -1.57 0.61 0.00 -0.72 0.00 0.00 41.12 40.00 4rla n ASP 237 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 4rla h PRO 238 N 1.43 0.00 0.00 -0.67 0.11 -1.85 0.26 132.00 131.29 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 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 4rla h PRO 238 CO 0.57 0.00 0.00 -0.24 -0.21 0.00 0.00 178.00 178.12 4rla h VAL 239 N 0.00 0.00 0.00 3.15 3.04 -1.95 -2.66 116.25 117.83 4rla h VAL 239 Ca 0.00 -0.39 -0.30 0.00 -1.01 0.00 0.00 66.70 64.99 4rla h VAL 239 Cb 0.10 1.26 -0.05 0.00 -2.01 0.00 0.00 31.29 30.59 4rla h VAL 239 CO 0.00 0.00 -2.06 0.49 -1.01 0.00 0.00 177.57 174.99 4rla n PHE 240 N -2.39 0.00 -3.16 3.17 3.72 0.88 -4.81 117.46 114.87 4rla n PHE 240 Ca 0.03 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.17 4rla n PHE 240 Cb 0.33 -0.70 -0.06 0.00 -0.94 0.00 0.00 39.48 38.11 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 -3.51 2.16 0.04 4.37 -2.24 -0.97 -3.90 114.28 110.24 4rla n THR 241 Ca -0.36 -5.22 0.04 0.00 -2.27 0.00 0.00 64.05 56.24 4rla n THR 241 Cb 0.80 -1.58 0.43 0.00 -2.10 0.00 0.00 70.33 67.88 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 3.50 0.45 -5.76 -0.78 0.13 -1.72 -3.38 132.00 124.44 4rla h PRO 242 Ca 0.15 -0.04 -0.68 0.00 -0.87 0.00 0.00 66.00 64.56 4rla h PRO 242 Cb 0.64 -0.10 -0.09 0.00 0.13 0.00 0.00 31.00 31.58 4rla h PRO 242 CO 0.76 0.34 2.03 0.00 -0.23 0.00 0.00 178.00 180.90 4rla s ALA 243 N -5.32 3.33 0.24 -0.56 0.00 -1.26 -4.82 121.76 113.37 4rla s ALA 243 Ca -0.08 -2.90 -0.12 0.00 0.00 0.00 0.00 51.96 48.86 4rla s ALA 243 Cb 0.17 -4.58 -0.01 0.00 0.00 0.00 0.00 23.12 18.71 4rla s ALA 243 CO 0.73 -3.27 0.46 0.95 0.00 0.00 0.00 175.76 174.63 4rla s THR 244 N 4.00 0.00 0.04 0.00 -4.23 -1.26 -1.58 115.64 112.61 4rla s THR 244 Ca 0.52 -1.42 -0.18 0.00 -1.18 0.00 0.00 61.69 59.43 4rla s THR 244 Cb 0.03 -2.20 -0.19 0.00 1.34 0.00 0.00 72.50 71.47 4rla s THR 244 CO 0.05 -0.00 1.21 1.23 -0.54 0.00 0.00 174.62 176.57 4rla h GLY 245 N 2.27 0.58 -6.61 3.99 0.00 -1.90 -3.41 103.07 97.99 4rla h GLY 245 Ca -0.26 -0.85 -0.60 0.00 0.00 0.00 0.00 47.33 45.61 4rla h GLY 245 CO 0.36 0.76 -0.77 2.41 0.00 0.00 0.00 176.54 179.30 4rla n THR 246 N -4.20 0.52 -2.53 4.70 -1.04 -1.26 -5.10 114.28 105.37 4rla n THR 246 Ca -0.08 -4.33 -0.38 0.00 -2.04 0.00 0.00 64.05 57.21 4rla n THR 246 Cb 0.63 -1.97 -0.04 0.00 -1.82 0.00 0.00 70.33 67.13 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 -1.05 4.42 -0.03 -2.82 0.04 -1.26 -4.94 135.00 129.35 4rla s PRO 247 Ca 0.31 1.63 0.02 0.00 0.04 0.00 0.00 61.00 62.99 4rla s PRO 247 Cb 0.03 -2.86 0.01 0.00 0.04 0.00 0.00 34.50 31.72 4rla s PRO 247 CO -0.15 0.06 -0.08 0.08 0.04 0.00 0.00 177.00 176.94 4rla s VAL 248 N -1.42 0.73 0.73 -0.36 1.01 -1.26 -5.04 120.40 114.79 4rla s VAL 248 Ca 0.51 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 62.06 4rla s VAL 248 Cb -0.26 -0.67 0.04 0.00 0.00 0.00 0.00 36.38 35.48 4rla s VAL 248 CO 0.33 0.24 1.10 0.68 0.00 0.00 0.00 175.10 177.45 4rla s VAL 249 N 0.37 3.28 -0.21 2.92 -7.23 -1.26 -4.08 120.40 114.19 4rla s VAL 249 Ca -0.06 0.48 0.00 0.00 -1.81 0.00 0.00 61.98 60.59 4rla s VAL 249 Cb -0.10 -2.97 0.00 0.00 0.56 0.00 0.00 36.38 33.87 4rla s VAL 249 CO 0.01 -0.48 0.00 0.61 -0.31 0.00 0.00 175.10 174.93 4rla n GLY 250 N -0.94 0.39 0.72 2.32 0.00 -1.26 -5.03 105.19 101.39 4rla n GLY 250 Ca 0.10 -0.87 -0.05 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.69 -0.60 3.77 -0.02 0.00 -1.26 -4.96 105.19 100.43 4rla n GLY 251 Ca -0.03 -1.77 -0.36 0.00 0.00 0.00 0.00 46.02 43.87 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 3.81 0.62 0.99 1.43 -0.88 -4.27 118.68 120.38 4rla s LEU 252 Ca 0.14 2.26 -0.06 0.00 -1.03 0.00 0.00 54.13 55.44 4rla s LEU 252 Cb -0.00 -4.48 0.02 0.00 0.03 0.00 0.00 46.19 41.75 4rla s LEU 252 CO 0.09 -1.21 0.93 -0.94 0.23 0.00 0.00 176.35 175.46 4rla s SER 253 N -1.61 5.43 0.37 2.29 1.04 -1.26 -0.56 113.70 119.40 4rla s SER 253 Ca 0.71 0.68 0.06 0.00 0.48 0.00 0.00 55.95 57.88 4rla s SER 253 Cb -0.27 -1.59 0.75 0.00 0.10 0.00 0.00 66.02 65.01 4rla s SER 253 CO 0.31 -1.19 1.98 0.22 0.98 0.00 0.00 173.24 175.54 4rla h TYR 254 N -0.28 0.72 -0.21 5.02 3.20 -1.96 0.78 116.97 124.23 4rla h TYR 254 Ca -0.45 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.37 4rla h TYR 254 Cb 1.27 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 4rla h TYR 254 CO 0.45 0.41 -0.12 0.00 -1.64 0.00 0.00 178.16 177.25 4rla h ARG 255 N 0.74 0.45 -0.75 1.82 3.08 -1.99 -1.66 114.38 116.08 4rla h ARG 255 Ca 0.27 -0.21 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 4rla h ARG 255 Cb 0.15 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 4rla h ARG 255 CO -0.08 0.75 0.24 0.93 -1.07 0.00 0.00 179.97 180.74 4rla h GLU 256 N 0.15 1.16 -0.66 0.04 5.08 -1.78 0.11 114.58 118.69 4rla h GLU 256 Ca 0.04 -0.25 0.02 0.00 -1.00 0.00 0.00 59.36 58.17 4rla h GLU 256 Cb 0.62 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 4rla h GLU 256 CO 0.03 0.98 0.43 0.78 -1.00 0.00 0.00 179.01 180.23 4rla h GLY 257 N 1.11 0.93 1.79 -3.84 0.00 -0.77 -1.86 103.07 100.43 4rla h GLY 257 Ca 0.24 -0.33 -0.16 0.00 0.00 0.00 0.00 47.33 47.08 4rla h GLY 257 CO -0.01 0.31 -0.69 1.41 0.00 0.00 0.00 176.54 177.56 4rla h LEU 258 N 0.86 0.25 -0.62 3.11 3.38 -0.90 -3.06 115.31 118.33 4rla h LEU 258 Ca 0.25 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 4rla h LEU 258 Cb -0.05 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 4rla h LEU 258 CO -0.07 0.86 0.23 0.22 0.09 0.00 0.00 178.44 179.76 4rla h TYR 259 N 0.14 0.97 0.71 1.13 3.20 -0.49 -0.55 116.97 122.08 4rla h TYR 259 Ca -0.02 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 61.74 4rla h TYR 259 Cb 1.23 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 4rla h TYR 259 CO 0.02 0.78 -0.50 0.82 -1.64 0.00 0.00 178.16 177.64 4rla h ILE 260 N 0.88 0.01 -0.38 1.81 2.04 -1.34 -1.26 117.51 119.27 4rla h ILE 260 Ca 0.20 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.12 4rla h ILE 260 Cb 0.24 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 4rla h ILE 260 CO -0.01 0.00 0.26 0.71 0.00 0.00 0.00 178.15 179.11 4rla h THR 261 N -1.15 0.96 -0.14 -0.27 1.35 -1.49 -1.04 112.91 111.13 4rla h THR 261 Ca -0.09 -0.10 -0.11 0.00 -0.55 0.00 0.00 66.41 65.55 4rla h THR 261 Cb 0.94 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 4rla h THR 261 CO 0.06 0.05 -0.40 -0.33 -0.25 0.00 0.00 175.52 174.65 4rla h GLU 262 N 0.29 0.32 0.01 4.72 5.08 -0.74 -2.02 114.58 122.24 4rla h GLU 262 Ca 0.17 -0.15 -0.20 0.00 -1.00 0.00 0.00 59.36 58.17 4rla h GLU 262 Cb 0.30 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 4rla h GLU 262 CO -0.03 0.68 -0.93 0.93 -1.00 0.00 0.00 179.01 178.65 4rla h GLU 263 N 0.27 0.08 -0.46 2.33 4.39 -0.04 -2.88 114.58 118.27 4rla h GLU 263 Ca 0.02 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 4rla h GLU 263 Cb 0.83 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.50 4rla h GLU 263 CO 0.07 0.95 0.11 0.82 -1.16 0.00 0.00 179.01 179.80 4rla h ILE 264 N 0.04 1.24 -0.80 3.13 1.08 -0.98 -2.59 117.51 118.62 4rla h ILE 264 Ca -0.03 -0.82 -0.03 0.00 -0.39 0.00 0.00 64.86 63.59 4rla h ILE 264 Cb 1.61 0.90 -0.04 0.00 -3.07 0.00 0.00 36.82 36.22 4rla h ILE 264 CO 0.13 0.29 0.40 0.22 -0.69 0.00 0.00 178.15 178.50 4rla h TYR 265 N 0.61 1.12 -0.69 1.37 3.20 -1.37 -2.76 116.97 118.45 4rla h TYR 265 Ca 0.14 -0.04 0.12 0.00 3.14 0.00 0.00 58.73 62.09 4rla h TYR 265 Cb 0.32 -0.35 -0.09 0.00 1.54 0.00 0.00 36.73 38.16 4rla h TYR 265 CO 0.02 0.80 0.27 0.87 -1.64 0.00 0.00 178.16 178.48 4rla h LYS 266 N 1.13 0.42 0.00 1.82 6.56 -1.24 -0.96 116.57 124.30 4rla h LYS 266 Ca 0.28 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.83 4rla h LYS 266 Cb 0.09 -0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 31.65 4rla h LYS 266 CO -0.04 0.28 -0.07 1.79 -2.06 0.00 0.00 179.45 179.35 4rla h THR 267 N 0.43 1.01 -1.33 -0.16 1.35 -1.30 -3.46 112.91 109.45 4rla h THR 267 Ca 0.37 -0.23 -0.26 0.00 -0.55 0.00 0.00 66.41 65.73 4rla h THR 267 Cb 0.51 1.13 -0.05 0.00 -1.73 0.00 0.00 68.15 68.00 4rla h THR 267 CO -0.36 0.06 -0.29 0.61 -0.25 0.00 0.00 175.52 175.29 4rla n GLY 268 N -1.32 0.49 0.19 5.82 0.00 -0.36 -4.89 105.19 105.11 4rla n GLY 268 Ca -0.03 -0.37 0.02 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.70 2.27 -4.69 0.99 4.32 -1.26 -5.02 117.00 111.91 4rla n LEU 269 Ca -0.14 -2.00 -0.42 0.00 -0.02 0.00 0.00 56.01 53.42 4rla n LEU 269 Cb 0.54 -0.07 -0.03 0.00 -1.62 0.00 0.00 43.42 42.24 4rla n LEU 269 CO 0.19 0.57 1.23 -0.22 -1.22 0.00 0.00 177.39 177.94 4rla s LEU 270 N -1.00 4.35 0.00 2.23 2.96 -1.26 -1.16 118.68 124.80 4rla s LEU 270 Ca 0.07 2.36 0.00 0.00 -0.22 0.00 0.00 54.13 56.34 4rla s LEU 270 Cb 0.04 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.16 4rla s LEU 270 CO 0.05 -0.81 0.00 -0.24 -1.32 0.00 0.00 176.35 174.03 4rla n SER 271 N 5.28 4.40 -3.78 3.68 2.88 -0.32 -4.89 113.62 120.87 4rla n SER 271 Ca 0.14 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.56 4rla n SER 271 Cb 0.41 0.66 -0.11 0.00 -0.75 0.00 0.00 64.21 64.43 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 -2.25 -0.19 -0.02 0.46 0.00 -1.19 -2.91 107.32 101.21 4rla s GLY 272 Ca 0.00 0.70 0.01 0.00 0.00 0.00 0.00 44.72 45.42 4rla s GLY 272 CO 0.00 0.57 -0.01 -2.27 0.00 0.00 0.00 173.10 171.39 4rla s LEU 273 N -0.11 1.51 -0.13 0.66 1.98 -0.34 -0.42 118.68 121.82 4rla s LEU 273 Ca -0.02 -0.04 0.02 0.00 -2.89 0.00 0.00 54.13 51.20 4rla s LEU 273 Cb -0.03 -0.19 0.01 0.00 0.66 0.00 0.00 46.19 46.64 4rla s LEU 273 CO 0.01 -0.05 -0.21 -1.81 -1.89 0.00 0.00 176.35 172.41 4rla s ASP 274 N 0.58 2.97 -0.49 3.68 1.01 -0.28 -0.64 116.67 123.49 4rla s ASP 274 Ca -0.06 -0.57 -0.02 0.00 0.71 0.00 0.00 52.55 52.62 4rla s ASP 274 Cb -0.09 -1.37 0.13 0.00 1.01 0.00 0.00 42.92 42.60 4rla s ASP 274 CO -0.01 0.07 0.28 -0.63 0.21 0.00 0.00 175.17 175.09 4rla s ILE 275 N 0.85 3.33 0.44 0.77 -1.09 -0.75 -0.53 121.20 124.22 4rla s ILE 275 Ca -0.07 -2.50 0.07 0.00 -2.23 0.00 0.00 60.65 55.92 4rla s ILE 275 Cb -0.15 -3.25 -0.02 0.00 -1.58 0.00 0.00 42.46 37.46 4rla s ILE 275 CO -0.02 -0.76 0.31 -0.04 -1.23 0.00 0.00 174.94 173.20 4rla s MET 276 N 0.58 2.36 0.00 2.79 -1.94 -0.54 -1.37 119.30 121.18 4rla s MET 276 Ca 0.12 -1.75 0.00 0.00 -1.71 0.00 0.00 55.69 52.35 4rla s MET 276 Cb -0.22 -2.17 0.00 0.00 2.01 0.00 0.00 34.83 34.45 4rla s MET 276 CO -0.04 -0.25 0.00 0.39 -0.01 0.00 0.00 175.02 175.11 4rla n GLU 277 N -1.48 -1.61 -2.35 2.03 -0.58 -0.30 -2.41 120.64 113.95 4rla n GLU 277 Ca 0.01 0.40 -0.42 0.00 -0.42 0.00 0.00 57.16 56.73 4rla n GLU 277 Cb 0.63 -4.62 -0.02 0.00 -0.57 0.00 0.00 31.44 26.86 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 -1.19 3.81 -0.54 2.62 1.01 -1.26 -4.34 120.40 120.51 4rla s VAL 278 Ca 0.00 0.75 -0.06 0.00 0.00 0.00 0.00 61.98 62.66 4rla s VAL 278 Cb 0.00 -4.30 0.14 0.00 0.00 0.00 0.00 36.38 32.22 4rla s VAL 278 CO 0.00 -0.97 0.38 0.21 0.00 0.00 0.00 175.10 174.73 4rla s ASN 279 N 4.45 5.57 0.62 3.32 3.84 -0.62 -3.73 114.94 128.38 4rla s ASN 279 Ca 0.57 -2.30 0.31 0.00 0.21 0.00 0.00 52.86 51.65 4rla s ASN 279 Cb -0.12 -1.94 1.68 0.00 -0.55 0.00 0.00 41.25 40.32 4rla s ASN 279 CO 0.28 -0.55 2.03 -0.65 -2.79 0.00 0.00 177.10 175.42 4rla h PRO 280 N 7.87 0.00 0.00 0.43 0.11 -1.82 -2.04 132.00 136.55 4rla h PRO 280 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 4rla h PRO 280 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 4rla h PRO 280 CO 0.77 0.00 -0.47 0.25 -0.21 0.00 0.00 178.00 178.34 4rla n THR 281 N -3.44 0.30 1.49 -1.15 -2.24 -1.26 -3.73 114.28 104.25 4rla n THR 281 Ca 0.02 -0.20 0.14 0.00 -2.27 0.00 0.00 64.05 61.73 4rla n THR 281 Cb 0.40 -0.15 0.58 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.97 0.86 -4.69 3.22 4.77 -0.77 -4.86 117.00 113.56 4rla n LEU 282 Ca 0.04 -0.22 -0.42 0.00 -0.03 0.00 0.00 56.01 55.38 4rla n LEU 282 Cb 0.41 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 4rla n LEU 282 CO 0.35 0.15 1.05 -0.83 -1.33 0.00 0.00 177.39 176.78 4rla s GLY 283 N -2.25 1.99 0.42 -0.72 0.00 -1.24 -4.72 107.32 100.79 4rla s GLY 283 Ca 0.34 0.85 0.09 0.00 0.00 0.00 0.00 44.72 46.00 4rla s GLY 283 CO 0.42 2.37 2.02 1.70 0.00 0.00 0.00 173.10 179.61 4rla h LYS 284 N 7.52 0.35 -4.11 2.90 3.64 -1.93 -3.44 116.57 121.50 4rla h LYS 284 Ca -0.38 -0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 58.83 4rla h LYS 284 Cb 1.18 -0.07 -0.17 0.00 -0.41 0.00 0.00 32.23 32.77 4rla h LYS 284 CO 0.88 0.32 -0.65 0.95 -2.27 0.00 0.00 179.45 178.68 4rla s THR 285 N -5.14 0.18 0.30 1.00 -4.23 -1.26 -5.04 115.64 101.45 4rla s THR 285 Ca -0.07 -1.49 0.06 0.00 -1.18 0.00 0.00 61.69 59.01 4rla s THR 285 Cb 0.17 -1.15 0.30 0.00 1.34 0.00 0.00 72.50 73.15 4rla s THR 285 CO 0.72 -0.82 1.77 -0.65 -0.54 0.00 0.00 174.62 175.10 4rla h PRO 286 N 3.54 0.71 -0.91 3.99 0.11 -1.99 -0.48 132.00 136.97 4rla h PRO 286 Ca -0.33 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 4rla h PRO 286 Cb 1.16 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 4rla h PRO 286 CO 0.58 0.47 0.55 1.49 -0.21 0.00 0.00 178.00 180.88 4rla h GLU 287 N 0.73 1.24 -0.76 1.05 4.22 -1.97 -1.38 114.58 117.70 4rla h GLU 287 Ca 0.58 -0.11 -0.01 0.00 0.08 0.00 0.00 59.36 59.90 4rla h GLU 287 Cb 0.92 -0.26 -0.04 0.00 0.50 0.00 0.00 28.75 29.87 4rla h GLU 287 CO -0.39 0.87 0.45 0.93 -2.18 0.00 0.00 179.01 178.68 4rla h GLU 288 N 1.26 1.03 -0.07 1.92 5.08 -1.47 0.39 114.58 122.71 4rla h GLU 288 Ca 0.33 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.55 4rla h GLU 288 Cb -0.05 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 28.98 4rla h GLU 288 CO -0.06 0.73 -0.13 0.28 -1.00 0.00 0.00 179.01 178.83 4rla h VAL 289 N 1.05 1.40 -0.81 3.13 2.07 -1.29 -2.48 116.25 119.32 4rla h VAL 289 Ca 0.27 -1.40 0.11 0.00 0.82 0.00 0.00 66.70 66.50 4rla h VAL 289 Cb -0.03 2.15 -0.08 0.00 -1.52 0.00 0.00 31.29 31.81 4rla h VAL 289 CO -0.05 0.39 0.44 0.74 0.02 0.00 0.00 177.57 179.11 4rla h THR 290 N -0.25 0.85 -0.10 2.57 2.02 -0.90 0.19 112.91 117.28 4rla h THR 290 Ca 0.00 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 4rla h THR 290 Cb 0.70 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 4rla h THR 290 CO 0.03 0.13 0.06 -0.09 0.37 0.00 0.00 175.52 176.02 4rla h ARG 291 N 0.71 0.15 0.27 6.66 2.43 -0.92 -1.26 114.38 122.42 4rla h ARG 291 Ca 0.41 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 4rla h ARG 291 Cb 0.45 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 4rla h ARG 291 CO -0.28 0.18 -0.13 1.15 -1.51 0.00 0.00 179.97 179.38 4rla h THR 292 N 0.07 0.74 -0.23 0.20 2.02 -0.83 -1.29 112.91 113.59 4rla h THR 292 Ca 0.04 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 4rla h THR 292 Cb 0.08 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 4rla h THR 292 CO -0.01 0.01 0.14 0.58 0.37 0.00 0.00 175.52 176.61 4rla h VAL 293 N -0.39 1.08 -0.71 3.16 2.07 -1.01 -2.58 116.25 117.88 4rla h VAL 293 Ca -0.04 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.29 4rla h VAL 293 Cb 0.30 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 4rla h VAL 293 CO 0.06 0.08 0.45 0.78 0.02 0.00 0.00 177.57 178.96 4rla h ASN 294 N 0.28 0.83 -0.04 0.57 2.35 -1.15 -1.75 115.58 116.67 4rla h ASN 294 Ca 0.08 -0.04 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 4rla h ASN 294 Cb 0.01 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 4rla h ASN 294 CO -0.02 0.62 -0.09 0.00 -1.65 0.00 0.00 177.43 176.29 4rla h THR 295 N 0.96 1.18 -0.24 2.81 1.03 -1.13 -1.38 112.91 116.14 4rla h THR 295 Ca 0.26 -0.76 -0.04 0.00 -0.01 0.00 0.00 66.41 65.86 4rla h THR 295 Cb -0.08 1.14 -0.01 0.00 -1.07 0.00 0.00 68.15 68.13 4rla h THR 295 CO -0.05 0.24 0.01 0.00 -0.01 0.00 0.00 175.52 175.71 4rla h ALA 296 N 1.62 0.32 -0.74 0.00 0.00 -0.99 -1.61 119.26 117.85 4rla h ALA 296 Ca 0.06 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.82 4rla h ALA 296 Cb 0.35 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 4rla h ALA 296 CO 0.02 0.03 0.43 0.28 0.00 0.00 0.00 179.25 180.02 4rla h VAL 297 N 0.19 0.99 -0.73 0.00 2.07 -0.85 -1.43 116.25 116.50 4rla h VAL 297 Ca 0.07 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 4rla h VAL 297 Cb 0.39 0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 4rla h VAL 297 CO 0.01 0.14 0.45 0.00 0.02 0.00 0.00 177.57 178.20 4rla h ALA 298 N 1.37 0.92 -0.55 1.67 0.00 -0.96 -1.03 119.26 120.68 4rla h ALA 298 Ca 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 4rla h ALA 298 Cb 0.18 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 4rla h ALA 298 CO -0.18 0.38 0.31 -0.07 0.00 0.00 0.00 179.25 179.69 4rla h LEU 299 N 0.99 0.69 -0.21 0.00 3.38 -0.34 -0.87 115.31 118.94 4rla h LEU 299 Ca 0.26 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 4rla h LEU 299 Cb -0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 4rla h LEU 299 CO -0.05 0.57 0.05 0.74 0.09 0.00 0.00 178.44 179.83 4rla h THR 300 N 0.75 1.21 -0.68 0.22 2.02 -0.81 -2.29 112.91 113.33 4rla h THR 300 Ca 0.20 -0.69 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 4rla h THR 300 Cb 0.03 1.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 4rla h THR 300 CO -0.03 0.22 0.42 -0.07 0.37 0.00 0.00 175.52 176.43 4rla h LEU 301 N 0.16 0.80 -0.76 2.58 3.38 -1.02 -1.52 115.31 118.93 4rla h LEU 301 Ca 0.07 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 4rla h LEU 301 Cb 0.29 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 4rla h LEU 301 CO 0.00 0.60 0.44 -1.28 0.09 0.00 0.00 178.44 178.29 4rla h SER 302 N 0.93 0.92 -0.03 -0.43 0.87 -0.96 -1.83 113.55 113.01 4rla h SER 302 Ca 0.25 -0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.74 4rla h SER 302 Cb -0.06 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.66 4rla h SER 302 CO -0.05 0.73 0.02 0.00 -0.53 0.00 0.00 176.83 177.01 4rla n PHE 304 N -4.53 2.95 0.00 0.00 3.72 -0.74 -4.42 117.46 114.44 4rla n PHE 304 Ca -0.02 -2.64 0.00 0.00 -0.05 0.00 0.00 57.45 54.74 4rla n PHE 304 Cb 0.12 -1.01 0.00 0.00 -0.94 0.00 0.00 39.48 37.65 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 2.44 3.65 1.37 0.00 -1.14 -4.66 105.19 105.98 4rla n GLY 305 Ca 0.55 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.38 3.60 0.14 2.61 2.01 -0.91 -4.97 115.64 115.74 4rla s THR 306 Ca 0.00 0.70 0.07 0.00 0.31 0.00 0.00 61.69 62.77 4rla s THR 306 Cb 0.00 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 4rla s THR 306 CO 0.00 -0.14 -0.02 -0.54 -0.69 0.00 0.00 174.62 173.24 4rla s LYS 307 N 4.35 2.39 0.49 4.92 1.02 -1.26 -4.36 119.74 127.29 4rla s LYS 307 Ca 0.74 -1.02 0.28 0.00 0.02 0.00 0.00 55.97 55.99 4rla s LYS 307 Cb -0.30 -2.40 0.91 0.00 -0.52 0.00 0.00 37.83 35.52 4rla s LYS 307 CO 0.30 0.49 1.82 0.00 -0.92 0.00 0.00 175.35 177.03 4rla h ARG 308 N 3.05 0.00 0.00 1.68 3.08 -1.99 -2.75 114.38 117.46 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 1.19 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 4rla h ARG 308 CO 0.57 0.05 0.00 -0.85 -1.07 0.00 0.00 179.97 178.67 4rla n GLU 309 N -3.13 0.04 0.00 0.04 0.28 -1.26 -5.01 120.64 111.60 4rla n GLU 309 Ca 0.02 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.09 4rla n GLU 309 Cb 0.42 -1.55 0.00 0.00 1.43 0.00 0.00 31.44 31.73 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 1.25 2.69 3.57 -1.84 0.00 -1.04 -5.13 105.19 104.69 4rla n GLY 310 Ca 0.06 -1.92 -0.28 0.00 0.00 0.00 0.00 46.02 43.88 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 3.12 0.00 1.61 0.01 -1.26 -4.67 114.94 113.74 4rla s ASN 311 Ca 0.00 -1.72 0.00 0.00 -0.71 0.00 0.00 52.86 50.43 4rla s ASN 311 Cb 0.00 0.60 0.00 0.00 0.41 0.00 0.00 41.25 42.26 4rla s ASN 311 CO 0.00 -0.97 0.00 0.00 -1.51 0.00 0.00 177.10 174.62 4rla n HIS 312 N -1.01 0.00 -2.19 2.20 1.44 -1.26 -5.14 115.22 109.25 4rla n HIS 312 Ca -0.09 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.23 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 -1.44 4.18 0.71 -1.40 -0.14 -1.26 -5.03 119.74 115.36 4rla s LYS 313 Ca 0.00 2.04 -0.11 0.00 -1.36 0.00 0.00 55.97 56.53 4rla s LYS 313 Cb 0.00 -2.87 0.02 0.00 -1.68 0.00 0.00 37.83 33.29 4rla s LYS 313 CO 0.00 -0.27 1.08 -1.25 -0.76 0.00 0.00 175.35 174.15 4rla s PRO 314 N -2.03 2.84 0.00 -1.68 0.04 -1.26 -3.82 135.00 129.09 4rla s PRO 314 Ca 0.53 0.58 0.00 0.00 0.04 0.00 0.00 61.00 62.15 4rla s PRO 314 Cb -0.36 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.17 4rla s PRO 314 CO 0.46 -1.07 0.00 0.39 0.04 0.00 0.00 177.00 176.82 4rla n GLU 315 N -3.05 0.00 -3.38 4.56 1.02 -1.26 -4.94 120.64 113.59 4rla n GLU 315 Ca 0.07 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.83 4rla n GLU 315 Cb 0.56 -3.22 -0.06 0.00 -0.02 0.00 0.00 31.44 28.70 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 -1.69 5.20 -0.24 2.62 2.01 -1.25 -5.06 115.64 117.23 4rla s THR 316 Ca 0.00 0.86 -0.10 0.00 0.31 0.00 0.00 61.69 62.75 4rla s THR 316 Cb 0.00 -3.77 -0.05 0.00 0.01 0.00 0.00 72.50 68.69 4rla s THR 316 CO 0.00 0.36 0.16 -0.62 -0.69 0.00 0.00 174.62 173.82 4rla s ASP 317 N 0.46 6.05 0.06 3.53 -1.08 -1.26 -4.96 116.67 119.47 4rla s ASP 317 Ca 0.24 0.09 0.21 0.00 -0.52 0.00 0.00 52.55 52.56 4rla s ASP 317 Cb -0.15 -2.09 -0.16 0.00 -1.46 0.00 0.00 42.92 39.06 4rla s ASP 317 CO 0.09 0.06 0.73 -1.22 0.52 0.00 0.00 175.17 175.34 4rla n TYR 318 N 4.35 0.57 1.93 -5.34 4.02 -1.26 -5.23 117.16 116.20 4rla n TYR 318 Ca -0.15 0.17 0.16 0.00 -0.01 0.00 0.00 57.90 58.07 4rla n TYR 318 Cb 0.52 -0.84 0.89 0.00 -0.02 0.00 0.00 39.34 39.89 4rla n TYR 318 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13