#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1owo n ALA 3 N 0.00 3.55 -2.20 0.00 0.00 -1.26 -4.86 120.51 115.74 1owo n ALA 3 Ca 0.00 -4.58 -0.31 0.00 0.00 0.00 0.00 53.44 48.54 1owo n ALA 3 Cb 0.00 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.37 1owo n ALA 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1owo s PRO 4 N -1.66 3.87 -0.10 0.00 0.04 -1.26 -4.68 135.00 131.21 1owo s PRO 4 Ca 0.28 0.52 0.01 0.00 0.04 0.00 0.00 61.00 61.84 1owo s PRO 4 Cb -0.01 -2.44 -0.02 0.00 0.04 0.00 0.00 34.50 32.07 1owo s PRO 4 CO -0.14 0.09 -0.11 0.42 0.04 0.00 0.00 177.00 177.30 1owo s ILE 5 N -2.13 3.29 -0.17 0.56 1.01 -0.55 -1.10 121.20 122.11 1owo s ILE 5 Ca 0.52 -0.60 -0.08 0.00 0.00 0.00 0.00 60.65 60.48 1owo s ILE 5 Cb -0.10 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.96 1owo s ILE 5 CO 0.24 0.55 0.11 -0.76 0.00 0.00 0.00 174.94 175.08 1owo s LEU 6 N -0.17 4.12 -0.22 2.97 1.43 -0.34 -1.43 118.68 125.05 1owo s LEU 6 Ca 0.01 0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 1owo s LEU 6 Cb -0.13 -2.04 -0.00 0.00 0.03 0.00 0.00 46.19 44.04 1owo s LEU 6 CO 0.03 0.24 -0.05 0.12 0.23 0.00 0.00 176.35 176.92 1owo s PHE 7 N -0.01 2.97 -0.40 0.29 5.36 -0.42 0.34 117.98 126.10 1owo s PHE 7 Ca 0.09 -1.02 -0.19 0.00 -0.96 0.00 0.00 56.93 54.84 1owo s PHE 7 Cb -0.12 -2.10 0.01 0.00 -0.34 0.00 0.00 43.02 40.48 1owo s PHE 7 CO 0.00 -0.58 0.55 -0.46 -1.46 0.00 0.00 175.22 173.27 1owo s TRP 8 N 1.46 3.13 0.14 10.12 -0.00 0.14 -0.96 118.94 132.98 1owo s TRP 8 Ca 0.05 -0.05 -0.20 0.00 -0.00 0.00 0.00 56.10 55.91 1owo s TRP 8 Cb -0.14 -3.08 -0.07 0.00 -0.00 0.00 0.00 33.47 30.17 1owo s TRP 8 CO -0.04 -0.71 0.65 -1.01 -0.00 0.00 0.00 176.95 175.85 1owo s HIS 9 N 2.50 3.75 0.16 5.86 3.76 -0.03 -4.45 115.29 126.83 1owo s HIS 9 Ca 0.19 1.34 0.00 0.00 -0.15 0.00 0.00 55.06 56.44 1owo s HIS 9 Cb -0.15 -2.56 0.00 0.00 1.11 0.00 0.00 32.58 30.97 1owo s HIS 9 CO 0.16 0.48 0.00 0.54 -0.85 0.00 0.00 174.74 175.07 1owo n ARG 10 N 1.28 0.00 -1.48 1.40 3.00 -1.26 -4.51 116.66 115.09 1owo n ARG 10 Ca -0.06 0.00 -0.03 0.00 -0.01 0.00 0.00 57.85 57.75 1owo n ARG 10 Cb 0.51 -0.01 0.10 0.00 0.00 0.00 0.00 32.46 33.05 1owo n ARG 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1owo n ARG 11 N -3.03 1.76 -2.91 5.56 1.74 -1.26 -4.75 116.66 113.77 1owo n ARG 11 Ca 0.00 -3.26 -0.14 0.00 -0.77 0.00 0.00 57.85 53.68 1owo n ARG 11 Cb 0.00 -1.42 -0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1owo n ARG 11 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1owo n ASP 12 N -0.58 1.37 -3.63 0.55 5.75 -1.13 -2.09 116.55 116.78 1owo n ASP 12 Ca 0.21 -2.92 -0.41 0.00 -0.01 0.00 0.00 54.79 51.66 1owo n ASP 12 Cb 0.88 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 40.37 1owo n ASP 12 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1owo n LEU 13 N 0.08 5.62 -3.54 -2.12 4.77 -0.39 -4.80 117.00 116.63 1owo n LEU 13 Ca 0.18 -3.53 -0.10 0.00 -0.03 0.00 0.00 56.01 52.53 1owo n LEU 13 Cb 0.73 -1.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.41 1owo n LEU 13 CO 0.25 0.47 0.46 0.00 -1.33 0.00 0.00 177.39 177.24 1owo s ARG 14 N 3.96 1.34 -0.08 3.23 1.70 -1.25 -4.34 118.95 123.52 1owo s ARG 14 Ca 0.52 -0.57 0.18 0.00 -0.47 0.00 0.00 55.73 55.39 1owo s ARG 14 Cb 0.14 0.56 -0.27 0.00 -0.57 0.00 0.00 34.95 34.82 1owo s ARG 14 CO 0.01 -0.59 0.29 -0.11 -1.08 0.00 0.00 175.30 173.82 1owo n LEU 15 N -0.39 0.00 -4.89 -1.89 7.94 -1.26 -4.92 117.00 111.59 1owo n LEU 15 Ca -0.13 0.00 -0.29 0.00 -1.11 0.00 0.00 56.01 54.48 1owo n LEU 15 Cb 0.63 0.15 -0.01 0.00 0.53 0.00 0.00 43.42 44.73 1owo n LEU 15 CO 0.13 0.15 0.48 -0.94 -1.11 0.00 0.00 177.39 176.10 1owo s SER 16 N -4.54 6.34 -0.66 1.96 1.04 -1.26 -4.26 113.70 112.32 1owo s SER 16 Ca -0.08 1.06 -0.17 0.00 0.48 0.00 0.00 55.95 57.24 1owo s SER 16 Cb 0.10 -2.30 0.02 0.00 0.10 0.00 0.00 66.02 63.94 1owo s SER 16 CO 0.77 -0.56 0.38 -0.67 0.98 0.00 0.00 173.24 174.14 1owo n ASP 17 N -2.02 -2.45 -3.95 7.02 2.03 -1.22 -4.76 116.55 111.19 1owo n ASP 17 Ca 0.02 -0.73 -0.31 0.00 0.52 0.00 0.00 54.79 54.29 1owo n ASP 17 Cb 0.55 -0.92 -0.15 0.00 -0.72 0.00 0.00 41.12 39.88 1owo n ASP 17 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1owo s ASN 18 N -3.83 4.18 0.12 1.67 3.84 -1.26 -4.63 114.94 115.04 1owo s ASN 18 Ca 0.23 -1.50 -0.33 0.00 0.21 0.00 0.00 52.86 51.47 1owo s ASN 18 Cb -0.13 -1.30 -0.11 0.00 -0.55 0.00 0.00 41.25 39.16 1owo s ASN 18 CO 0.56 -0.28 1.56 0.40 -2.79 0.00 0.00 177.10 176.54 1owo h ILE 19 N 6.65 0.02 -0.72 -5.21 1.08 -1.89 0.12 117.51 117.56 1owo h ILE 19 Ca -0.14 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.29 1owo h ILE 19 Cb 1.05 0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.78 1owo h ILE 19 CO 0.45 0.00 0.30 1.23 -0.69 0.00 0.00 178.15 179.44 1owo h GLY 20 N -0.52 1.12 1.06 5.37 0.00 -1.87 -1.92 103.07 106.31 1owo h GLY 20 Ca 0.05 -0.58 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 1owo h GLY 20 CO -0.49 0.55 -0.12 -2.00 0.00 0.00 0.00 176.54 174.48 1owo h LEU 21 N 1.03 0.95 -0.70 3.11 5.85 -1.88 -1.15 115.31 122.52 1owo h LEU 21 Ca 0.24 -0.36 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 1owo h LEU 21 Cb 0.17 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1owo h LEU 21 CO -0.02 1.09 -0.09 0.00 -0.34 0.00 0.00 178.44 179.08 1owo h ALA 22 N 0.89 0.89 -0.55 1.25 0.00 -0.82 -1.12 119.26 119.80 1owo h ALA 22 Ca 0.12 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1owo h ALA 22 Cb 0.68 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1owo h ALA 22 CO 0.05 0.64 -0.01 0.00 0.00 0.00 0.00 179.25 179.92 1owo h ALA 23 N 1.07 0.93 -0.63 0.00 0.00 -1.21 -2.55 119.26 116.88 1owo h ALA 23 Ca 0.14 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1owo h ALA 23 Cb 0.61 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1owo h ALA 23 CO 0.04 0.64 0.15 0.00 0.00 0.00 0.00 179.25 180.08 1owo h ALA 24 N 1.10 0.83 0.00 0.00 0.00 -0.84 -2.73 119.26 117.62 1owo h ALA 24 Ca 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1owo h ALA 24 Cb 0.53 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1owo h ALA 24 CO 0.03 0.54 -0.15 -0.09 0.00 0.00 0.00 179.25 179.58 1owo h ARG 25 N 0.92 0.00 0.00 0.00 9.65 -0.98 -1.50 114.38 122.48 1owo h ARG 25 Ca 0.20 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.08 1owo h ARG 25 Cb 0.36 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.94 1owo h ARG 25 CO 0.00 0.15 0.00 0.00 2.80 0.00 0.00 179.97 182.92 1owo n ALA 26 N -2.24 2.21 -0.04 2.80 0.00 -0.98 -3.30 120.51 118.96 1owo n ALA 26 Ca -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.37 1owo n ALA 26 Cb 0.31 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 18.19 1owo n ALA 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1owo n GLN 27 N -1.58 0.83 -3.61 0.00 1.13 -0.62 -5.04 117.38 108.50 1owo n GLN 27 Ca 0.06 -0.10 -0.10 0.00 -1.94 0.00 0.00 57.00 54.92 1owo n GLN 27 Cb 0.32 -1.43 -0.06 0.00 0.11 0.00 0.00 30.24 29.18 1owo n GLN 27 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1owo s SER 28 N -4.46 -0.42 0.27 1.08 0.15 -0.87 -5.02 113.70 104.43 1owo s SER 28 Ca -0.07 0.66 0.20 0.00 0.70 0.00 0.00 55.95 57.45 1owo s SER 28 Cb 0.09 0.62 0.10 0.00 -1.71 0.00 0.00 66.02 65.12 1owo s SER 28 CO 0.72 -0.25 1.26 0.00 1.20 0.00 0.00 173.24 176.18 1owo h ALA 29 N 3.45 0.71 -0.33 5.45 0.00 -1.87 -3.38 119.26 123.29 1owo h ALA 29 Ca -0.24 -0.22 -0.72 0.00 0.00 0.00 0.00 54.91 53.73 1owo h ALA 29 Cb 1.17 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 1owo h ALA 29 CO 0.20 0.26 2.84 0.94 0.00 0.00 0.00 179.25 183.49 1owo n GLN 30 N -2.94 3.34 -3.49 0.00 7.27 -1.26 -0.60 117.38 119.69 1owo n GLN 30 Ca 0.00 -2.90 -0.41 0.00 0.07 0.00 0.00 57.00 53.76 1owo n GLN 30 Cb 0.62 -3.06 -0.10 0.00 2.41 0.00 0.00 30.24 30.11 1owo n GLN 30 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 1owo s LEU 31 N 0.86 4.71 -0.21 1.69 2.96 -1.26 -1.48 118.68 125.95 1owo s LEU 31 Ca 0.48 -0.56 -0.04 0.00 -0.22 0.00 0.00 54.13 53.79 1owo s LEU 31 Cb 0.14 -2.16 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 1owo s LEU 31 CO -0.06 -0.32 -0.05 -0.63 -1.32 0.00 0.00 176.35 173.98 1owo s ILE 32 N 1.74 3.37 0.66 6.68 -1.09 -0.51 -4.65 121.20 127.40 1owo s ILE 32 Ca 0.06 -0.50 -0.11 0.00 -2.23 0.00 0.00 60.65 57.87 1owo s ILE 32 Cb -0.18 -2.52 -0.01 0.00 -1.58 0.00 0.00 42.46 38.17 1owo s ILE 32 CO 0.11 0.43 1.06 -0.83 -1.23 0.00 0.00 174.94 174.48 1owo s GLY 33 N 1.33 1.64 -0.05 6.18 0.00 -0.91 -1.30 107.32 114.22 1owo s GLY 33 Ca 0.04 -0.24 -0.24 0.00 0.00 0.00 0.00 44.72 44.28 1owo s GLY 33 CO -0.02 0.08 0.53 0.48 0.00 0.00 0.00 173.10 174.17 1owo s LEU 34 N -5.26 -0.07 -0.02 0.66 0.05 -0.13 -0.95 118.68 112.96 1owo s LEU 34 Ca 0.57 0.51 0.00 0.00 0.05 0.00 0.00 54.13 55.26 1owo s LEU 34 Cb -0.11 2.03 0.02 0.00 -2.05 0.00 0.00 46.19 46.07 1owo s LEU 34 CO 0.52 -0.52 -0.00 0.12 -0.55 0.00 0.00 176.35 175.92 1owo s PHE 35 N -1.14 0.23 -0.23 3.48 5.36 -0.37 -0.85 117.98 124.46 1owo s PHE 35 Ca -0.11 0.00 -0.04 0.00 -0.96 0.00 0.00 56.93 55.83 1owo s PHE 35 Cb -0.02 -0.28 -0.00 0.00 -0.34 0.00 0.00 43.02 42.37 1owo s PHE 35 CO 0.07 -0.08 -0.05 0.00 -1.46 0.00 0.00 175.22 173.71 1owo s LEU 37 N 1.46 3.27 -0.42 0.00 1.43 0.26 -4.94 118.68 119.73 1owo s LEU 37 Ca 0.05 -0.56 -0.24 0.00 -1.03 0.00 0.00 54.13 52.35 1owo s LEU 37 Cb -0.15 -2.56 0.02 0.00 0.03 0.00 0.00 46.19 43.54 1owo s LEU 37 CO -0.04 -1.97 0.86 -0.62 0.23 0.00 0.00 176.35 174.82 1owo s ASP 38 N 5.38 6.52 0.46 2.29 -1.08 -1.26 -1.73 116.67 127.25 1owo s ASP 38 Ca 0.48 0.19 0.24 0.00 -0.52 0.00 0.00 52.55 52.94 1owo s ASP 38 Cb -0.07 -2.43 1.25 0.00 -1.46 0.00 0.00 42.92 40.22 1owo s ASP 38 CO 0.08 -0.92 1.86 -0.65 0.52 0.00 0.00 175.17 176.06 1owo h PRO 39 N 8.83 0.23 0.00 4.34 0.11 -1.93 0.22 132.00 143.80 1owo h PRO 39 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1owo h PRO 39 Cb 1.08 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1owo h PRO 39 CO 0.98 0.15 0.00 1.96 -0.21 0.00 0.00 178.00 180.88 1owo h GLN 40 N 0.24 0.00 0.00 1.05 4.20 -1.92 -0.56 115.11 118.12 1owo h GLN 40 Ca 0.47 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.90 1owo h GLN 40 Cb 1.45 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.19 1owo h GLN 40 CO -0.12 0.00 -1.77 -0.89 -0.67 0.00 0.00 178.83 175.37 1owo n ILE 41 N -2.94 1.52 -0.27 2.54 5.41 0.64 -4.12 119.36 122.14 1owo n ILE 41 Ca 0.00 -0.15 -0.06 0.00 1.00 0.00 0.00 62.75 63.54 1owo n ILE 41 Cb 0.25 -2.05 0.05 0.00 -0.71 0.00 0.00 39.64 37.19 1owo n ILE 41 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1owo h LEU 42 N -1.00 0.97 -0.48 1.39 3.38 -1.14 -3.02 115.31 115.41 1owo h LEU 42 Ca -0.43 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1owo h LEU 42 Cb 1.33 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1owo h LEU 42 CO -0.26 0.85 -0.04 0.00 0.09 0.00 0.00 178.44 179.07 1owo n GLN 43 N -4.39 1.18 -1.77 1.13 1.13 -0.22 -4.87 117.38 109.57 1owo n GLN 43 Ca 0.06 -0.48 -0.40 0.00 -1.94 0.00 0.00 57.00 54.25 1owo n GLN 43 Cb 0.15 -1.49 0.02 0.00 0.11 0.00 0.00 30.24 29.03 1owo n GLN 43 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1owo s SER 44 N -2.15 5.71 0.28 1.08 0.15 -1.14 -4.87 113.70 112.76 1owo s SER 44 Ca 0.38 2.92 0.24 0.00 0.70 0.00 0.00 55.95 60.19 1owo s SER 44 Cb 0.21 -2.65 1.04 0.00 -1.71 0.00 0.00 66.02 62.90 1owo s SER 44 CO 0.39 -1.29 1.72 0.00 1.20 0.00 0.00 173.24 175.26 1owo n ALA 45 N -0.39 1.57 -0.29 5.45 0.00 -1.26 -2.30 120.51 123.29 1owo n ALA 45 Ca 0.06 0.11 0.07 0.00 0.00 0.00 0.00 53.44 53.68 1owo n ALA 45 Cb 0.42 -1.39 0.30 0.00 0.00 0.00 0.00 19.45 18.78 1owo n ALA 45 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1owo n ASP 46 N -2.29 4.23 -4.72 0.00 8.00 -1.26 -4.85 116.55 115.66 1owo n ASP 46 Ca 0.01 -2.50 -0.39 0.00 0.71 0.00 0.00 54.79 52.63 1owo n ASP 46 Cb 0.20 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 40.68 1owo n ASP 46 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1owo s MET 47 N -2.02 4.36 -0.10 -1.24 -2.45 -0.98 -4.11 119.30 112.77 1owo s MET 47 Ca 0.42 0.59 -0.17 0.00 -1.25 0.00 0.00 55.69 55.28 1owo s MET 47 Cb 0.29 -3.45 -0.05 0.00 1.25 0.00 0.00 34.83 32.87 1owo s MET 47 CO 0.17 0.10 0.45 0.00 1.05 0.00 0.00 175.02 176.79 1owo s ALA 48 N 0.76 3.52 0.37 4.11 0.00 -1.23 -4.79 121.76 124.49 1owo s ALA 48 Ca 0.30 -0.21 0.08 0.00 0.00 0.00 0.00 51.96 52.12 1owo s ALA 48 Cb -0.16 -2.58 0.79 0.00 0.00 0.00 0.00 23.12 21.17 1owo s ALA 48 CO 0.13 0.09 1.93 -1.35 0.00 0.00 0.00 175.76 176.56 1owo h PRO 49 N 6.34 0.69 -0.25 0.00 0.11 -1.90 -0.78 132.00 136.21 1owo h PRO 49 Ca -0.43 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 1owo h PRO 49 Cb 1.18 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1owo h PRO 49 CO 0.73 0.45 -0.14 0.00 -0.21 0.00 0.00 178.00 178.83 1owo h ALA 50 N 1.61 1.29 -0.20 -0.75 0.00 -1.89 -1.66 119.26 117.66 1owo h ALA 50 Ca 0.36 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1owo h ALA 50 Cb 0.45 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1owo h ALA 50 CO -0.13 0.47 -0.65 -0.09 0.00 0.00 0.00 179.25 178.85 1owo h ARG 51 N 0.39 0.73 -0.36 0.00 2.43 -1.39 -1.82 114.38 114.37 1owo h ARG 51 Ca 0.07 -0.52 -0.11 0.00 -0.81 0.00 0.00 59.98 58.61 1owo h ARG 51 Cb 0.49 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1owo h ARG 51 CO 0.03 1.15 -0.24 0.28 -1.51 0.00 0.00 179.97 179.68 1owo h VAL 52 N 0.53 1.27 -0.30 0.20 2.07 -1.08 0.63 116.25 119.58 1owo h VAL 52 Ca -0.02 -1.34 -0.03 0.00 0.82 0.00 0.00 66.70 66.13 1owo h VAL 52 Cb 1.25 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 1owo h VAL 52 CO 0.13 0.44 0.05 0.00 0.02 0.00 0.00 177.57 178.22 1owo h ALA 53 N 1.12 0.40 -0.01 1.67 0.00 -1.22 0.89 119.26 122.11 1owo h ALA 53 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1owo h ALA 53 Cb 0.73 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1owo h ALA 53 CO 0.06 0.09 0.00 -0.92 0.00 0.00 0.00 179.25 178.48 1owo h TYR 54 N 0.33 0.02 -0.02 0.00 3.20 -1.20 -1.71 116.97 117.59 1owo h TYR 54 Ca 0.09 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.99 1owo h TYR 54 Cb 0.33 -0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.54 1owo h TYR 54 CO 0.02 0.22 -0.41 1.25 -1.64 0.00 0.00 178.16 177.60 1owo h LEU 55 N -0.19 -1.25 -1.12 2.82 5.85 -0.77 0.02 115.31 120.67 1owo h LEU 55 Ca 0.00 0.16 0.14 0.00 0.84 0.00 0.00 57.88 59.02 1owo h LEU 55 Cb 0.21 0.50 -0.08 0.00 0.37 0.00 0.00 40.66 41.65 1owo h LEU 55 CO -0.00 -0.45 0.61 -0.61 -0.34 0.00 0.00 178.44 177.65 1owo h GLN 56 N -0.55 0.83 -0.40 1.25 -0.00 -0.78 -0.85 115.11 114.60 1owo h GLN 56 Ca 0.05 -0.05 -0.13 0.00 -0.00 0.00 0.00 58.65 58.53 1owo h GLN 56 Cb 0.64 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.92 1owo h GLN 56 CO -0.33 0.55 -0.25 0.78 0.00 0.00 0.00 178.83 179.58 1owo h GLY 57 N 0.86 0.91 1.33 2.39 0.00 -0.32 -2.12 103.07 106.12 1owo h GLY 57 Ca 0.49 -0.81 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 1owo h GLY 57 CO -0.25 0.74 -0.06 0.00 0.00 0.00 0.00 176.54 176.96 1owo h LEU 59 N 0.73 1.00 -0.60 0.00 3.38 -1.06 -1.23 115.31 117.54 1owo h LEU 59 Ca 0.13 -0.31 0.05 0.00 0.09 0.00 0.00 57.88 57.84 1owo h LEU 59 Cb 0.53 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1owo h LEU 59 CO 0.03 1.10 0.32 1.56 0.09 0.00 0.00 178.44 181.54 1owo h GLN 60 N 0.90 0.59 -0.40 1.13 4.20 -1.25 -0.03 115.11 120.24 1owo h GLN 60 Ca 0.15 -0.04 -0.15 0.00 0.06 0.00 0.00 58.65 58.67 1owo h GLN 60 Cb 0.63 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1owo h GLN 60 CO 0.04 0.39 -0.33 1.49 -0.67 0.00 0.00 178.83 179.75 1owo h GLU 61 N 0.61 0.93 -0.30 1.46 4.81 -1.39 -2.98 114.58 117.71 1owo h GLU 61 Ca 0.27 -0.47 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 1owo h GLU 61 Cb 0.17 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 1owo h GLU 61 CO -0.17 1.12 0.15 1.25 -0.73 0.00 0.00 179.01 180.63 1owo h LEU 62 N 0.76 0.37 -0.52 1.64 5.85 -0.50 -0.69 115.31 122.21 1owo h LEU 62 Ca 0.07 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1owo h LEU 62 Cb 0.92 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1owo h LEU 62 CO 0.09 0.32 0.28 1.56 -0.34 0.00 0.00 178.44 180.34 1owo h GLN 63 N 0.42 0.73 -0.31 1.25 4.20 -0.88 -2.30 115.11 118.22 1owo h GLN 63 Ca 0.11 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1owo h GLN 63 Cb 0.04 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1owo h GLN 63 CO -0.02 0.58 0.08 1.96 -0.67 0.00 0.00 178.83 180.76 1owo h GLN 64 N 0.70 0.50 -0.76 1.46 4.20 -1.19 -2.28 115.11 117.73 1owo h GLN 64 Ca 0.18 -0.12 0.06 0.00 0.06 0.00 0.00 58.65 58.83 1owo h GLN 64 Cb 0.07 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 1owo h GLN 64 CO -0.03 0.57 0.45 0.00 -0.67 0.00 0.00 178.83 179.14 1owo h ARG 65 N 0.34 0.79 -0.48 1.46 2.47 -1.02 0.17 114.38 118.12 1owo h ARG 65 Ca 0.10 -0.05 -0.11 0.00 -1.26 0.00 0.00 59.98 58.66 1owo h ARG 65 Cb 0.29 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.42 1owo h ARG 65 CO 0.00 0.52 -0.15 1.88 0.56 0.00 0.00 179.97 182.78 1owo h TYR 66 N 0.81 1.02 -0.19 3.04 0.05 -1.37 0.22 116.97 120.55 1owo h TYR 66 Ca 0.34 -0.22 -0.00 0.00 0.05 0.00 0.00 58.73 58.90 1owo h TYR 66 Cb 0.19 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 1owo h TYR 66 CO -0.06 0.99 0.11 0.37 -1.05 0.00 0.00 178.16 178.53 1owo h GLN 67 N 0.81 0.26 -0.42 4.88 -0.00 -0.66 -1.42 115.11 118.55 1owo h GLN 67 Ca 0.12 -0.02 -0.07 0.00 -0.00 0.00 0.00 58.65 58.68 1owo h GLN 67 Cb 0.69 -0.05 -0.02 0.00 0.00 0.00 0.00 27.48 28.10 1owo h GLN 67 CO 0.05 0.22 -0.02 1.96 0.00 0.00 0.00 178.83 181.05 1owo h GLN 68 N 0.23 0.69 0.00 1.69 4.20 -0.55 -2.89 115.11 118.48 1owo h GLN 68 Ca 0.07 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.53 1owo h GLN 68 Cb 0.03 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 1owo h GLN 68 CO -0.01 0.71 -0.36 0.00 -0.67 0.00 0.00 178.83 178.50 1owo h ALA 69 N 1.34 1.34 0.00 3.87 0.00 -0.55 -3.47 119.26 121.79 1owo h ALA 69 Ca 0.13 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1owo h ALA 69 Cb 0.43 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1owo h ALA 69 CO 0.02 0.45 0.00 0.41 0.00 0.00 0.00 179.25 180.13 1owo n GLY 70 N -0.41 0.70 0.00 0.00 0.00 -0.76 -1.02 105.19 103.69 1owo n GLY 70 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1owo n GLY 70 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1owo n SER 71 N 0.00 0.00 -3.57 1.61 3.41 -0.61 -2.34 113.62 112.12 1owo n SER 71 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1owo n SER 71 Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1owo n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1owo s ARG 72 N 3.85 1.75 -0.27 4.33 1.70 -1.26 -3.74 118.95 125.32 1owo s ARG 72 Ca 0.00 -1.03 -0.04 0.00 -0.47 0.00 0.00 55.73 54.19 1owo s ARG 72 Cb 0.00 0.56 0.02 0.00 -0.57 0.00 0.00 34.95 34.95 1owo s ARG 72 CO 0.00 -0.81 0.00 -1.17 -1.08 0.00 0.00 175.30 172.25 1owo s LEU 73 N -3.00 3.48 0.22 -1.89 2.96 -1.26 -2.14 118.68 117.05 1owo s LEU 73 Ca 0.13 -0.77 -0.25 0.00 -0.22 0.00 0.00 54.13 53.02 1owo s LEU 73 Cb -0.05 -1.77 -0.09 0.00 0.50 0.00 0.00 46.19 44.79 1owo s LEU 73 CO 0.07 -0.15 0.82 -0.76 -1.32 0.00 0.00 176.35 175.01 1owo s LEU 74 N 1.41 4.50 -0.11 -0.68 1.43 -0.13 -4.93 118.68 120.18 1owo s LEU 74 Ca 0.01 1.68 0.02 0.00 -1.03 0.00 0.00 54.13 54.82 1owo s LEU 74 Cb -0.17 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 1owo s LEU 74 CO -0.01 0.12 -0.19 -0.76 0.23 0.00 0.00 176.35 175.73 1owo s LEU 75 N -1.49 2.39 0.13 1.79 1.43 -1.26 -1.24 118.68 120.42 1owo s LEU 75 Ca 0.41 -0.44 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 1owo s LEU 75 Cb -0.21 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 1owo s LEU 75 CO 0.26 0.17 -0.14 -0.76 0.23 0.00 0.00 176.35 176.10 1owo s LEU 76 N 0.30 2.41 -0.12 1.79 1.02 -0.39 -1.48 118.68 122.22 1owo s LEU 76 Ca -0.14 -0.83 -0.02 0.00 0.02 0.00 0.00 54.13 53.16 1owo s LEU 76 Cb -0.17 -0.57 0.04 0.00 0.02 0.00 0.00 46.19 45.52 1owo s LEU 76 CO 0.07 -0.14 0.03 -1.58 0.02 0.00 0.00 176.35 174.75 1owo s GLN 77 N -2.75 0.48 0.00 1.70 0.74 -1.26 0.91 119.66 119.48 1owo s GLN 77 Ca 0.10 -0.04 0.00 0.00 0.05 0.00 0.00 55.36 55.47 1owo s GLN 77 Cb -0.05 -1.36 0.00 0.00 1.10 0.00 0.00 33.01 32.71 1owo s GLN 77 CO 0.03 -0.45 0.00 0.41 -0.55 0.00 0.00 175.29 174.73 1owo n GLY 78 N 5.15 0.31 3.67 2.59 0.00 -0.71 -4.95 105.19 111.25 1owo n GLY 78 Ca -0.07 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.00 1owo n GLY 78 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1owo s ASP 79 N -4.00 7.14 0.15 1.61 2.15 -1.26 -4.18 116.67 118.28 1owo s ASP 79 Ca 0.00 1.46 -0.17 0.00 0.43 0.00 0.00 52.55 54.27 1owo s ASP 79 Cb 0.00 -2.55 0.05 0.00 -0.30 0.00 0.00 42.92 40.12 1owo s ASP 79 CO 0.00 -0.59 1.74 -0.65 -0.17 0.00 0.00 175.17 175.49 1owo h PRO 80 N 7.36 0.20 0.00 4.34 0.11 -1.96 0.15 132.00 142.20 1owo h PRO 80 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1owo h PRO 80 Cb 1.10 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1owo h PRO 80 CO 0.93 0.13 0.00 0.00 -0.21 0.00 0.00 178.00 178.85 1owo n GLN 81 N -5.07 0.18 -0.09 1.05 10.64 -1.26 -1.07 117.38 121.76 1owo n GLN 81 Ca 0.01 0.17 -0.18 0.00 -1.83 0.00 0.00 57.00 55.16 1owo n GLN 81 Cb 0.14 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 27.96 1owo n GLN 81 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 1owo n HIS 82 N -1.30 0.00 -0.12 2.61 8.25 -1.02 -4.57 115.22 119.06 1owo n HIS 82 Ca 0.06 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.39 1owo n HIS 82 Cb 0.11 -0.64 -0.02 0.00 1.12 0.00 0.00 29.99 30.56 1owo n HIS 82 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1owo h LEU 83 N -0.71 1.01 -0.13 2.41 3.38 -0.88 -2.91 115.31 117.48 1owo h LEU 83 Ca -0.40 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.09 1owo h LEU 83 Cb 1.29 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1owo h LEU 83 CO -0.24 1.27 0.03 0.40 0.09 0.00 0.00 178.44 179.99 1owo h ILE 84 N 0.77 1.19 -0.74 1.22 5.03 -1.32 -1.02 117.51 122.64 1owo h ILE 84 Ca 0.06 -0.61 -0.02 0.00 -0.12 0.00 0.00 64.86 64.17 1owo h ILE 84 Cb 0.99 1.36 -0.03 0.00 -3.03 0.00 0.00 36.82 36.11 1owo h ILE 84 CO 0.10 0.18 0.38 -0.65 -0.68 0.00 0.00 178.15 177.48 1owo h PRO 85 N 0.01 1.05 -0.59 2.37 0.11 -1.74 -0.61 132.00 132.61 1owo h PRO 85 Ca 0.04 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 66.01 1owo h PRO 85 Cb 0.25 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.13 1owo h PRO 85 CO 0.00 0.81 0.37 1.96 -0.21 0.00 0.00 178.00 180.93 1owo h GLN 86 N 1.03 0.78 -0.20 1.05 4.20 -1.43 0.84 115.11 121.38 1owo h GLN 86 Ca 0.26 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.89 1owo h GLN 86 Cb 0.08 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1owo h GLN 86 CO -0.04 0.54 0.06 1.25 -0.67 0.00 0.00 178.83 179.97 1owo h LEU 87 N 0.80 0.30 -0.87 1.46 5.85 -0.90 0.05 115.31 121.99 1owo h LEU 87 Ca 0.21 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1owo h LEU 87 Cb -0.06 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 1owo h LEU 87 CO -0.04 0.43 0.49 0.00 -0.34 0.00 0.00 178.44 178.98 1owo h ALA 88 N 0.88 1.11 0.22 1.25 0.00 -0.84 -1.57 119.26 120.31 1owo h ALA 88 Ca 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1owo h ALA 88 Cb 0.24 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1owo h ALA 88 CO -0.00 0.61 -0.11 0.37 0.00 0.00 0.00 179.25 180.12 1owo h GLN 89 N 1.21 -0.28 -0.07 0.00 4.15 -0.64 0.15 115.11 119.62 1owo h GLN 89 Ca 0.31 0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.77 1owo h GLN 89 Cb 0.01 0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 1owo h GLN 89 CO -0.05 -0.03 0.18 1.96 -1.93 0.00 0.00 178.83 178.96 1owo h GLN 90 N -0.52 0.00 -0.08 1.69 1.08 -0.80 0.22 115.11 116.70 1owo h GLN 90 Ca -0.03 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1owo h GLN 90 Cb 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 1owo h GLN 90 CO 0.05 0.00 0.00 -0.11 -0.95 0.00 0.00 178.83 177.82 1owo n LEU 91 N -3.27 2.70 -3.98 1.46 7.94 -0.61 -4.76 117.00 116.48 1owo n LEU 91 Ca -0.01 -1.09 -0.35 0.00 -1.11 0.00 0.00 56.01 53.45 1owo n LEU 91 Cb 0.26 -0.04 -0.00 0.00 0.53 0.00 0.00 43.42 44.17 1owo n LEU 91 CO 0.20 0.49 -0.21 1.67 -1.11 0.00 0.00 177.39 178.44 1owo n GLN 92 N 1.10 -1.39 -2.29 1.96 7.27 0.77 -4.66 117.38 120.14 1owo n GLN 92 Ca 0.12 0.26 -0.42 0.00 0.07 0.00 0.00 57.00 57.04 1owo n GLN 92 Cb 0.49 -3.64 -0.03 0.00 2.41 0.00 0.00 30.24 29.47 1owo n GLN 92 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1owo s ALA 93 N -3.77 3.49 0.30 1.69 0.00 0.29 -4.41 121.76 119.35 1owo s ALA 93 Ca 0.28 1.01 0.26 0.00 0.00 0.00 0.00 51.96 53.52 1owo s ALA 93 Cb -0.13 -3.47 1.25 0.00 0.00 0.00 0.00 23.12 20.77 1owo s ALA 93 CO 0.93 -0.49 1.97 1.49 0.00 0.00 0.00 175.76 179.67 1owo h GLU 94 N 5.92 0.00 -1.04 0.00 4.81 -1.39 -3.44 114.58 119.45 1owo h GLU 94 Ca -0.43 0.00 0.33 0.00 -0.13 0.00 0.00 59.36 59.13 1owo h GLU 94 Cb 1.21 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 30.39 1owo h GLU 94 CO 0.79 0.16 0.99 0.00 -0.73 0.00 0.00 179.01 180.22 1owo s ALA 95 N -3.96 -2.22 -0.16 2.92 0.00 -1.25 -3.99 121.76 113.10 1owo s ALA 95 Ca -0.01 1.90 0.01 0.00 0.00 0.00 0.00 51.96 53.85 1owo s ALA 95 Cb 0.12 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.87 1owo s ALA 95 CO 0.60 -0.56 -0.15 0.08 0.00 0.00 0.00 175.76 175.74 1owo s VAL 96 N -2.03 1.68 0.13 0.00 1.01 0.13 -1.20 120.40 120.12 1owo s VAL 96 Ca 0.12 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1owo s VAL 96 Cb -0.01 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 1owo s VAL 96 CO -0.02 0.44 0.11 -0.31 0.00 0.00 0.00 175.10 175.32 1owo s TYR 97 N 1.44 3.15 -0.09 5.22 1.51 0.15 -1.87 117.35 126.87 1owo s TYR 97 Ca 0.04 0.01 -0.30 0.00 -1.01 0.00 0.00 57.07 55.81 1owo s TYR 97 Cb -0.13 -1.55 0.12 0.00 -0.11 0.00 0.00 41.96 40.29 1owo s TYR 97 CO -0.11 0.52 0.99 1.67 -1.11 0.00 0.00 175.55 177.51 1owo s TRP 98 N -1.61 -0.31 -0.06 2.71 -2.14 -0.83 0.29 118.94 116.99 1owo s TRP 98 Ca 0.30 0.31 -0.16 0.00 2.66 0.00 0.00 56.10 59.21 1owo s TRP 98 Cb -0.11 0.51 -0.05 0.00 -3.10 0.00 0.00 33.47 30.72 1owo s TRP 98 CO 0.23 -0.41 0.42 -0.80 -2.66 0.00 0.00 176.95 173.72 1owo s ASN 99 N -2.00 6.72 0.62 -2.66 0.01 -1.26 -1.95 114.94 114.43 1owo s ASN 99 Ca 0.04 0.86 -0.18 0.00 -0.71 0.00 0.00 52.86 52.86 1owo s ASN 99 Cb -0.01 -2.26 -0.03 0.00 0.41 0.00 0.00 41.25 39.36 1owo s ASN 99 CO -0.05 0.18 1.13 0.00 -1.51 0.00 0.00 177.10 176.85 1owo n GLN 100 N 2.68 1.03 -3.84 -0.60 6.02 0.94 -4.88 117.38 118.72 1owo n GLN 100 Ca -0.11 0.40 -0.21 0.00 -0.01 0.00 0.00 57.00 57.07 1owo n GLN 100 Cb 0.52 -2.35 -0.03 0.00 1.02 0.00 0.00 30.24 29.41 1owo n GLN 100 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1owo s ASP 101 N -1.29 5.76 -0.00 1.08 -1.08 -1.26 -4.76 116.67 115.12 1owo s ASP 101 Ca 0.79 -0.22 0.06 0.00 -0.52 0.00 0.00 52.55 52.65 1owo s ASP 101 Cb -0.40 -1.35 -0.07 0.00 -1.46 0.00 0.00 42.92 39.64 1owo s ASP 101 CO 0.44 -0.23 0.23 2.30 0.52 0.00 0.00 175.17 178.44 1owo n ILE 102 N -1.40 0.00 -3.20 4.11 -5.35 -1.26 -4.78 119.36 107.48 1owo n ILE 102 Ca -0.05 -0.33 -0.36 0.00 -0.27 0.00 0.00 62.75 61.74 1owo n ILE 102 Cb 0.58 0.92 -0.06 0.00 -1.74 0.00 0.00 39.64 39.34 1owo n ILE 102 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1owo s GLU 103 N -1.66 4.14 0.17 6.28 2.02 -1.26 -3.88 118.70 124.51 1owo s GLU 103 Ca 0.02 0.72 -0.20 0.00 0.02 0.00 0.00 54.97 55.53 1owo s GLU 103 Cb 0.04 -2.89 0.10 0.00 0.10 0.00 0.00 34.13 31.49 1owo s GLU 103 CO 0.24 0.42 1.62 -1.35 0.02 0.00 0.00 175.26 176.21 1owo h PRO 104 N 3.44 -0.15 0.19 0.39 0.11 -1.93 -0.42 132.00 133.63 1owo h PRO 104 Ca -0.48 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1owo h PRO 104 Cb 1.19 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1owo h PRO 104 CO 0.65 -0.10 -0.10 -0.92 -0.21 0.00 0.00 178.00 177.33 1owo h TYR 105 N -0.16 -0.25 -0.96 0.65 3.20 -1.99 -1.02 116.97 116.43 1owo h TYR 105 Ca 0.20 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.09 1owo h TYR 105 Cb 0.48 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.78 1owo h TYR 105 CO -0.49 -0.15 0.63 0.78 -1.64 0.00 0.00 178.16 177.29 1owo h GLY 106 N -0.26 1.38 1.29 1.82 0.00 -1.90 -0.96 103.07 104.44 1owo h GLY 106 Ca -0.02 -0.49 -0.16 0.00 0.00 0.00 0.00 47.33 46.65 1owo h GLY 106 CO 0.04 0.45 -0.48 3.21 0.00 0.00 0.00 176.54 179.76 1owo h ARG 107 N 1.25 0.76 -0.24 4.80 3.08 -0.90 -0.50 114.38 122.63 1owo h ARG 107 Ca 0.37 -0.44 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 1owo h ARG 107 Cb -0.06 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 1owo h ARG 107 CO -0.10 1.06 -0.11 -0.44 -1.07 0.00 0.00 179.97 179.32 1owo h ASP 108 N 0.60 0.52 -0.34 7.04 3.32 -0.90 -1.98 116.42 124.67 1owo h ASP 108 Ca 0.03 -0.40 0.03 0.00 0.02 0.00 0.00 57.03 56.71 1owo h ASP 108 Cb 1.05 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.42 1owo h ASP 108 CO 0.10 0.80 0.15 -0.09 -1.72 0.00 0.00 179.24 178.49 1owo h ARG 109 N 0.23 0.31 -0.36 3.56 2.43 -1.16 -2.60 114.38 116.79 1owo h ARG 109 Ca 0.06 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1owo h ARG 109 Cb 0.60 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 1owo h ARG 109 CO 0.03 0.20 0.16 -0.44 -1.51 0.00 0.00 179.97 178.42 1owo h ASP 110 N 0.32 0.23 -0.72 -3.80 3.32 -0.96 -0.29 116.42 114.51 1owo h ASP 110 Ca 0.15 0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.26 1owo h ASP 110 Cb 0.08 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 1owo h ASP 110 CO -0.12 0.17 0.48 1.23 -1.72 0.00 0.00 179.24 179.27 1owo h GLY 111 N 0.34 1.00 1.25 2.75 0.00 -1.19 -0.33 103.07 106.89 1owo h GLY 111 Ca 0.16 -0.34 -0.17 0.00 0.00 0.00 0.00 47.33 46.98 1owo h GLY 111 CO -0.13 0.30 -0.47 1.46 0.00 0.00 0.00 176.54 177.70 1owo h GLN 112 N 0.87 0.81 -0.31 4.80 1.08 -0.96 -1.57 115.11 119.83 1owo h GLN 112 Ca 0.29 -0.47 -0.07 0.00 -1.45 0.00 0.00 58.65 56.95 1owo h GLN 112 Cb 0.06 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.52 1owo h GLN 112 CO -0.08 1.10 -0.07 0.28 -0.95 0.00 0.00 178.83 179.11 1owo h VAL 113 N 0.64 1.28 -0.55 -0.54 2.07 -0.52 -1.67 116.25 116.96 1owo h VAL 113 Ca 0.03 -1.11 0.02 0.00 0.82 0.00 0.00 66.70 66.47 1owo h VAL 113 Cb 1.05 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 1owo h VAL 113 CO 0.10 0.36 0.35 0.00 0.02 0.00 0.00 177.57 178.39 1owo h ALA 114 N 0.79 0.71 -0.59 1.67 0.00 -1.01 0.44 119.26 121.27 1owo h ALA 114 Ca 0.08 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1owo h ALA 114 Cb 0.56 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1owo h ALA 114 CO 0.03 0.08 0.28 0.00 0.00 0.00 0.00 179.25 179.64 1owo h ALA 115 N 1.23 0.76 -0.48 0.00 0.00 -1.22 0.91 119.26 120.47 1owo h ALA 115 Ca 0.22 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1owo h ALA 115 Cb -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1owo h ALA 115 CO -0.08 0.33 0.10 0.00 0.00 0.00 0.00 179.25 179.60 1owo h ALA 116 N 1.11 1.27 -0.37 0.00 0.00 -0.83 -1.12 119.26 119.33 1owo h ALA 116 Ca 0.20 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1owo h ALA 116 Cb 0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1owo h ALA 116 CO -0.02 0.50 -0.41 -0.07 0.00 0.00 0.00 179.25 179.25 1owo h LEU 117 N 0.71 1.00 -0.52 0.00 3.38 -0.29 -2.46 115.31 117.13 1owo h LEU 117 Ca 0.16 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 1owo h LEU 117 Cb 0.29 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1owo h LEU 117 CO 0.00 1.27 0.25 0.50 0.09 0.00 0.00 178.44 180.55 1owo h LYS 118 N 0.74 0.75 -0.70 1.13 3.64 -0.48 0.42 116.57 122.06 1owo h LYS 118 Ca 0.05 -0.11 0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1owo h LYS 118 Cb 1.01 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.63 1owo h LYS 118 CO 0.10 0.62 0.40 1.15 -2.27 0.00 0.00 179.45 179.45 1owo h THR 119 N 0.69 0.98 0.00 1.00 2.02 -1.15 0.25 112.91 116.70 1owo h THR 119 Ca 0.18 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.11 1owo h THR 119 Cb 0.11 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.70 1owo h THR 119 CO -0.02 0.13 0.00 0.00 0.37 0.00 0.00 175.52 176.00 1owo n ALA 120 N -2.35 2.47 -2.20 6.16 0.00 -0.88 -4.87 120.51 118.84 1owo n ALA 120 Ca 0.09 -0.16 -0.09 0.00 0.00 0.00 0.00 53.44 53.29 1owo n ALA 120 Cb 0.18 -1.41 -0.00 0.00 0.00 0.00 0.00 19.45 18.22 1owo n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1owo n GLY 121 N 0.62 0.02 3.33 0.00 0.00 0.88 -5.03 105.19 105.02 1owo n GLY 121 Ca 0.19 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1owo n GLY 121 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1owo s ILE 122 N -2.47 2.54 0.26 -0.61 1.01 0.14 -4.99 121.20 117.08 1owo s ILE 122 Ca 0.01 -0.88 -0.30 0.00 0.00 0.00 0.00 60.65 59.49 1owo s ILE 122 Cb -0.00 -1.99 -0.10 0.00 0.01 0.00 0.00 42.46 40.38 1owo s ILE 122 CO 0.01 0.56 1.35 -0.13 0.00 0.00 0.00 174.94 176.74 1owo s ARG 123 N -0.05 4.34 -0.15 2.79 0.52 -1.26 -3.56 118.95 121.59 1owo s ARG 123 Ca -0.05 2.19 0.01 0.00 -0.52 0.00 0.00 55.73 57.36 1owo s ARG 123 Cb -0.14 -3.13 0.02 0.00 0.52 0.00 0.00 34.95 32.22 1owo s ARG 123 CO 0.04 -0.29 -0.16 0.00 0.02 0.00 0.00 175.30 174.92 1owo s ALA 124 N -0.33 1.95 -0.24 2.13 0.00 -1.26 -0.69 121.76 123.32 1owo s ALA 124 Ca 0.55 -0.95 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 1owo s ALA 124 Cb -0.39 -1.04 0.03 0.00 0.00 0.00 0.00 23.12 21.72 1owo s ALA 124 CO 0.44 -0.30 -0.08 0.08 0.00 0.00 0.00 175.76 175.91 1owo s VAL 125 N 1.31 2.72 -0.31 0.00 1.01 -0.78 -4.99 120.40 119.36 1owo s VAL 125 Ca 0.02 -1.10 -0.03 0.00 0.00 0.00 0.00 61.98 60.87 1owo s VAL 125 Cb -0.13 -2.39 0.05 0.00 0.00 0.00 0.00 36.38 33.90 1owo s VAL 125 CO -0.09 0.19 0.03 -1.10 0.00 0.00 0.00 175.10 174.14 1owo s GLN 126 N 1.29 2.50 0.24 2.72 -0.21 -1.26 -1.96 119.66 122.99 1owo s GLN 126 Ca -0.01 -1.23 0.10 0.00 0.02 0.00 0.00 55.36 54.24 1owo s GLN 126 Cb -0.17 -3.26 -0.04 0.00 1.00 0.00 0.00 33.01 30.54 1owo s GLN 126 CO -0.05 -0.63 -0.07 -0.51 -2.12 0.00 0.00 175.29 171.91 1owo s LEU 127 N 1.30 3.01 -0.08 2.90 1.43 -0.82 -4.78 118.68 121.63 1owo s LEU 127 Ca -0.04 -0.70 -0.24 0.00 -1.03 0.00 0.00 54.13 52.12 1owo s LEU 127 Cb -0.20 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1owo s LEU 127 CO 0.00 0.04 0.72 0.26 0.23 0.00 0.00 176.35 177.60 1owo s TRP 128 N -2.18 3.55 0.00 0.29 0.52 -1.26 -0.04 118.94 119.81 1owo s TRP 128 Ca 0.29 1.25 0.00 0.00 0.02 0.00 0.00 56.10 57.67 1owo s TRP 128 Cb -0.07 -2.84 0.00 0.00 -1.15 0.00 0.00 33.47 29.41 1owo s TRP 128 CO 0.18 0.03 0.00 -3.47 0.02 0.00 0.00 176.95 173.71 1owo n ASP 129 N 4.02 1.44 0.00 2.95 2.03 -1.26 -4.80 116.55 120.92 1owo n ASP 129 Ca -0.00 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.44 1owo n ASP 129 Cb 0.51 0.00 0.79 0.00 -0.72 0.00 0.00 41.12 41.70 1owo n ASP 129 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1owo n GLN 130 N -1.93 0.79 -4.89 -0.67 10.64 -1.26 -4.64 117.38 115.43 1owo n GLN 130 Ca 0.00 0.01 -0.26 0.00 -1.83 0.00 0.00 57.00 54.92 1owo n GLN 130 Cb 0.19 -1.50 -0.15 0.00 -0.86 0.00 0.00 30.24 27.92 1owo n GLN 130 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1owo s LEU 131 N -2.07 2.05 0.39 2.61 1.43 -1.26 -4.80 118.68 117.02 1owo s LEU 131 Ca 0.39 -0.35 0.09 0.00 -1.03 0.00 0.00 54.13 53.23 1owo s LEU 131 Cb 0.19 -0.96 0.78 0.00 0.03 0.00 0.00 46.19 46.22 1owo s LEU 131 CO 0.33 0.22 1.92 -0.07 0.23 0.00 0.00 176.35 178.98 1owo h LEU 132 N 5.62 0.26 -7.58 1.79 3.38 -1.92 -3.41 115.31 113.45 1owo h LEU 132 Ca -0.38 -0.05 -0.40 0.00 0.09 0.00 0.00 57.88 57.14 1owo h LEU 132 Cb 1.15 -0.07 -0.36 0.00 0.09 0.00 0.00 40.66 41.47 1owo h LEU 132 CO 0.48 0.39 -0.76 -1.00 0.09 0.00 0.00 178.44 177.63 1owo s HIS 133 N -4.79 0.58 0.76 1.13 3.76 -1.26 -4.68 115.29 110.79 1owo s HIS 133 Ca -0.06 -0.12 -0.12 0.00 -0.15 0.00 0.00 55.06 54.61 1owo s HIS 133 Cb 0.16 -0.66 0.05 0.00 1.11 0.00 0.00 32.58 33.24 1owo s HIS 133 CO 0.73 -0.24 1.11 -1.54 -0.85 0.00 0.00 174.74 173.96 1owo s SER 134 N 1.45 4.43 0.49 1.40 1.04 -1.26 -4.90 113.70 116.34 1owo s SER 134 Ca -0.03 1.97 0.21 0.00 0.48 0.00 0.00 55.95 58.57 1owo s SER 134 Cb -0.13 -2.54 1.24 0.00 0.10 0.00 0.00 66.02 64.69 1owo s SER 134 CO -0.03 -2.09 1.97 -0.65 0.98 0.00 0.00 173.24 173.43 1owo h PRO 135 N -0.84 0.18 0.00 4.02 0.11 -1.95 -0.92 132.00 132.60 1owo h PRO 135 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1owo h PRO 135 Cb 1.25 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1owo h PRO 135 CO 0.51 0.12 0.00 -0.25 -0.21 0.00 0.00 178.00 178.16 1owo n ASP 136 N -4.42 0.77 0.04 -2.05 8.00 -1.26 -3.50 116.55 114.12 1owo n ASP 136 Ca 0.11 0.60 -0.03 0.00 0.71 0.00 0.00 54.79 56.18 1owo n ASP 136 Cb 0.55 -0.79 -0.09 0.00 -0.02 0.00 0.00 41.12 40.77 1owo n ASP 136 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1owo h GLN 137 N 0.00 0.00 -3.90 -1.24 4.15 -1.51 -3.42 115.11 109.19 1owo h GLN 137 Ca 0.00 0.00 -0.76 0.00 0.77 0.00 0.00 58.65 58.66 1owo h GLN 137 Cb 0.64 0.00 -0.27 0.00 0.21 0.00 0.00 27.48 28.06 1owo h GLN 137 CO 0.00 0.48 -0.09 0.42 -1.93 0.00 0.00 178.83 177.71 1owo s ILE 138 N -2.81 5.09 0.12 2.39 -1.09 -1.21 -5.03 121.20 118.66 1owo s ILE 138 Ca -0.02 -2.28 0.04 0.00 -2.23 0.00 0.00 60.65 56.16 1owo s ILE 138 Cb 0.08 -4.21 -0.04 0.00 -1.58 0.00 0.00 42.46 36.72 1owo s ILE 138 CO 0.81 -0.95 -0.10 -0.76 -1.23 0.00 0.00 174.94 172.71 1owo s LEU 139 N 0.54 2.48 0.00 2.97 1.43 -1.26 -4.70 118.68 120.14 1owo s LEU 139 Ca 0.13 -0.94 -0.15 0.00 -1.03 0.00 0.00 54.13 52.14 1owo s LEU 139 Cb -0.17 -0.31 0.22 0.00 0.03 0.00 0.00 46.19 45.95 1owo s LEU 139 CO -0.05 -0.31 1.02 -1.54 0.23 0.00 0.00 176.35 175.70 1owo n SER 140 N 0.10 -0.81 0.27 2.29 3.41 0.58 -4.80 113.62 114.66 1owo n SER 140 Ca -0.13 -1.25 0.12 0.00 -0.26 0.00 0.00 58.87 57.36 1owo n SER 140 Cb 0.59 -0.84 0.77 0.00 -0.26 0.00 0.00 64.21 64.47 1owo n SER 140 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1owo h GLY 141 N -1.86 0.00 -1.67 5.00 0.00 -2.01 0.76 103.07 103.29 1owo h GLY 141 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1owo h GLY 141 CO 0.24 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.22 1owo n SER 142 N -3.97 2.45 -1.19 0.19 7.64 -1.26 -4.92 113.62 112.56 1owo n SER 142 Ca -0.03 -1.99 -0.11 0.00 1.01 0.00 0.00 58.87 57.76 1owo n SER 142 Cb 0.14 -0.30 -0.01 0.00 -1.01 0.00 0.00 64.21 63.04 1owo n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1owo n GLY 143 N 1.23 0.07 3.49 0.23 0.00 0.26 -5.03 105.19 105.44 1owo n GLY 143 Ca 0.16 -0.44 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 1owo n GLY 143 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1owo s ASN 144 N -2.55 3.80 0.92 1.61 0.01 -1.26 -4.76 114.94 112.71 1owo s ASN 144 Ca 0.00 -0.78 -0.11 0.00 -0.71 0.00 0.00 52.86 51.26 1owo s ASN 144 Cb 0.00 -0.45 0.14 0.00 0.41 0.00 0.00 41.25 41.35 1owo s ASN 144 CO 0.00 0.10 1.09 -2.16 -1.51 0.00 0.00 177.10 174.62 1owo s PRO 145 N -2.90 1.05 -0.13 -0.60 0.04 -1.26 -0.31 135.00 130.88 1owo s PRO 145 Ca 0.24 0.96 -0.06 0.00 0.04 0.00 0.00 61.00 62.18 1owo s PRO 145 Cb -0.08 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.65 1owo s PRO 145 CO 0.13 -2.42 0.10 0.71 0.04 0.00 0.00 177.00 175.56 1owo s TYR 146 N -2.83 3.46 0.00 0.56 2.02 -1.26 -4.80 117.35 114.50 1owo s TYR 146 Ca 0.64 0.40 0.00 0.00 -0.37 0.00 0.00 57.07 57.74 1owo s TYR 146 Cb -0.19 -1.95 0.00 0.00 -0.40 0.00 0.00 41.96 39.42 1owo s TYR 146 CO 0.58 0.58 0.92 -1.13 -1.57 0.00 0.00 175.55 174.93 1owo n SER 147 N 2.32 1.84 -3.98 2.29 3.41 -1.26 -4.84 113.62 113.40 1owo n SER 147 Ca -0.19 -1.84 -0.24 0.00 -0.26 0.00 0.00 58.87 56.34 1owo n SER 147 Cb 0.54 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.33 1owo n SER 147 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1owo s VAL 148 N -0.84 1.01 0.10 -3.33 1.01 -1.26 0.02 120.40 117.11 1owo s VAL 148 Ca 0.00 -0.39 -0.22 0.00 0.00 0.00 0.00 61.98 61.38 1owo s VAL 148 Cb 0.00 -0.95 -0.12 0.00 0.00 0.00 0.00 36.38 35.31 1owo s VAL 148 CO 0.00 0.33 1.75 0.22 0.00 0.00 0.00 175.10 177.40 1owo h TYR 149 N 7.17 0.07 -0.42 5.22 3.20 -1.93 -3.22 116.97 127.06 1owo h TYR 149 Ca -0.32 0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.59 1owo h TYR 149 Cb 1.17 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 39.37 1owo h TYR 149 CO 0.49 0.04 -0.25 0.41 -1.64 0.00 0.00 178.16 177.22 1owo n GLY 150 N -1.11 -2.84 0.31 1.82 0.00 -1.26 -0.43 105.19 101.67 1owo n GLY 150 Ca -0.06 0.83 0.05 0.00 0.00 0.00 0.00 46.02 46.84 1owo n GLY 150 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1owo h PRO 151 N 0.00 0.48 -0.04 1.61 0.11 -2.01 -2.06 132.00 130.09 1owo h PRO 151 Ca 0.07 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.14 1owo h PRO 151 Cb 0.17 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.17 1owo h PRO 151 CO -0.39 0.31 0.01 0.35 -0.21 0.00 0.00 178.00 178.07 1owo h PHE 152 N 0.49 0.07 -0.43 0.65 3.04 -1.12 -2.49 116.94 117.14 1owo h PHE 152 Ca 0.14 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.11 1owo h PHE 152 Cb -0.02 -0.02 -0.03 0.00 2.56 0.00 0.00 35.95 38.44 1owo h PHE 152 CO -0.00 0.27 0.24 2.35 -2.02 0.00 0.00 178.31 179.15 1owo h TRP 153 N -0.16 0.44 -0.87 0.41 2.91 -0.39 0.38 115.95 118.68 1owo h TRP 153 Ca 0.01 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.12 1owo h TRP 153 Cb 0.24 -0.13 -0.06 0.00 -0.51 0.00 0.00 29.16 28.70 1owo h TRP 153 CO 0.00 0.24 0.56 -0.22 -1.03 0.00 0.00 178.44 178.00 1owo h LYS 154 N 0.47 0.91 0.27 2.65 3.64 -1.29 0.17 116.57 123.39 1owo h LYS 154 Ca 0.18 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1owo h LYS 154 Cb 0.05 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1owo h LYS 154 CO -0.11 0.60 -0.13 -0.97 -2.27 0.00 0.00 179.45 176.58 1owo h ASN 155 N 0.94 -0.31 -0.65 4.20 -0.73 -1.02 -3.24 115.58 114.77 1owo h ASN 155 Ca 0.38 -0.10 0.13 0.00 1.87 0.00 0.00 56.30 58.58 1owo h ASN 155 Cb 0.26 0.08 -0.12 0.00 0.27 0.00 0.00 38.32 38.80 1owo h ASN 155 CO -0.14 0.18 -0.14 -0.25 -0.37 0.00 0.00 177.43 176.70 1owo h TRP 156 N -1.05 -0.31 -0.75 0.67 7.01 -0.71 -1.48 115.95 119.34 1owo h TRP 156 Ca -0.04 0.06 0.05 0.00 2.11 0.00 0.00 58.89 61.07 1owo h TRP 156 Cb 0.39 0.24 -0.04 0.00 -2.10 0.00 0.00 29.16 27.64 1owo h TRP 156 CO 0.03 -0.27 0.49 0.37 -2.79 0.00 0.00 178.44 176.27 1owo h GLN 157 N 0.01 0.82 0.00 2.65 -0.00 -0.80 -2.48 115.11 115.31 1owo h GLN 157 Ca 0.32 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.92 1owo h GLN 157 Cb 0.49 -0.18 0.00 0.00 0.00 0.00 0.00 27.48 27.79 1owo h GLN 157 CO -0.66 0.54 0.00 0.00 0.00 0.00 0.00 178.83 178.71 1owo h ALA 158 N 1.58 1.00 -2.71 3.38 0.00 -1.30 -3.46 119.26 117.76 1owo h ALA 158 Ca 0.31 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.70 1owo h ALA 158 Cb 0.16 0.00 0.03 0.00 0.00 0.00 0.00 17.79 17.98 1owo h ALA 158 CO -0.10 0.00 0.57 -0.65 0.00 0.00 0.00 179.25 179.07 1owo s GLN 159 N -3.19 4.48 0.29 0.00 -1.52 -0.94 -4.97 119.66 113.82 1owo s GLN 159 Ca 0.08 1.93 -0.30 0.00 -1.95 0.00 0.00 55.36 55.13 1owo s GLN 159 Cb 0.10 -3.21 -0.11 0.00 -0.22 0.00 0.00 33.01 29.57 1owo s GLN 159 CO 0.59 -0.09 1.54 -1.25 -0.25 0.00 0.00 175.29 175.83 1owo s PRO 160 N -0.53 4.16 -0.01 2.91 0.04 -1.26 -4.96 135.00 135.34 1owo s PRO 160 Ca 0.52 2.50 -0.21 0.00 0.04 0.00 0.00 61.00 63.85 1owo s PRO 160 Cb -0.34 -3.04 -0.05 0.00 0.04 0.00 0.00 34.50 31.11 1owo s PRO 160 CO 0.39 -0.56 0.61 0.15 0.04 0.00 0.00 177.00 177.62 1owo s LYS 161 N -0.62 4.33 0.54 4.56 -0.14 -1.26 -5.06 119.74 122.10 1owo s LYS 161 Ca 0.61 0.75 -0.18 0.00 -1.36 0.00 0.00 55.97 55.79 1owo s LYS 161 Cb -0.46 -3.35 -0.06 0.00 -1.68 0.00 0.00 37.83 32.28 1owo s LYS 161 CO 0.48 0.34 1.05 -1.25 -0.76 0.00 0.00 175.35 175.21 1owo s PRO 162 N -0.11 3.54 0.31 -1.68 0.04 -1.26 -5.07 135.00 130.77 1owo s PRO 162 Ca 0.32 1.28 0.07 0.00 0.04 0.00 0.00 61.00 62.71 1owo s PRO 162 Cb -0.18 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 1owo s PRO 162 CO 0.17 -0.64 0.32 0.95 0.04 0.00 0.00 177.00 177.84 1owo s THR 163 N -2.23 3.93 0.47 1.26 -4.23 -1.26 -4.88 115.64 108.70 1owo s THR 163 Ca 0.65 -1.27 -0.24 0.00 -1.18 0.00 0.00 61.69 59.65 1owo s THR 163 Cb -0.16 -3.32 -0.08 0.00 1.34 0.00 0.00 72.50 70.28 1owo s THR 163 CO 0.29 -0.21 1.38 -2.65 -0.54 0.00 0.00 174.62 172.89 1owo n PRO 164 N -1.40 2.04 -2.90 3.99 -0.02 -1.26 -4.98 135.00 130.47 1owo n PRO 164 Ca -0.03 0.73 -0.19 0.00 -2.02 0.00 0.00 63.50 62.00 1owo n PRO 164 Cb 0.59 -2.57 0.03 0.00 -0.02 0.00 0.00 33.50 31.53 1owo n PRO 164 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1owo s VAL 165 N -1.22 2.76 0.55 -1.45 -7.23 -1.26 -5.01 120.40 107.54 1owo s VAL 165 Ca 0.64 -0.90 -0.18 0.00 -1.81 0.00 0.00 61.98 59.73 1owo s VAL 165 Cb -0.45 -2.86 -0.05 0.00 0.56 0.00 0.00 36.38 33.57 1owo s VAL 165 CO 0.56 0.00 1.09 0.00 -0.31 0.00 0.00 175.10 176.43 1owo s ALA 166 N -2.53 2.72 -0.04 1.32 0.00 -1.26 -3.42 121.76 118.55 1owo s ALA 166 Ca 0.57 0.63 -0.24 0.00 0.00 0.00 0.00 51.96 52.93 1owo s ALA 166 Cb -0.09 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1owo s ALA 166 CO 0.36 -0.72 0.71 0.99 0.00 0.00 0.00 175.76 177.10 1owo s THR 167 N -2.06 4.98 0.33 0.00 2.01 -1.26 -4.47 115.64 115.17 1owo s THR 167 Ca 0.68 1.47 -0.28 0.00 0.31 0.00 0.00 61.69 63.88 1owo s THR 167 Cb -0.20 -4.05 -0.09 0.00 0.01 0.00 0.00 72.50 68.17 1owo s THR 167 CO 0.29 0.28 1.18 -2.16 -0.69 0.00 0.00 174.62 173.52 1owo s PRO 168 N 0.58 4.37 0.21 4.92 0.04 -1.26 -5.03 135.00 138.82 1owo s PRO 168 Ca 0.37 1.92 0.01 0.00 0.04 0.00 0.00 61.00 63.34 1owo s PRO 168 Cb -0.18 -2.98 -0.05 0.00 0.04 0.00 0.00 34.50 31.33 1owo s PRO 168 CO 0.19 -0.07 0.06 0.95 0.04 0.00 0.00 177.00 178.17 1owo s THR 169 N -1.25 0.52 -1.23 1.26 -4.23 -1.26 -4.92 115.64 104.53 1owo s THR 169 Ca 0.50 -1.98 -0.08 0.00 -1.18 0.00 0.00 61.69 58.94 1owo s THR 169 Cb -0.33 -2.36 -0.01 0.00 1.34 0.00 0.00 72.50 71.14 1owo s THR 169 CO 0.43 -0.24 0.72 -0.62 -0.54 0.00 0.00 174.62 174.37 1owo n GLU 170 N -0.32 -3.03 -2.21 3.99 1.02 -1.08 -4.97 120.64 114.04 1owo n GLU 170 Ca -0.03 0.56 -0.31 0.00 -0.02 0.00 0.00 57.16 57.36 1owo n GLU 170 Cb 0.65 -4.79 -0.01 0.00 -0.02 0.00 0.00 31.44 27.27 1owo n GLU 170 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1owo s LEU 171 N -6.49 3.45 -0.23 -4.62 1.43 -0.19 -4.92 118.68 107.11 1owo s LEU 171 Ca 0.23 1.36 -0.07 0.00 -1.03 0.00 0.00 54.13 54.63 1owo s LEU 171 Cb -0.07 -4.36 -0.03 0.00 0.03 0.00 0.00 46.19 41.77 1owo s LEU 171 CO 0.83 -0.71 0.05 -0.69 0.23 0.00 0.00 176.35 176.06 1owo s VAL 172 N -2.90 4.24 0.79 -1.59 1.01 0.23 -4.32 120.40 117.87 1owo s VAL 172 Ca 0.55 -0.20 -0.12 0.00 0.00 0.00 0.00 61.98 62.21 1owo s VAL 172 Cb -0.11 -2.96 0.07 0.00 0.00 0.00 0.00 36.38 33.38 1owo s VAL 172 CO 0.45 0.38 1.11 -0.62 0.00 0.00 0.00 175.10 176.41 1owo s ASP 173 N 1.31 4.58 0.67 3.32 2.15 -0.99 -4.16 116.67 123.56 1owo s ASP 173 Ca 0.05 1.18 -0.12 0.00 0.43 0.00 0.00 52.55 54.09 1owo s ASP 173 Cb -0.15 -1.89 -0.00 0.00 -0.30 0.00 0.00 42.92 40.58 1owo s ASP 173 CO 0.03 -1.90 1.06 -0.76 -0.17 0.00 0.00 175.17 173.42 1owo s LEU 174 N -5.70 3.22 0.46 -1.34 1.43 -1.26 -5.05 118.68 110.44 1owo s LEU 174 Ca 0.61 1.66 0.04 0.00 -1.03 0.00 0.00 54.13 55.40 1owo s LEU 174 Cb -0.13 -4.50 0.01 0.00 0.03 0.00 0.00 46.19 41.60 1owo s LEU 174 CO 0.53 -1.37 0.65 -0.94 0.23 0.00 0.00 176.35 175.45 1owo s SER 175 N -3.58 5.60 0.25 2.29 1.04 -1.26 -4.93 113.70 113.12 1owo s SER 175 Ca 0.59 -0.10 -0.05 0.00 0.48 0.00 0.00 55.95 56.87 1owo s SER 175 Cb -0.14 -1.00 0.31 0.00 0.10 0.00 0.00 66.02 65.29 1owo s SER 175 CO 0.51 -0.83 1.90 -0.65 0.98 0.00 0.00 173.24 175.14 1owo h PRO 176 N 0.43 1.17 -0.40 4.02 0.11 -1.98 0.13 132.00 135.48 1owo h PRO 176 Ca -0.43 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 1owo h PRO 176 Cb 1.28 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 1owo h PRO 176 CO 0.51 0.77 0.05 0.93 -0.21 0.00 0.00 178.00 180.05 1owo h GLU 177 N 1.21 0.62 -0.19 1.05 5.08 -1.99 0.14 114.58 120.50 1owo h GLU 177 Ca 0.38 -0.13 -0.18 0.00 -1.00 0.00 0.00 59.36 58.43 1owo h GLU 177 Cb 0.00 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.16 1owo h GLU 177 CO -0.12 0.61 -0.60 1.96 -1.00 0.00 0.00 179.01 179.85 1owo h GLN 178 N 0.60 0.74 -0.20 2.33 4.20 -1.78 -2.71 115.11 118.29 1owo h GLN 178 Ca 0.13 -0.54 -0.03 0.00 0.06 0.00 0.00 58.65 58.27 1owo h GLN 178 Cb 0.31 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 1owo h GLN 178 CO 0.01 1.16 0.00 -0.07 -0.67 0.00 0.00 178.83 179.26 1owo h LEU 179 N 0.45 0.26 -0.56 1.46 3.38 -0.39 -1.93 115.31 117.98 1owo h LEU 179 Ca -0.02 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 1owo h LEU 179 Cb 1.23 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1owo h LEU 179 CO 0.13 0.31 -0.38 0.74 0.09 0.00 0.00 178.44 179.33 1owo h THR 180 N 0.28 1.29 -0.03 0.22 2.02 -0.63 -1.46 112.91 114.61 1owo h THR 180 Ca 0.07 -1.54 -0.04 0.00 0.77 0.00 0.00 66.41 65.66 1owo h THR 180 Cb 0.19 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1owo h THR 180 CO 0.00 0.50 -0.18 0.00 0.37 0.00 0.00 175.52 176.21 1owo h ALA 181 N 0.97 1.64 -0.01 6.16 0.00 -1.03 -3.10 119.26 123.88 1owo h ALA 181 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1owo h ALA 181 Cb 0.92 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1owo h ALA 181 CO 0.08 0.27 -0.33 0.44 0.00 0.00 0.00 179.25 179.71 1owo n ILE 182 N -4.30 0.00 -0.31 0.00 -5.35 -1.07 -4.73 119.36 103.61 1owo n ILE 182 Ca -0.02 -0.33 0.05 0.00 -0.27 0.00 0.00 62.75 62.18 1owo n ILE 182 Cb 0.26 1.18 0.12 0.00 -1.74 0.00 0.00 39.64 39.46 1owo n ILE 182 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1owo n ALA 183 N -0.16 0.21 0.27 -1.28 0.00 -0.56 -0.45 120.51 118.54 1owo n ALA 183 Ca 0.06 0.94 0.13 0.00 0.00 0.00 0.00 53.44 54.58 1owo n ALA 183 Cb 0.33 -0.56 0.82 0.00 0.00 0.00 0.00 19.45 20.04 1owo n ALA 183 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1owo h PRO 184 N 0.00 0.00 0.00 0.00 0.11 -1.85 -2.66 132.00 127.61 1owo h PRO 184 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1owo h PRO 184 Cb 0.62 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.73 1owo h PRO 184 CO -0.88 0.00 -0.55 1.28 -0.21 0.00 0.00 178.00 177.65 1owo n LEU 185 N -4.05 0.54 -4.91 2.35 4.77 0.41 -4.96 117.00 111.15 1owo n LEU 185 Ca -0.02 0.09 -0.31 0.00 -0.03 0.00 0.00 56.01 55.74 1owo n LEU 185 Cb 0.12 -0.23 -0.04 0.00 -2.33 0.00 0.00 43.42 40.94 1owo n LEU 185 CO 0.30 0.06 -0.07 -0.76 -1.33 0.00 0.00 177.39 175.59 1owo s LEU 186 N -3.43 4.31 0.04 2.23 1.43 -1.00 -4.52 118.68 117.74 1owo s LEU 186 Ca 0.09 0.41 -0.18 0.00 -1.03 0.00 0.00 54.13 53.42 1owo s LEU 186 Cb 0.16 -3.12 -0.06 0.00 0.03 0.00 0.00 46.19 43.20 1owo s LEU 186 CO 0.70 0.11 0.53 -0.76 0.23 0.00 0.00 176.35 177.16 1owo s LEU 187 N -2.62 4.49 0.39 1.79 1.43 -0.55 -4.97 118.68 118.65 1owo s LEU 187 Ca 0.38 1.15 0.11 0.00 -1.03 0.00 0.00 54.13 54.74 1owo s LEU 187 Cb -0.13 -2.81 0.78 0.00 0.03 0.00 0.00 46.19 44.06 1owo s LEU 187 CO 0.27 0.25 1.88 0.77 0.23 0.00 0.00 176.35 179.75 1owo h SER 188 N 4.83 0.11 -5.11 2.29 4.64 -1.95 -3.43 113.55 114.92 1owo h SER 188 Ca -0.49 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 60.78 1owo h SER 188 Cb 1.21 -0.03 -0.10 0.00 -0.31 0.00 0.00 62.40 63.18 1owo h SER 188 CO 0.64 0.36 0.01 -1.83 -0.87 0.00 0.00 176.83 175.14 1owo s GLU 189 N -4.49 1.42 -0.10 4.77 -1.05 -1.26 -5.10 118.70 112.89 1owo s GLU 189 Ca -0.04 -0.95 -0.30 0.00 -0.15 0.00 0.00 54.97 53.54 1owo s GLU 189 Cb 0.15 0.51 -0.03 0.00 -0.44 0.00 0.00 34.13 34.32 1owo s GLU 189 CO 0.73 -0.60 1.36 -1.17 0.95 0.00 0.00 175.26 176.53 1owo s LEU 190 N -2.90 4.24 0.49 1.83 2.96 -1.26 -4.98 118.68 119.06 1owo s LEU 190 Ca 0.12 1.89 -0.23 0.00 -0.22 0.00 0.00 54.13 55.68 1owo s LEU 190 Cb -0.01 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.07 1owo s LEU 190 CO -0.00 -0.77 1.31 -2.84 -1.32 0.00 0.00 176.35 172.73 1owo s PRO 191 N 3.29 3.48 0.75 0.98 0.02 -1.26 -5.01 135.00 137.25 1owo s PRO 191 Ca 0.60 2.14 -0.11 0.00 0.02 0.00 0.00 61.00 63.65 1owo s PRO 191 Cb -0.26 -2.42 0.05 0.00 0.02 0.00 0.00 34.50 31.89 1owo s PRO 191 CO 0.21 -0.89 1.12 0.95 -0.33 0.00 0.00 177.00 178.06 1owo s THR 192 N -1.34 2.66 0.19 0.99 -4.23 -1.26 -4.89 115.64 107.75 1owo s THR 192 Ca 0.66 0.16 -0.12 0.00 -1.18 0.00 0.00 61.69 61.21 1owo s THR 192 Cb -0.38 -3.20 0.09 0.00 1.34 0.00 0.00 72.50 70.35 1owo s THR 192 CO 0.46 -0.26 1.79 0.25 -0.54 0.00 0.00 174.62 176.31 1owo h LEU 193 N -0.83 0.39 -0.57 4.79 5.85 -1.95 -2.04 115.31 120.95 1owo h LEU 193 Ca -0.45 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.24 1owo h LEU 193 Cb 1.30 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 1owo h LEU 193 CO 0.65 0.26 0.14 0.07 -0.34 0.00 0.00 178.44 179.22 1owo h LYS 194 N 0.52 0.91 -0.20 1.25 2.10 -1.93 -1.54 116.57 117.69 1owo h LYS 194 Ca 0.24 -0.22 -0.01 0.00 -2.00 0.00 0.00 60.65 58.66 1owo h LYS 194 Cb 0.15 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 31.35 1owo h LYS 194 CO -0.17 0.85 0.08 0.37 -2.00 0.00 0.00 179.45 178.58 1owo h GLN 195 N 0.81 0.27 0.00 0.07 5.75 -1.78 0.88 115.11 121.12 1owo h GLN 195 Ca 0.18 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 1owo h GLN 195 Cb 0.34 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.84 1owo h GLN 195 CO 0.00 0.23 0.00 1.28 -2.65 0.00 0.00 178.83 177.69 1owo n LEU 196 N -4.45 0.00 0.00 -2.39 4.77 -0.80 -4.90 117.00 109.22 1owo n LEU 196 Ca -0.00 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1owo n LEU 196 Cb 0.12 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1owo n LEU 196 CO 0.35 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1owo n GLY 197 N 1.17 0.74 3.51 -0.72 0.00 0.30 -5.09 105.19 105.11 1owo n GLY 197 Ca 0.10 -0.47 -0.25 0.00 0.00 0.00 0.00 46.02 45.40 1owo n GLY 197 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1owo s PHE 198 N -2.00 2.35 -0.11 1.61 0.08 -0.62 -5.01 117.98 114.29 1owo s PHE 198 Ca 0.00 -0.41 -0.08 0.00 0.12 0.00 0.00 56.93 56.55 1owo s PHE 198 Cb 0.00 -1.19 0.04 0.00 -0.57 0.00 0.00 43.02 41.29 1owo s PHE 198 CO 0.00 0.65 0.28 0.16 -0.10 0.00 0.00 175.22 176.21 1owo s ASP 199 N -3.56 -0.30 -0.17 1.36 -4.77 -1.26 -3.44 116.67 104.52 1owo s ASP 199 Ca 0.31 0.58 -0.10 0.00 -3.30 0.00 0.00 52.55 50.04 1owo s ASP 199 Cb -0.01 0.53 0.06 0.00 -1.09 0.00 0.00 42.92 42.41 1owo s ASP 199 CO 0.16 -0.13 0.41 0.86 0.70 0.00 0.00 175.17 177.17 1owo s TRP 200 N 0.63 -0.58 -0.00 2.11 -0.11 -1.26 -4.85 118.94 114.88 1owo s TRP 200 Ca -0.04 1.25 0.00 0.00 1.22 0.00 0.00 56.10 58.54 1owo s TRP 200 Cb -0.05 0.25 0.00 0.00 -1.50 0.00 0.00 33.47 32.17 1owo s TRP 200 CO -0.04 -0.32 0.80 -3.47 -4.62 0.00 0.00 176.95 169.30 1owo n ASP 201 N 4.06 0.02 -0.34 5.86 2.03 -1.26 -4.87 116.55 122.05 1owo n ASP 201 Ca -0.22 -1.61 0.14 0.00 0.52 0.00 0.00 54.79 53.62 1owo n ASP 201 Cb 0.55 -0.12 0.62 0.00 -0.72 0.00 0.00 41.12 41.45 1owo n ASP 201 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1owo n GLY 202 N -0.01 -0.28 3.76 0.27 0.00 -1.26 -5.06 105.19 102.61 1owo n GLY 202 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1owo n GLY 202 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1owo n GLY 203 N 1.11 -2.24 3.16 -0.02 0.00 -1.26 -4.45 105.19 101.48 1owo n GLY 203 Ca 0.20 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.57 1owo n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1owo s PHE 204 N -0.38 0.22 0.32 1.61 0.08 -1.26 -4.82 117.98 113.75 1owo s PHE 204 Ca 0.00 -0.61 0.25 0.00 0.12 0.00 0.00 56.93 56.69 1owo s PHE 204 Cb 0.00 -0.14 1.22 0.00 -0.57 0.00 0.00 43.02 43.53 1owo s PHE 204 CO 0.00 -0.45 1.97 -1.35 -0.10 0.00 0.00 175.22 175.29 1owo h PRO 205 N 3.17 0.00 -2.32 0.24 0.11 -1.86 -3.42 132.00 127.92 1owo h PRO 205 Ca -0.33 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.72 1owo h PRO 205 Cb 1.18 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.06 1owo h PRO 205 CO 0.55 0.18 -0.10 0.54 -0.21 0.00 0.00 178.00 178.96 1owo s VAL 206 N -4.00 -0.01 0.54 3.15 0.11 -1.26 -4.83 120.40 114.11 1owo s VAL 206 Ca -0.02 0.03 -0.21 0.00 -2.93 0.00 0.00 61.98 58.86 1owo s VAL 206 Cb 0.12 -0.81 -0.06 0.00 -1.53 0.00 0.00 36.38 34.10 1owo s VAL 206 CO 0.61 0.01 1.05 -0.62 -3.33 0.00 0.00 175.10 172.83 1owo n GLU 207 N 3.81 1.18 -1.70 1.54 -0.58 -1.26 -4.92 120.64 118.71 1owo n GLU 207 Ca -0.19 0.44 -0.38 0.00 -0.42 0.00 0.00 57.16 56.61 1owo n GLU 207 Cb 0.57 -2.22 0.05 0.00 -0.57 0.00 0.00 31.44 29.27 1owo n GLU 207 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1owo n PRO 208 N -0.70 1.31 0.00 3.49 -0.02 -1.26 -4.46 135.00 133.35 1owo n PRO 208 Ca 0.12 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1owo n PRO 208 Cb 0.45 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1owo n PRO 208 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1owo n GLY 209 N 0.97 2.72 0.15 -1.23 0.00 -1.26 -4.59 105.19 101.95 1owo n GLY 209 Ca 0.13 -1.72 -0.06 0.00 0.00 0.00 0.00 46.02 44.36 1owo n GLY 209 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1owo h GLU 210 N 0.00 0.14 -0.17 1.61 4.81 -1.79 -2.03 114.58 117.14 1owo h GLU 210 Ca 0.00 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1owo h GLU 210 Cb 0.00 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1owo h GLU 210 CO 0.00 0.09 -0.04 1.15 -0.73 0.00 0.00 179.01 179.48 1owo h THR 211 N 0.14 0.83 -0.28 0.32 2.02 -1.89 -0.90 112.91 113.16 1owo h THR 211 Ca 0.16 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.28 1owo h THR 211 Cb 0.20 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1owo h THR 211 CO -0.24 0.00 -0.07 0.00 0.37 0.00 0.00 175.52 175.59 1owo h ALA 212 N 1.17 1.38 -0.21 6.16 0.00 -1.78 -1.95 119.26 124.02 1owo h ALA 212 Ca 0.08 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1owo h ALA 212 Cb 0.13 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1owo h ALA 212 CO -0.18 0.43 -0.08 0.00 0.00 0.00 0.00 179.25 179.42 1owo h ALA 213 N 1.52 0.30 -0.43 0.00 0.00 -0.87 -1.74 119.26 118.03 1owo h ALA 213 Ca 0.09 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1owo h ALA 213 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1owo h ALA 213 CO 0.02 0.11 0.07 0.82 0.00 0.00 0.00 179.25 180.26 1owo h ILE 214 N 0.14 1.21 -0.45 0.00 2.04 -0.98 -1.09 117.51 118.38 1owo h ILE 214 Ca 0.05 -0.78 -0.14 0.00 1.00 0.00 0.00 64.86 64.99 1owo h ILE 214 Cb 0.55 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1owo h ILE 214 CO 0.03 0.28 -0.26 0.00 0.00 0.00 0.00 178.15 178.19 1owo h ALA 215 N 1.43 0.68 -0.28 1.87 0.00 -1.26 -2.29 119.26 119.41 1owo h ALA 215 Ca 0.14 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1owo h ALA 215 Cb 0.30 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1owo h ALA 215 CO 0.00 0.67 -0.10 -0.09 0.00 0.00 0.00 179.25 179.74 1owo h ARG 216 N 0.82 0.57 -0.30 0.00 9.65 -0.96 -0.71 114.38 123.45 1owo h ARG 216 Ca 0.10 -0.23 0.05 0.00 -1.10 0.00 0.00 59.98 58.79 1owo h ARG 216 Cb 0.84 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 29.35 1owo h ARG 216 CO 0.07 0.79 -0.00 1.25 2.80 0.00 0.00 179.97 184.88 1owo h LEU 217 N 0.32 -0.13 -0.70 3.80 5.85 -1.17 0.06 115.31 123.35 1owo h LEU 217 Ca 0.07 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 1owo h LEU 217 Cb 0.60 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.72 1owo h LEU 217 CO 0.03 -0.03 0.24 1.56 -0.34 0.00 0.00 178.44 179.90 1owo h GLN 218 N 0.08 1.07 -0.36 1.25 4.20 -1.32 -1.28 115.11 118.77 1owo h GLN 218 Ca 0.14 -0.22 -0.11 0.00 0.06 0.00 0.00 58.65 58.53 1owo h GLN 218 Cb 0.19 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1owo h GLN 218 CO -0.24 0.91 -0.22 0.93 -0.67 0.00 0.00 178.83 179.54 1owo h GLU 219 N 1.02 0.70 -0.10 1.46 5.08 -0.71 -1.51 114.58 120.51 1owo h GLU 219 Ca 0.23 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1owo h GLU 219 Cb 0.27 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 1owo h GLU 219 CO -0.01 0.86 -0.08 0.35 -1.00 0.00 0.00 179.01 179.13 1owo h PHE 220 N 0.62 0.27 0.00 4.33 3.57 -0.80 -3.06 116.94 121.86 1owo h PHE 220 Ca 0.09 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1owo h PHE 220 Cb 0.70 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.38 1owo h PHE 220 CO 0.03 0.62 0.00 0.00 -2.23 0.00 0.00 178.31 176.74 1owo h ASP 222 N 0.00 0.00 0.00 0.00 3.32 -1.21 -3.45 116.42 115.08 1owo h ASP 222 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1owo h ASP 222 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1owo h ASP 222 CO 0.00 0.09 0.00 0.54 -1.72 0.00 0.00 179.24 178.15 1owo n ARG 223 N -3.09 0.00 -0.44 3.56 5.12 -1.03 -4.97 116.66 115.81 1owo n ARG 223 Ca 0.03 0.00 0.37 0.00 -1.93 0.00 0.00 57.85 56.33 1owo n ARG 223 Cb 0.57 0.00 0.70 0.00 -1.16 0.00 0.00 32.46 32.57 1owo n ARG 223 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1owo h ALA 224 N 0.26 3.04 -0.03 7.54 0.00 -1.70 0.30 119.26 128.67 1owo h ALA 224 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1owo h ALA 224 Cb 0.00 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1owo h ALA 224 CO 0.00 -1.51 0.02 0.97 0.00 0.00 0.00 179.25 178.73 1owo h ILE 225 N 0.09 1.01 0.00 0.00 2.10 -1.20 -1.47 117.51 118.04 1owo h ILE 225 Ca 0.71 -0.01 -0.01 0.00 1.08 0.00 0.00 64.86 66.63 1owo h ILE 225 Cb 2.54 0.96 -0.00 0.00 -1.09 0.00 0.00 36.82 39.23 1owo h ILE 225 CO -0.15 0.01 -0.02 0.00 -1.08 0.00 0.00 178.15 176.90 1owo h ALA 226 N 1.98 1.36 -0.30 0.18 0.00 -1.19 -1.61 119.26 119.68 1owo h ALA 226 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1owo h ALA 226 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1owo h ALA 226 CO -0.00 0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.03 1owo n ASP 227 N -3.64 2.80 -0.32 0.00 8.00 -0.57 -4.18 116.55 118.63 1owo n ASP 227 Ca -0.03 -1.88 0.12 0.00 0.71 0.00 0.00 54.79 53.72 1owo n ASP 227 Cb 0.11 -0.20 0.26 0.00 -0.02 0.00 0.00 41.12 41.28 1owo n ASP 227 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1owo h TYR 228 N 2.38 -0.02 -3.62 1.24 3.20 -1.07 -2.34 116.97 116.73 1owo h TYR 228 Ca 0.00 0.07 -0.65 0.00 3.14 0.00 0.00 58.73 61.29 1owo h TYR 228 Cb 0.70 0.16 -0.22 0.00 1.54 0.00 0.00 36.73 38.92 1owo h TYR 228 CO 0.20 -0.38 -0.61 0.34 -1.64 0.00 0.00 178.16 176.07 1owo s ASP 229 N -5.06 5.22 0.00 -2.11 2.15 -1.26 0.41 116.67 116.02 1owo s ASP 229 Ca -0.13 -0.17 0.22 0.00 0.43 0.00 0.00 52.55 52.90 1owo s ASP 229 Cb 0.27 -1.94 0.54 0.00 -0.30 0.00 0.00 42.92 41.50 1owo s ASP 229 CO 0.77 -0.01 1.46 -0.81 -0.17 0.00 0.00 175.17 176.41 1owo n PRO 230 N 4.77 2.47 0.26 4.34 -0.04 -1.23 -4.75 135.00 140.81 1owo n PRO 230 Ca -0.16 -2.25 0.14 0.00 -0.04 0.00 0.00 63.50 61.18 1owo n PRO 230 Cb 0.52 -1.51 0.72 0.00 -0.04 0.00 0.00 33.50 33.19 1owo n PRO 230 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1owo h GLN 231 N 3.99 0.00 0.00 0.54 1.08 -0.88 -0.78 115.11 119.06 1owo h GLN 231 Ca 0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1owo h GLN 231 Cb 0.90 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.32 1owo h GLN 231 CO 0.00 0.00 -0.18 0.07 -0.95 0.00 0.00 178.83 177.77 1owo h ARG 232 N 0.00 0.00 0.00 1.46 0.11 -0.26 -3.11 114.38 112.58 1owo h ARG 232 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1owo h ARG 232 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 1owo h ARG 232 CO 0.00 0.18 0.00 -0.91 0.10 0.00 0.00 179.97 179.34 1owo h ASN 233 N 0.00 0.00 -3.62 0.08 2.35 -1.38 -3.45 115.58 109.56 1owo h ASN 233 Ca -0.00 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 55.06 1owo h ASN 233 Cb 0.57 0.00 -0.27 0.00 0.05 0.00 0.00 38.32 38.68 1owo h ASN 233 CO 0.02 0.00 -0.61 -0.36 -1.65 0.00 0.00 177.43 174.83 1owo s PHE 234 N -3.17 3.18 0.42 1.19 0.08 -1.18 -4.85 117.98 113.66 1owo s PHE 234 Ca 0.09 -1.08 0.14 0.00 0.12 0.00 0.00 56.93 56.20 1owo s PHE 234 Cb 0.11 -2.28 1.02 0.00 -0.57 0.00 0.00 43.02 41.31 1owo s PHE 234 CO 0.55 -0.62 1.95 -1.35 -0.10 0.00 0.00 175.22 175.65 1owo h PRO 235 N 8.25 0.43 -0.20 0.24 0.11 -1.86 -0.90 132.00 138.05 1owo h PRO 235 Ca -0.29 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.73 1owo h PRO 235 Cb 1.11 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1owo h PRO 235 CO 0.61 0.28 -0.18 0.00 -0.21 0.00 0.00 178.00 178.50 1owo h ALA 236 N 1.67 1.32 -2.58 -0.75 0.00 -1.94 -3.43 119.26 113.55 1owo h ALA 236 Ca 0.33 -0.27 -0.52 0.00 0.00 0.00 0.00 54.91 54.45 1owo h ALA 236 Cb 0.67 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1owo h ALA 236 CO -0.10 0.45 0.14 -1.21 0.00 0.00 0.00 179.25 178.53 1owo s GLU 237 N -4.62 4.35 -1.25 0.00 0.41 -0.35 -4.93 118.70 112.32 1owo s GLU 237 Ca -0.06 0.97 -0.06 0.00 -0.41 0.00 0.00 54.97 55.41 1owo s GLU 237 Cb 0.15 -2.98 0.18 0.00 -1.78 0.00 0.00 34.13 29.70 1owo s GLU 237 CO 0.76 0.44 2.03 0.00 -0.49 0.00 0.00 175.26 177.99 1owo n ALA 238 N 0.97 6.00 1.23 5.21 0.00 -1.26 -4.68 120.51 127.97 1owo n ALA 238 Ca -0.03 -4.32 0.13 0.00 0.00 0.00 0.00 53.44 49.22 1owo n ALA 238 Cb 0.50 -2.74 0.29 0.00 0.00 0.00 0.00 19.45 17.51 1owo n ALA 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1owo n GLY 239 N 1.90 0.39 3.99 0.00 0.00 -1.26 -4.95 105.19 105.25 1owo n GLY 239 Ca 0.48 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 1owo n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1owo s THR 240 N -2.07 2.13 0.06 2.61 -4.23 -1.26 -4.48 115.64 108.40 1owo s THR 240 Ca 0.31 -1.14 -0.04 0.00 -1.18 0.00 0.00 61.69 59.64 1owo s THR 240 Cb 0.20 -2.27 -0.28 0.00 1.34 0.00 0.00 72.50 71.49 1owo s THR 240 CO 0.35 0.00 1.09 0.77 -0.54 0.00 0.00 174.62 176.29 1owo h SER 241 N 0.41 0.42 -0.00 3.99 4.64 -1.99 -3.48 113.55 117.54 1owo h SER 241 Ca -0.33 -0.47 -0.00 0.00 -0.47 0.00 0.00 61.79 60.52 1owo h SER 241 Cb 1.29 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1owo h SER 241 CO 0.46 1.37 -0.00 0.61 -0.87 0.00 0.00 176.83 178.40 1owo n GLY 242 N 1.56 0.49 0.14 -0.77 0.00 -1.26 -4.92 105.19 100.42 1owo n GLY 242 Ca -0.10 -0.14 0.14 0.00 0.00 0.00 0.00 46.02 45.93 1owo n GLY 242 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1owo n LEU 243 N -0.00 0.50 -0.27 0.99 4.77 -1.26 -4.07 117.00 117.66 1owo n LEU 243 Ca -0.00 -0.04 -0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1owo n LEU 243 Cb 0.00 -0.14 0.06 0.00 -2.33 0.00 0.00 43.42 41.02 1owo n LEU 243 CO 0.00 0.09 0.67 0.77 -1.33 0.00 0.00 177.39 177.59 1owo h SER 244 N 0.66 -0.94 0.57 -1.43 4.64 -1.99 0.28 113.55 115.34 1owo h SER 244 Ca 0.00 0.24 -0.06 0.00 -0.47 0.00 0.00 61.79 61.51 1owo h SER 244 Cb 0.31 0.55 -0.01 0.00 -0.31 0.00 0.00 62.40 62.94 1owo h SER 244 CO 0.00 -0.28 -0.27 1.55 -0.87 0.00 0.00 176.83 176.97 1owo h PRO 245 N -0.05 0.00 -0.10 4.77 0.13 -1.83 -1.17 132.00 133.75 1owo h PRO 245 Ca 0.33 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.35 1owo h PRO 245 Cb 0.57 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1owo h PRO 245 CO -0.80 0.27 -0.45 0.00 -0.23 0.00 0.00 178.00 176.79 1owo h ALA 246 N 1.73 1.06 0.12 -0.56 0.00 -0.82 -1.90 119.26 118.89 1owo h ALA 246 Ca -0.00 -0.44 -0.28 0.00 0.00 0.00 0.00 54.91 54.19 1owo h ALA 246 Cb 0.62 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1owo h ALA 246 CO 0.03 0.62 -1.35 -0.07 0.00 0.00 0.00 179.25 178.48 1owo h LEU 247 N 0.19 0.39 -0.39 0.00 3.38 -0.53 0.46 115.31 118.82 1owo h LEU 247 Ca 0.01 -0.46 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 1owo h LEU 247 Cb 0.87 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1owo h LEU 247 CO 0.07 1.37 -0.01 0.50 0.09 0.00 0.00 178.44 180.46 1owo h LYS 248 N 0.07 0.70 -0.19 1.13 3.11 -1.16 -3.11 116.57 117.12 1owo h LYS 248 Ca -0.17 -0.23 0.00 0.00 -2.81 0.00 0.00 60.65 57.44 1owo h LYS 248 Cb 1.98 -0.06 0.00 0.00 -1.00 0.00 0.00 32.23 33.15 1owo h LYS 248 CO 0.18 0.80 0.00 1.19 -2.81 0.00 0.00 179.45 178.81 1owo n PHE 249 N -4.44 0.23 -2.21 1.91 3.72 -0.72 -4.81 117.46 111.12 1owo n PHE 249 Ca -0.01 -0.11 -0.12 0.00 -0.05 0.00 0.00 57.45 57.15 1owo n PHE 249 Cb 0.29 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.83 1owo n PHE 249 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1owo n GLY 250 N 1.31 -0.10 0.26 1.37 0.00 -0.69 -1.26 105.19 106.07 1owo n GLY 250 Ca 0.17 -0.37 0.14 0.00 0.00 0.00 0.00 46.02 45.96 1owo n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1owo h ALA 251 N 0.57 1.08 -4.16 4.61 0.00 -0.30 -3.16 119.26 117.89 1owo h ALA 251 Ca -0.29 -0.10 -0.56 0.00 0.00 0.00 0.00 54.91 53.96 1owo h ALA 251 Cb 1.21 -0.02 -0.27 0.00 0.00 0.00 0.00 17.79 18.70 1owo h ALA 251 CO 0.34 0.14 -0.84 -1.50 0.00 0.00 0.00 179.25 177.40 1owo s ILE 252 N -3.84 1.50 0.26 0.00 1.10 -1.02 -4.29 121.20 114.91 1owo s ILE 252 Ca -0.01 -0.98 -0.20 0.00 -0.51 0.00 0.00 60.65 58.95 1owo s ILE 252 Cb 0.11 -1.29 -0.09 0.00 0.15 0.00 0.00 42.46 41.35 1owo s ILE 252 CO 0.58 0.28 0.76 -0.83 -2.11 0.00 0.00 174.94 173.62 1owo s GLY 253 N -0.82 2.59 0.45 1.50 0.00 -1.26 -4.71 107.32 105.07 1owo s GLY 253 Ca 0.07 0.20 0.18 0.00 0.00 0.00 0.00 44.72 45.17 1owo s GLY 253 CO 0.01 0.55 1.96 1.19 0.00 0.00 0.00 173.10 176.81 1owo h ILE 254 N 2.58 0.99 0.03 0.90 6.09 -1.86 -2.38 117.51 123.86 1owo h ILE 254 Ca -0.48 -0.80 -0.22 0.00 -1.37 0.00 0.00 64.86 62.00 1owo h ILE 254 Cb 1.19 1.45 -0.01 0.00 0.47 0.00 0.00 36.82 39.92 1owo h ILE 254 CO 0.65 0.21 -0.97 0.03 -3.07 0.00 0.00 178.15 175.00 1owo h ARG 255 N 0.00 0.20 -0.48 2.19 3.08 -1.89 -2.25 114.38 115.23 1owo h ARG 255 Ca -0.00 -0.25 -0.07 0.00 0.07 0.00 0.00 59.98 59.73 1owo h ARG 255 Cb 0.43 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.54 1owo h ARG 255 CO 0.03 1.02 0.04 1.96 -1.07 0.00 0.00 179.97 181.95 1owo h GLN 256 N 0.09 0.82 -0.18 0.04 4.20 -1.85 -0.87 115.11 117.35 1owo h GLN 256 Ca -0.06 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.41 1owo h GLN 256 Cb 1.64 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 29.33 1owo h GLN 256 CO 0.15 0.85 0.10 0.00 -0.67 0.00 0.00 178.83 179.26 1owo h ALA 257 N 0.94 0.24 -0.72 3.87 0.00 -1.42 -0.56 119.26 121.60 1owo h ALA 257 Ca 0.14 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1owo h ALA 257 Cb 0.45 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1owo h ALA 257 CO 0.02 -0.23 0.27 2.35 0.00 0.00 0.00 179.25 181.66 1owo h TRP 258 N 0.20 1.11 -0.32 0.00 2.91 -1.28 -2.53 115.95 116.04 1owo h TRP 258 Ca 0.07 -0.09 -0.05 0.00 1.13 0.00 0.00 58.89 59.95 1owo h TRP 258 Cb 0.06 -0.33 -0.01 0.00 -0.51 0.00 0.00 29.16 28.37 1owo h TRP 258 CO -0.04 0.86 0.03 0.37 -1.03 0.00 0.00 178.44 178.63 1owo h GLN 259 N 1.04 0.56 -0.82 2.65 4.15 -0.99 -0.22 115.11 121.47 1owo h GLN 259 Ca 0.24 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.50 1owo h GLN 259 Cb 0.24 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.83 1owo h GLN 259 CO -0.02 0.67 0.53 0.00 -1.93 0.00 0.00 178.83 178.08 1owo h ALA 260 N 0.87 1.38 -0.15 3.38 0.00 -0.99 0.14 119.26 123.89 1owo h ALA 260 Ca 0.10 -0.07 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 1owo h ALA 260 Cb 0.40 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1owo h ALA 260 CO 0.01 0.56 -0.77 0.00 0.00 0.00 0.00 179.25 179.05 1owo h ALA 261 N 1.46 0.35 -0.39 0.00 0.00 -1.33 -2.24 119.26 117.11 1owo h ALA 261 Ca 0.30 -0.60 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1owo h ALA 261 Cb -0.10 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1owo h ALA 261 CO -0.06 0.69 -0.13 1.03 0.00 0.00 0.00 179.25 180.78 1owo h SER 262 N 0.52 0.69 0.59 0.00 0.87 -0.55 -1.36 113.55 114.31 1owo h SER 262 Ca -0.05 -0.21 -0.13 0.00 -1.23 0.00 0.00 61.79 60.17 1owo h SER 262 Cb 1.39 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 63.15 1owo h SER 262 CO 0.16 0.84 -0.62 0.00 -0.53 0.00 0.00 176.83 176.68 1owo h ALA 263 N 1.22 0.96 -0.03 6.23 0.00 -0.71 -2.30 119.26 124.63 1owo h ALA 263 Ca 0.11 -0.56 -0.16 0.00 0.00 0.00 0.00 54.91 54.29 1owo h ALA 263 Cb 0.59 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1owo h ALA 263 CO 0.04 0.77 -0.71 0.00 0.00 0.00 0.00 179.25 179.34 1owo h ALA 264 N 1.35 0.75 -0.35 0.00 0.00 -1.03 -1.97 119.26 118.01 1owo h ALA 264 Ca -0.01 -0.63 -0.15 0.00 0.00 0.00 0.00 54.91 54.13 1owo h ALA 264 Cb 1.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1owo h ALA 264 CO 0.08 0.83 -0.36 1.25 0.00 0.00 0.00 179.25 181.06 1owo h HIS 265 N 0.10 1.04 -0.05 0.00 6.17 -1.02 -1.43 115.15 119.96 1owo h HIS 265 Ca -0.02 -0.31 -0.15 0.00 0.71 0.00 0.00 60.37 60.60 1owo h HIS 265 Cb 1.27 -0.22 -0.01 0.00 2.52 0.00 0.00 27.41 30.96 1owo h HIS 265 CO 0.02 1.12 -0.64 0.00 0.71 0.00 0.00 177.93 179.14 1owo h ALA 266 N 0.75 0.84 -0.01 5.26 0.00 -1.39 -3.17 119.26 121.54 1owo h ALA 266 Ca 0.06 -0.57 -0.21 0.00 0.00 0.00 0.00 54.91 54.19 1owo h ALA 266 Cb 0.94 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1owo h ALA 266 CO 0.09 0.76 -0.89 1.25 0.00 0.00 0.00 179.25 180.46 1owo h LEU 267 N 0.13 0.45-10.02 0.00 5.85 -1.30 -3.45 115.31 106.97 1owo h LEU 267 Ca -0.01 -0.35 -0.54 0.00 0.84 0.00 0.00 57.88 57.82 1owo h LEU 267 Cb 1.15 -0.14 0.11 0.00 0.37 0.00 0.00 40.66 42.16 1owo h LEU 267 CO 0.10 1.14 0.59 -0.55 -0.34 0.00 0.00 178.44 179.37 1owo s SER 268 N -7.02 5.67 0.00 1.25 0.15 -0.54 -4.94 113.70 108.26 1owo s SER 268 Ca -0.05 2.66 0.00 0.00 0.70 0.00 0.00 55.95 59.26 1owo s SER 268 Cb 0.09 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1owo s SER 268 CO 0.85 -1.29 0.46 -2.11 1.20 0.00 0.00 173.24 172.35 1owo n ARG 269 N -0.68 -0.91 -3.72 5.44 0.00 -1.26 -4.97 116.66 110.56 1owo n ARG 269 Ca 0.08 -0.46 -0.37 0.00 -0.00 0.00 0.00 57.85 57.10 1owo n ARG 269 Cb 0.45 -0.96 -0.07 0.00 -0.00 0.00 0.00 32.46 31.89 1owo n ARG 269 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1owo s SER 270 N -0.00 6.45 0.08 2.89 0.15 -1.26 -5.02 113.70 116.99 1owo s SER 270 Ca 0.00 0.54 -0.21 0.00 0.70 0.00 0.00 55.95 56.97 1owo s SER 270 Cb 0.00 -2.13 -0.11 0.00 -1.71 0.00 0.00 66.02 62.07 1owo s SER 270 CO 0.00 0.30 1.62 0.44 1.20 0.00 0.00 173.24 176.80 1owo h ASP 271 N 5.51 0.18 -0.84 5.45 3.45 -1.99 -1.28 116.42 126.90 1owo h ASP 271 Ca -0.50 -0.16 0.04 0.00 0.43 0.00 0.00 57.03 56.84 1owo h ASP 271 Cb 1.20 -0.05 -0.05 0.00 -0.56 0.00 0.00 39.33 39.88 1owo h ASP 271 CO 0.65 0.29 0.55 -0.33 -1.57 0.00 0.00 179.24 178.83 1owo h GLU 272 N 0.06 1.01 -0.45 3.56 5.08 -1.95 -0.63 114.58 121.25 1owo h GLU 272 Ca 0.04 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 1owo h GLU 272 Cb 0.16 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1owo h GLU 272 CO -0.00 0.67 -0.24 0.00 -1.00 0.00 0.00 179.01 178.43 1owo h ALA 273 N 1.51 0.71 -0.00 3.43 0.00 -1.68 -1.61 119.26 121.62 1owo h ALA 273 Ca 0.33 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1owo h ALA 273 Cb 0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1owo h ALA 273 CO -0.10 0.67 -0.07 0.00 0.00 0.00 0.00 179.25 179.75 1owo h ARG 274 N 0.81 -0.12 -0.11 0.00 2.47 -0.16 -1.79 114.38 115.49 1owo h ARG 274 Ca 0.10 0.01 0.03 0.00 -1.26 0.00 0.00 59.98 58.86 1owo h ARG 274 Cb 0.81 0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 29.13 1owo h ARG 274 CO 0.07 -0.08 -0.06 -0.97 0.56 0.00 0.00 179.97 179.49 1owo h ASN 275 N -0.12 -0.20 -0.94 7.04 -1.24 -1.05 -1.62 115.58 117.45 1owo h ASN 275 Ca 0.03 0.05 0.16 0.00 0.71 0.00 0.00 56.30 57.24 1owo h ASN 275 Cb 0.16 0.11 -0.08 0.00 0.73 0.00 0.00 38.32 39.23 1owo h ASN 275 CO -0.07 -0.08 0.60 0.28 -1.29 0.00 0.00 177.43 176.86 1owo h SER 276 N -0.06 0.71 0.36 1.15 0.02 -0.99 -0.37 113.55 114.38 1owo h SER 276 Ca 0.06 0.05 -0.19 0.00 -0.84 0.00 0.00 61.79 60.87 1owo h SER 276 Cb 0.15 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1owo h SER 276 CO -0.14 0.33 -0.81 0.40 -1.14 0.00 0.00 176.83 175.47 1owo h ILE 277 N 0.74 1.41 -0.26 3.27 2.04 -0.81 -2.42 117.51 121.48 1owo h ILE 277 Ca 0.49 -2.32 -0.10 0.00 1.00 0.00 0.00 64.86 63.93 1owo h ILE 277 Cb 0.76 2.27 -0.01 0.00 -0.74 0.00 0.00 36.82 39.10 1owo h ILE 277 CO -0.25 0.69 -0.27 0.03 0.00 0.00 0.00 178.15 178.35 1owo h ARG 278 N 0.22 0.50 -0.46 2.37 2.47 -0.30 -1.53 114.38 117.66 1owo h ARG 278 Ca -0.04 -0.20 -0.12 0.00 -1.26 0.00 0.00 59.98 58.36 1owo h ARG 278 Cb 1.41 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.69 1owo h ARG 278 CO 0.13 0.73 -0.19 0.28 0.56 0.00 0.00 179.97 181.48 1owo h VAL 279 N 0.44 1.27 -0.38 2.04 2.07 -1.02 -1.57 116.25 119.10 1owo h VAL 279 Ca 0.06 -1.35 -0.03 0.00 0.82 0.00 0.00 66.70 66.20 1owo h VAL 279 Cb 0.70 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1owo h VAL 279 CO 0.05 0.46 0.10 -0.25 0.02 0.00 0.00 177.57 177.96 1owo h TRP 280 N 0.78 0.63 -0.82 1.57 7.01 -1.16 -2.46 115.95 121.50 1owo h TRP 280 Ca 0.11 -0.07 0.08 0.00 2.11 0.00 0.00 58.89 61.11 1owo h TRP 280 Cb 0.76 -0.18 -0.05 0.00 -2.10 0.00 0.00 29.16 27.59 1owo h TRP 280 CO 0.05 0.61 0.54 1.96 -2.79 0.00 0.00 178.44 178.81 1owo h GLN 281 N 0.48 0.82 0.00 2.65 4.20 -1.13 0.84 115.11 122.96 1owo h GLN 281 Ca 0.12 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 1owo h GLN 281 Cb 0.29 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1owo h GLN 281 CO -0.00 0.54 -0.06 0.37 -0.67 0.00 0.00 178.83 179.01 1owo h GLN 282 N 0.84 0.00 -0.60 1.46 4.15 -0.84 -1.85 115.11 118.27 1owo h GLN 282 Ca 0.37 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.71 1owo h GLN 282 Cb 0.32 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.99 1owo h GLN 282 CO -0.14 0.06 0.09 0.93 -1.93 0.00 0.00 178.83 177.84 1owo h GLU 283 N 0.00 0.99 0.00 1.69 4.39 -0.46 0.06 114.58 121.24 1owo h GLU 283 Ca -0.00 -0.25 -0.08 0.00 0.34 0.00 0.00 59.36 59.37 1owo h GLU 283 Cb 0.54 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1owo h GLU 283 CO 0.01 0.92 -0.39 -0.07 -1.16 0.00 0.00 179.01 178.32 1owo h LEU 284 N 0.93 0.00 -0.26 1.33 3.38 -1.24 -1.49 115.31 117.95 1owo h LEU 284 Ca 0.19 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.95 1owo h LEU 284 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1owo h LEU 284 CO 0.01 0.39 -0.73 0.00 0.09 0.00 0.00 178.44 178.20 1owo h ALA 285 N 1.61 0.43 -0.37 1.53 0.00 -1.00 -2.67 119.26 118.79 1owo h ALA 285 Ca -0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.24 1owo h ALA 285 Cb 0.72 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1owo h ALA 285 CO 0.05 0.71 -0.08 2.35 0.00 0.00 0.00 179.25 182.28 1owo h TRP 286 N 0.48 0.68 -0.51 0.00 7.01 -0.63 -1.60 115.95 121.39 1owo h TRP 286 Ca -0.04 -0.10 -0.01 0.00 2.11 0.00 0.00 58.89 60.85 1owo h TRP 286 Cb 1.34 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 28.19 1owo h TRP 286 CO 0.07 0.70 0.29 -0.09 -2.79 0.00 0.00 178.44 176.62 1owo h ARG 287 N 0.59 0.70 -0.20 2.65 2.43 -1.13 -2.55 114.38 116.86 1owo h ARG 287 Ca 0.11 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 1owo h ARG 287 Cb 0.49 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1owo h ARG 287 CO 0.03 0.53 -0.28 0.93 -1.51 0.00 0.00 179.97 179.67 1owo h GLU 288 N 0.68 0.39 -0.23 0.20 5.08 -1.09 -1.92 114.58 117.70 1owo h GLU 288 Ca 0.18 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1owo h GLU 288 Cb 0.02 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1owo h GLU 288 CO -0.03 0.64 0.12 0.35 -1.00 0.00 0.00 179.01 179.08 1owo h PHE 289 N 0.35 0.22 -0.16 4.33 3.57 -0.91 0.26 116.94 124.60 1owo h PHE 289 Ca 0.05 0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.41 1owo h PHE 289 Cb 0.67 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1owo h PHE 289 CO 0.02 0.13 -0.53 1.88 -2.23 0.00 0.00 178.31 177.57 1owo h TYR 290 N 0.25 0.58 -0.37 0.41 0.05 -1.38 -0.74 116.97 115.78 1owo h TYR 290 Ca 0.09 -0.20 -0.15 0.00 0.05 0.00 0.00 58.73 58.52 1owo h TYR 290 Cb 0.02 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 1owo h TYR 290 CO -0.09 0.90 -0.36 1.96 -1.05 0.00 0.00 178.16 179.52 1owo h GLN 291 N 0.36 0.90 -0.33 4.88 4.20 -1.05 -1.27 115.11 122.80 1owo h GLN 291 Ca 0.01 -0.47 -0.10 0.00 0.06 0.00 0.00 58.65 58.15 1owo h GLN 291 Cb 1.05 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.83 1owo h GLN 291 CO 0.10 1.12 -0.22 0.45 -0.67 0.00 0.00 178.83 179.60 1owo h HIS 292 N 0.71 0.70 -0.43 2.96 3.86 -0.42 -1.83 115.15 120.70 1owo h HIS 292 Ca 0.06 -0.15 -0.02 0.00 -1.16 0.00 0.00 60.37 59.10 1owo h HIS 292 Cb 0.95 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 29.23 1owo h HIS 292 CO 0.06 0.80 0.19 0.00 0.86 0.00 0.00 177.93 179.84 1owo h ALA 293 N 1.20 0.55 -0.74 2.45 0.00 -0.92 0.13 119.26 121.94 1owo h ALA 293 Ca 0.08 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1owo h ALA 293 Cb 0.68 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1owo h ALA 293 CO 0.05 0.13 0.28 1.25 0.00 0.00 0.00 179.25 180.96 1owo h LEU 294 N 0.55 1.03 0.02 0.00 5.85 -1.07 0.32 115.31 122.01 1owo h LEU 294 Ca 0.14 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1owo h LEU 294 Cb 0.15 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.91 1owo h LEU 294 CO -0.02 0.92 -0.01 0.22 -0.34 0.00 0.00 178.44 179.22 1owo h TYR 295 N 1.08 -0.02 -0.14 1.25 3.20 -0.85 -2.66 116.97 118.83 1owo h TYR 295 Ca 0.25 -0.00 -0.17 0.00 3.14 0.00 0.00 58.73 61.94 1owo h TYR 295 Cb 0.23 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 1owo h TYR 295 CO 0.02 0.21 -0.64 0.45 -1.64 0.00 0.00 178.16 176.57 1owo h HIS 296 N -0.26 0.65 -2.22 -3.82 3.86 -0.58 -3.37 115.15 109.41 1owo h HIS 296 Ca -0.00 -0.26 -0.59 0.00 -1.16 0.00 0.00 60.37 58.36 1owo h HIS 296 Cb 0.25 -0.11 -0.41 0.00 1.06 0.00 0.00 27.41 28.19 1owo h HIS 296 CO 0.00 1.00 -0.72 1.19 0.86 0.00 0.00 177.93 180.26 1owo n PHE 297 N -3.91 2.56 0.02 2.45 3.72 0.11 -4.96 117.46 117.46 1owo n PHE 297 Ca -0.04 -4.01 0.22 0.00 -0.05 0.00 0.00 57.45 53.57 1owo n PHE 297 Cb 0.65 -0.49 0.73 0.00 -0.94 0.00 0.00 39.48 39.43 1owo n PHE 297 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1owo h PRO 298 N 4.26 0.00 0.00 -1.08 0.13 -1.65 -0.79 132.00 132.87 1owo h PRO 298 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1owo h PRO 298 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1owo h PRO 298 CO 0.73 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.37 1owo n SER 299 N -3.94 0.48 -0.16 1.44 3.41 -1.26 -1.70 113.62 111.89 1owo n SER 299 Ca 0.10 0.68 0.08 0.00 -0.26 0.00 0.00 58.87 59.48 1owo n SER 299 Cb 0.69 -0.76 0.39 0.00 -0.26 0.00 0.00 64.21 64.27 1owo n SER 299 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1owo h LEU 300 N 0.00 0.59 -2.50 1.04 3.38 -1.43 -0.32 115.31 116.07 1owo h LEU 300 Ca 0.00 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1owo h LEU 300 Cb 0.12 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1owo h LEU 300 CO 0.00 0.37 -0.02 0.00 0.09 0.00 0.00 178.44 178.88 1owo h ALA 301 N 1.63 1.14 0.00 1.53 0.00 -1.56 -2.59 119.26 119.41 1owo h ALA 301 Ca 0.31 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1owo h ALA 301 Cb 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1owo h ALA 301 CO -0.11 0.03 -0.19 -0.44 0.00 0.00 0.00 179.25 178.54 1owo h ASP 302 N 0.00 0.00 -0.64 0.00 3.32 -1.24 -3.49 116.42 114.37 1owo h ASP 302 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1owo h ASP 302 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1owo h ASP 302 CO 0.00 0.19 0.00 0.61 -1.72 0.00 0.00 179.24 178.32 1owo n GLY 303 N 0.30 0.94 2.98 2.75 0.00 -0.98 -5.09 105.19 106.10 1owo n GLY 303 Ca 0.01 -1.92 -0.53 0.00 0.00 0.00 0.00 46.02 43.58 1owo n GLY 303 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1owo n PRO 304 N 0.00 0.00 -0.06 1.61 -0.02 -1.26 -4.75 135.00 130.51 1owo n PRO 304 Ca 0.00 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.42 1owo n PRO 304 Cb 0.00 -1.22 -0.04 0.00 -0.02 0.00 0.00 33.50 32.22 1owo n PRO 304 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1owo h TYR 305 N 3.57 0.00 -3.90 6.00 3.20 -0.75 -3.42 116.97 121.67 1owo h TYR 305 Ca -0.37 0.00 -0.55 0.00 3.14 0.00 0.00 58.73 60.95 1owo h TYR 305 Cb 1.13 0.00 0.12 0.00 1.54 0.00 0.00 36.73 39.52 1owo h TYR 305 CO 0.51 0.34 0.68 0.54 -1.64 0.00 0.00 178.16 178.58 1owo n ARG 306 N -4.68 2.23 -0.23 1.82 1.74 0.79 -4.86 116.66 113.47 1owo n ARG 306 Ca -0.06 0.79 0.02 0.00 -0.77 0.00 0.00 57.85 57.83 1owo n ARG 306 Cb 0.22 -2.60 0.14 0.00 -1.02 0.00 0.00 32.46 29.20 1owo n ARG 306 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1owo h SER 307 N 2.30 0.27 -0.47 0.55 4.64 -1.91 -2.38 113.55 116.55 1owo h SER 307 Ca -0.50 0.09 0.05 0.00 -0.47 0.00 0.00 61.79 60.96 1owo h SER 307 Cb 1.27 0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 63.38 1owo h SER 307 CO 0.61 0.13 0.20 0.25 -0.87 0.00 0.00 176.83 177.15 1owo h LEU 308 N 0.44 0.25 -1.24 5.97 7.12 -1.98 -2.71 115.31 123.16 1owo h LEU 308 Ca 0.36 0.04 -0.03 0.00 0.13 0.00 0.00 57.88 58.38 1owo h LEU 308 Cb 0.48 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.61 1owo h LEU 308 CO -0.35 0.18 -0.12 -0.50 -0.13 0.00 0.00 178.44 177.52 1owo h TRP 309 N 0.39 0.00 0.00 1.25 4.06 -1.81 -2.42 115.95 117.43 1owo h TRP 309 Ca 0.21 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.16 1owo h TRP 309 Cb 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 1owo h TRP 309 CO -0.13 0.12 0.00 1.04 -3.56 0.00 0.00 178.44 175.91 1owo n GLN 310 N -3.27 0.20 -0.00 0.49 6.02 -1.02 -2.57 117.38 117.24 1owo n GLN 310 Ca 0.00 0.42 0.06 0.00 -0.01 0.00 0.00 57.00 57.48 1owo n GLN 310 Cb 0.38 -1.89 -0.08 0.00 1.02 0.00 0.00 30.24 29.67 1owo n GLN 310 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1owo n GLN 311 N -2.27 2.12 -1.55 -1.09 6.02 -0.94 -5.03 117.38 114.65 1owo n GLN 311 Ca 0.02 -0.03 -0.51 0.00 -0.01 0.00 0.00 57.00 56.48 1owo n GLN 311 Cb 0.24 -1.17 -0.05 0.00 1.02 0.00 0.00 30.24 30.28 1owo n GLN 311 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1owo n PHE 312 N -1.46 1.05 -2.56 1.08 7.35 -1.06 -4.83 117.46 117.04 1owo n PHE 312 Ca 0.01 0.76 -0.43 0.00 -0.76 0.00 0.00 57.45 57.03 1owo n PHE 312 Cb 0.24 -2.23 0.00 0.00 0.35 0.00 0.00 39.48 37.84 1owo n PHE 312 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1owo n PRO 313 N 1.73 3.23 -1.92 -7.13 -0.04 -1.26 -4.99 135.00 124.62 1owo n PRO 313 Ca 0.16 -3.37 -0.42 0.00 -0.04 0.00 0.00 63.50 59.84 1owo n PRO 313 Cb 0.22 -3.31 -0.02 0.00 -0.04 0.00 0.00 33.50 30.34 1owo n PRO 313 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1owo s TRP 314 N 3.11 2.95 0.04 0.54 0.52 -1.26 -4.92 118.94 119.92 1owo s TRP 314 Ca 0.49 0.84 -0.20 0.00 0.02 0.00 0.00 56.10 57.25 1owo s TRP 314 Cb 0.04 -3.93 -0.15 0.00 -1.15 0.00 0.00 33.47 28.28 1owo s TRP 314 CO 0.03 -3.16 1.31 1.49 0.02 0.00 0.00 176.95 176.64 1owo h GLU 315 N 5.47 0.40 -5.64 4.98 4.81 -1.77 -3.48 114.58 119.36 1owo h GLU 315 Ca -0.45 -0.25 -0.31 0.00 -0.13 0.00 0.00 59.36 58.22 1owo h GLU 315 Cb 1.21 0.02 0.17 0.00 0.63 0.00 0.00 28.75 30.79 1owo h GLU 315 CO 0.82 0.83 -0.84 0.09 -0.73 0.00 0.00 179.01 179.19 1owo n ASN 316 N -4.47 -4.53 -4.56 1.04 3.02 -1.14 -4.94 115.26 99.67 1owo n ASN 316 Ca -0.06 -0.72 -0.43 0.00 -0.03 0.00 0.00 54.58 53.34 1owo n ASN 316 Cb 0.43 -4.92 -0.04 0.00 -0.61 0.00 0.00 39.78 34.64 1owo n ASN 316 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1owo s ARG 317 N -4.99 3.53 0.23 3.52 0.52 -1.26 -4.91 118.95 115.59 1owo s ARG 317 Ca 0.27 0.17 -0.07 0.00 -0.52 0.00 0.00 55.73 55.58 1owo s ARG 317 Cb -0.04 -3.94 0.40 0.00 0.52 0.00 0.00 34.95 31.88 1owo s ARG 317 CO 0.75 -1.28 1.71 1.49 0.02 0.00 0.00 175.30 177.99 1owo h GLU 318 N 9.13 0.32 -0.92 3.54 4.57 -2.00 -1.39 114.58 127.83 1owo h GLU 318 Ca -0.24 -0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.04 1owo h GLU 318 Cb 1.07 -0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 29.52 1owo h GLU 318 CO 1.05 0.21 0.59 0.00 -1.18 0.00 0.00 179.01 179.68 1owo h ALA 319 N 1.54 1.70 -0.43 2.92 0.00 -1.99 0.12 119.26 123.11 1owo h ALA 319 Ca 0.38 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.18 1owo h ALA 319 Cb 0.59 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1owo h ALA 319 CO -0.43 0.08 -0.22 -0.07 0.00 0.00 0.00 179.25 178.60 1owo h LEU 320 N 0.82 0.90 0.13 0.00 3.38 -1.67 -2.07 115.31 116.81 1owo h LEU 320 Ca 0.45 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1owo h LEU 320 Cb 0.57 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1owo h LEU 320 CO -0.21 1.08 -0.06 0.15 0.09 0.00 0.00 178.44 179.49 1owo h PHE 321 N 0.76 -0.16 -0.55 1.13 3.57 -0.89 -2.14 116.94 118.65 1owo h PHE 321 Ca 0.10 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.70 1owo h PHE 321 Cb 0.77 0.05 -0.08 0.00 2.79 0.00 0.00 35.95 39.48 1owo h PHE 321 CO 0.05 0.10 0.08 1.15 -2.23 0.00 0.00 178.31 177.46 1owo h THR 322 N -0.42 0.65 -0.87 4.41 2.02 -1.01 0.20 112.91 117.90 1owo h THR 322 Ca -0.02 -0.07 0.06 0.00 0.77 0.00 0.00 66.41 67.15 1owo h THR 322 Cb 0.34 0.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.11 1owo h THR 322 CO 0.03 0.04 0.57 0.00 0.37 0.00 0.00 175.52 176.52 1owo h ALA 323 N 1.45 1.53 0.04 6.16 0.00 -1.28 -0.78 119.26 126.39 1owo h ALA 323 Ca 0.28 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1owo h ALA 323 Cb 0.41 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1owo h ALA 323 CO -0.39 0.34 -0.02 2.35 0.00 0.00 0.00 179.25 181.53 1owo h TRP 324 N 0.99 -0.05 0.00 0.00 7.01 -0.02 0.16 115.95 124.04 1owo h TRP 324 Ca 0.37 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.35 1owo h TRP 324 Cb 0.18 0.02 -0.00 0.00 -2.10 0.00 0.00 29.16 27.25 1owo h TRP 324 CO -0.00 0.20 -0.10 1.79 -2.79 0.00 0.00 178.44 177.54 1owo h THR 325 N -0.30 0.91 -0.66 2.65 1.35 -0.44 -2.43 112.91 113.99 1owo h THR 325 Ca -0.01 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1owo h THR 325 Cb 0.28 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1owo h THR 325 CO 0.01 0.10 0.00 0.00 -0.25 0.00 0.00 175.52 175.38 1owo n GLN 326 N -4.18 2.66 -3.10 4.72 6.02 -0.35 -4.95 117.38 118.21 1owo n GLN 326 Ca -0.03 -2.42 -0.23 0.00 -0.01 0.00 0.00 57.00 54.32 1owo n GLN 326 Cb 0.18 -1.56 0.03 0.00 1.02 0.00 0.00 30.24 29.92 1owo n GLN 326 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1owo n ALA 327 N 1.39 -1.01 -1.84 -1.58 0.00 -0.91 -4.90 120.51 111.65 1owo n ALA 327 Ca 0.22 0.27 -0.22 0.00 0.00 0.00 0.00 53.44 53.71 1owo n ALA 327 Cb 0.59 -3.88 0.06 0.00 0.00 0.00 0.00 19.45 16.21 1owo n ALA 327 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1owo n GLN 328 N -4.07 3.21 0.13 0.00 1.13 0.51 -4.72 117.38 113.56 1owo n GLN 328 Ca -0.10 -3.90 0.02 0.00 -1.94 0.00 0.00 57.00 51.08 1owo n GLN 328 Cb 0.61 -2.20 0.01 0.00 0.11 0.00 0.00 30.24 28.77 1owo n GLN 328 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1owo h THR 329 N 1.83 0.88 0.00 5.09 1.35 -1.90 -3.45 112.91 116.71 1owo h THR 329 Ca 0.37 -2.26 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 1owo h THR 329 Cb 1.40 2.42 0.00 0.00 -1.73 0.00 0.00 68.15 70.24 1owo h THR 329 CO 0.81 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 177.20 1owo n GLY 330 N 1.24 0.80 3.27 5.82 0.00 -1.26 -0.61 105.19 114.46 1owo n GLY 330 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1owo n GLY 330 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1owo s TYR 331 N -2.53 3.34 0.18 1.61 1.51 -1.26 -4.19 117.35 116.01 1owo s TYR 331 Ca 0.00 -1.53 -0.25 0.00 -1.01 0.00 0.00 57.07 54.28 1owo s TYR 331 Cb 0.00 -3.27 0.04 0.00 -0.11 0.00 0.00 41.96 38.62 1owo s TYR 331 CO 0.00 -0.91 1.50 -2.30 -1.11 0.00 0.00 175.55 172.73 1owo n PRO 332 N 5.00 -0.36 0.04 -1.71 -0.02 -1.26 -0.81 135.00 135.89 1owo n PRO 332 Ca -0.10 1.48 0.14 0.00 -2.02 0.00 0.00 63.50 63.00 1owo n PRO 332 Cb 0.42 -2.18 0.61 0.00 -0.02 0.00 0.00 33.50 32.33 1owo n PRO 332 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1owo h ILE 333 N 0.00 0.87 0.04 4.25 6.09 -1.93 -0.05 117.51 126.78 1owo h ILE 333 Ca 0.22 -0.05 -0.10 0.00 -1.37 0.00 0.00 64.86 63.56 1owo h ILE 333 Cb 0.46 0.71 0.01 0.00 0.47 0.00 0.00 36.82 38.48 1owo h ILE 333 CO -0.93 0.03 -0.42 0.58 -3.07 0.00 0.00 178.15 174.33 1owo h VAL 334 N 0.14 1.57 -0.17 2.19 2.07 -1.37 -3.14 116.25 117.53 1owo h VAL 334 Ca 0.19 -2.23 -0.11 0.00 0.82 0.00 0.00 66.70 65.37 1owo h VAL 334 Cb 0.57 3.01 -0.01 0.00 -1.52 0.00 0.00 31.29 33.34 1owo h VAL 334 CO -0.02 0.62 -0.37 0.44 0.02 0.00 0.00 177.57 178.26 1owo h ASP 335 N -0.51 0.38 -0.54 0.57 3.32 -0.73 -1.45 116.42 117.46 1owo h ASP 335 Ca -0.07 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 56.76 1owo h ASP 335 Cb 1.25 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.67 1owo h ASP 335 CO 0.08 0.72 0.07 0.00 -1.72 0.00 0.00 179.24 178.39 1owo h ALA 336 N 1.30 1.03 -0.11 3.45 0.00 -1.15 -1.39 119.26 122.39 1owo h ALA 336 Ca 0.03 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1owo h ALA 336 Cb 0.79 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1owo h ALA 336 CO 0.06 0.61 -0.17 0.00 0.00 0.00 0.00 179.25 179.76 1owo h ALA 337 N 1.18 0.17 0.00 0.00 0.00 -1.43 -2.16 119.26 117.01 1owo h ALA 337 Ca 0.18 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1owo h ALA 337 Cb 0.42 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1owo h ALA 337 CO 0.01 0.08 -0.17 0.52 0.00 0.00 0.00 179.25 179.69 1owo h MET 338 N -0.11 0.00 -0.18 0.00 2.07 -1.21 -1.61 114.93 113.90 1owo h MET 338 Ca 0.01 0.00 -0.20 0.00 -2.07 0.00 0.00 59.70 57.44 1owo h MET 338 Cb 0.73 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 30.47 1owo h MET 338 CO 0.04 0.17 -0.66 0.00 1.07 0.00 0.00 176.91 177.53 1owo h ARG 339 N 0.00 0.76 -0.97 1.72 2.47 -1.18 -2.27 114.38 114.90 1owo h ARG 339 Ca -0.00 -0.58 0.01 0.00 -1.26 0.00 0.00 59.98 58.15 1owo h ARG 339 Cb 0.34 0.11 -0.05 0.00 -1.65 0.00 0.00 29.97 28.72 1owo h ARG 339 CO 0.02 1.19 0.64 0.37 0.56 0.00 0.00 179.97 182.75 1owo h GLN 340 N 0.48 1.29 0.60 0.04 4.15 -0.69 -0.42 115.11 120.56 1owo h GLN 340 Ca -0.03 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.27 1owo h GLN 340 Cb 1.28 -0.29 0.01 0.00 0.21 0.00 0.00 27.48 28.69 1owo h GLN 340 CO 0.14 0.86 -0.29 1.25 -1.93 0.00 0.00 178.83 178.87 1owo h LEU 341 N 1.33 -0.68 -1.69 -2.39 5.85 -1.24 0.81 115.31 117.29 1owo h LEU 341 Ca 0.36 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 1owo h LEU 341 Cb -0.14 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1owo h LEU 341 CO -0.07 -0.34 -0.15 0.71 -0.34 0.00 0.00 178.44 178.24 1owo h THR 342 N -1.03 0.58 0.08 1.05 1.35 -1.36 0.37 112.91 113.95 1owo h THR 342 Ca -0.08 -0.71 -0.33 0.00 -0.55 0.00 0.00 66.41 64.74 1owo h THR 342 Cb 0.67 1.46 -0.03 0.00 -1.73 0.00 0.00 68.15 68.53 1owo h THR 342 CO 0.13 0.15 -1.79 -0.33 -0.25 0.00 0.00 175.52 173.44 1owo h GLU 343 N 0.00 0.18 -0.00 4.72 5.08 -1.05 -3.41 114.58 120.09 1owo h GLU 343 Ca -0.00 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1owo h GLU 343 Cb 0.45 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1owo h GLU 343 CO 0.02 0.95 -0.04 0.25 -1.00 0.00 0.00 179.01 179.20 1owo n THR 344 N -3.33 0.00 -1.12 1.13 -2.24 0.27 -4.28 114.28 104.70 1owo n THR 344 Ca -0.23 -0.48 -0.04 0.00 -2.27 0.00 0.00 64.05 61.02 1owo n THR 344 Cb 1.05 1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 70.28 1owo n THR 344 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1owo n GLY 345 N 0.52 0.68 3.21 3.38 0.00 0.13 -4.62 105.19 108.50 1owo n GLY 345 Ca 0.01 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1owo n GLY 345 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1owo s TRP 346 N -1.99 -0.01 -0.10 1.61 -0.00 -1.25 0.18 118.94 117.38 1owo s TRP 346 Ca 0.00 -0.19 -0.07 0.00 -0.00 0.00 0.00 56.10 55.84 1owo s TRP 346 Cb 0.00 0.03 0.04 0.00 -0.00 0.00 0.00 33.47 33.53 1owo s TRP 346 CO 0.00 -0.47 0.25 1.41 -0.00 0.00 0.00 176.95 178.13 1owo s MET 347 N -2.67 0.24 0.32 5.86 -2.45 -1.26 -3.35 119.30 115.99 1owo s MET 347 Ca -0.04 0.44 -0.29 0.00 -1.25 0.00 0.00 55.69 54.55 1owo s MET 347 Cb -0.00 -0.00 -0.12 0.00 1.25 0.00 0.00 34.83 35.95 1owo s MET 347 CO -0.04 -0.10 1.38 1.58 1.05 0.00 0.00 175.02 178.88 1owo n HIS 348 N 3.64 2.45 -0.25 4.11 -0.00 -1.26 -4.73 115.22 119.19 1owo n HIS 348 Ca -0.20 0.48 0.05 0.00 0.46 0.00 0.00 57.72 58.51 1owo n HIS 348 Cb 0.55 -2.46 0.18 0.00 -0.12 0.00 0.00 29.99 28.14 1owo n HIS 348 CO 0.00 0.00 0.00 -0.97 0.46 0.00 0.00 176.34 175.83 1owo h ASN 349 N 3.16 0.15 -0.92 0.26 -0.73 -1.99 0.39 115.58 115.90 1owo h ASN 349 Ca -0.47 0.12 0.06 0.00 1.87 0.00 0.00 56.30 57.89 1owo h ASN 349 Cb 1.27 0.13 -0.06 0.00 0.27 0.00 0.00 38.32 39.93 1owo h ASN 349 CO 0.67 0.04 0.60 -0.09 -0.37 0.00 0.00 177.43 178.28 1owo h ARG 350 N 0.36 1.04 -0.16 6.67 9.65 -1.90 -0.99 114.38 129.05 1owo h ARG 350 Ca 0.40 -0.06 -0.14 0.00 -1.10 0.00 0.00 59.98 59.08 1owo h ARG 350 Cb 0.64 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 1owo h ARG 350 CO -0.44 0.69 -0.51 0.00 2.80 0.00 0.00 179.97 182.50 1owo h ARG 352 N 0.35 1.04 -0.37 0.00 3.08 0.10 -0.93 114.38 117.66 1owo h ARG 352 Ca 0.01 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 59.87 1owo h ARG 352 Cb 1.02 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1owo h ARG 352 CO 0.09 0.78 -0.01 0.52 -1.07 0.00 0.00 179.97 180.28 1owo h MET 353 N 1.04 0.66 0.06 0.04 2.86 -1.11 -1.76 114.93 116.71 1owo h MET 353 Ca 0.26 -0.22 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1owo h MET 353 Cb 0.07 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1owo h MET 353 CO -0.04 0.77 -0.03 0.82 1.06 0.00 0.00 176.91 179.49 1owo h ILE 354 N 0.47 1.06 -0.02 -1.22 2.04 -0.97 -1.49 117.51 117.38 1owo h ILE 354 Ca 0.10 -0.41 -0.09 0.00 1.00 0.00 0.00 64.86 65.46 1owo h ILE 354 Cb 0.48 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1owo h ILE 354 CO 0.02 0.10 -0.41 -0.37 0.00 0.00 0.00 178.15 177.50 1owo h VAL 355 N -0.27 1.30 -0.17 1.67 -1.51 -1.22 -0.58 116.25 115.47 1owo h VAL 355 Ca -0.01 -1.43 -0.09 0.00 -1.23 0.00 0.00 66.70 63.95 1owo h VAL 355 Cb 0.23 1.74 -0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1owo h VAL 355 CO 0.01 0.41 -0.24 0.00 -1.23 0.00 0.00 177.57 176.53 1owo h ALA 356 N 1.55 0.25 -0.49 5.19 0.00 -1.27 -1.53 119.26 122.96 1owo h ALA 356 Ca 0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1owo h ALA 356 Cb 0.74 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1owo h ALA 356 CO 0.05 0.22 0.26 1.03 0.00 0.00 0.00 179.25 180.81 1owo h SER 357 N 0.09 0.63 0.05 0.00 0.87 -1.12 -1.69 113.55 112.38 1owo h SER 357 Ca 0.02 -0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.49 1owo h SER 357 Cb 0.81 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.58 1owo h SER 357 CO 0.06 0.56 -0.13 0.15 -0.53 0.00 0.00 176.83 176.93 1owo h PHE 358 N 0.66 -0.35 -0.89 2.24 3.57 -1.05 0.55 116.94 121.67 1owo h PHE 358 Ca 0.17 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.72 1owo h PHE 358 Cb 0.08 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 1owo h PHE 358 CO -0.01 -0.20 0.58 1.25 -2.23 0.00 0.00 178.31 177.69 1owo h LEU 359 N -0.25 0.95 0.10 0.59 5.85 -1.12 0.32 115.31 121.75 1owo h LEU 359 Ca 0.03 -0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.58 1owo h LEU 359 Cb 0.28 -0.21 0.01 0.00 0.37 0.00 0.00 40.66 41.11 1owo h LEU 359 CO -0.10 0.65 -0.79 0.74 -0.34 0.00 0.00 178.44 178.60 1owo h THR 360 N 1.11 1.44 0.13 1.05 2.02 -0.99 -2.11 112.91 115.55 1owo h THR 360 Ca 0.36 -2.45 -0.26 0.00 0.77 0.00 0.00 66.41 64.83 1owo h THR 360 Cb 0.02 3.09 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 1owo h THR 360 CO -0.12 0.67 -1.32 0.11 0.37 0.00 0.00 175.52 175.23 1owo h LYS 361 N -0.53 0.27 0.00 6.66 1.79 0.08 -3.10 116.57 121.73 1owo h LYS 361 Ca -0.16 -0.46 -0.05 0.00 -2.18 0.00 0.00 60.65 57.81 1owo h LYS 361 Cb 1.51 0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 32.32 1owo h LYS 361 CO 0.08 1.22 -0.34 -0.44 -1.08 0.00 0.00 179.45 178.89 1owo h ASP 362 N -0.29 0.00 1.79 0.86 5.19 -1.07 -3.38 116.42 119.51 1owo h ASP 362 Ca -0.27 -0.47 0.00 0.00 -0.62 0.00 0.00 57.03 55.67 1owo h ASP 362 Cb 1.76 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.27 1owo h ASP 362 CO 0.09 0.92 0.00 -0.07 -3.12 0.00 0.00 179.24 177.06 1owo h LEU 363 N -1.00 0.00 -1.43 1.55 3.38 -1.23 -3.46 115.31 113.12 1owo h LEU 363 Ca -0.07 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.48 1owo h LEU 363 Cb 0.71 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.51 1owo h LEU 363 CO -0.04 0.00 -0.78 -0.38 0.09 0.00 0.00 178.44 177.32 1owo n ILE 364 N -2.95 -3.86 -4.14 1.22 5.41 -0.88 -4.69 119.36 109.46 1owo n ILE 364 Ca 0.04 -0.31 -0.35 0.00 1.00 0.00 0.00 62.75 63.13 1owo n ILE 364 Cb 0.48 -3.73 -0.09 0.00 -0.71 0.00 0.00 39.64 35.59 1owo n ILE 364 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1owo s ILE 365 N -3.48 4.75 -0.40 1.39 -1.09 -0.85 -2.17 121.20 119.34 1owo s ILE 365 Ca 0.25 -0.07 -0.43 0.00 -2.23 0.00 0.00 60.65 58.17 1owo s ILE 365 Cb -0.12 -3.06 -0.17 0.00 -1.58 0.00 0.00 42.46 37.52 1owo s ILE 365 CO 0.79 0.57 1.78 -0.67 -1.23 0.00 0.00 174.94 176.18 1owo n ASP 366 N 2.51 1.68 0.15 3.58 -0.08 -1.26 -4.46 116.55 118.67 1owo n ASP 366 Ca -0.18 1.01 0.09 0.00 -1.51 0.00 0.00 54.79 54.20 1owo n ASP 366 Cb 0.54 -1.01 0.49 0.00 2.34 0.00 0.00 41.12 43.47 1owo n ASP 366 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 1owo n TRP 367 N 5.49 0.61 0.24 -0.67 4.27 -1.26 -1.54 117.44 124.57 1owo n TRP 367 Ca 0.33 0.32 0.07 0.00 -3.89 0.00 0.00 57.50 54.33 1owo n TRP 367 Cb 0.04 -0.97 0.56 0.00 -1.36 0.00 0.00 31.31 29.58 1owo n TRP 367 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1owo h ARG 368 N 0.00 0.00 -0.25 -2.67 3.08 -1.97 0.49 114.38 113.05 1owo h ARG 368 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 1owo h ARG 368 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1owo h ARG 368 CO 0.00 0.12 -0.18 0.00 -1.07 0.00 0.00 179.97 178.85 1owo h ARG 369 N 0.00 0.45 0.05 0.04 2.47 -1.63 -1.45 114.38 114.31 1owo h ARG 369 Ca -0.00 -0.14 -0.22 0.00 -1.26 0.00 0.00 59.98 58.36 1owo h ARG 369 Cb 0.22 -0.04 0.02 0.00 -1.65 0.00 0.00 29.97 28.52 1owo h ARG 369 CO 0.02 0.61 -0.90 0.78 0.56 0.00 0.00 179.97 181.04 1owo h GLY 370 N 0.95 0.58 0.60 0.04 0.00 -1.30 -1.77 103.07 102.17 1owo h GLY 370 Ca 0.07 -1.12 0.09 0.00 0.00 0.00 0.00 47.33 46.37 1owo h GLY 370 CO 0.04 0.99 0.55 -2.09 0.00 0.00 0.00 176.54 176.02 1owo h GLU 371 N 0.07 0.91 -0.34 4.80 4.81 -0.80 0.17 114.58 124.21 1owo h GLU 371 Ca -0.13 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 58.88 1owo h GLU 371 Cb 1.60 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 30.77 1owo h GLU 371 CO 0.17 0.60 -0.46 0.37 -0.73 0.00 0.00 179.01 178.97 1owo h GLN 372 N 0.94 0.90 -0.44 1.92 4.15 -1.27 -1.85 115.11 119.47 1owo h GLN 372 Ca 0.42 -0.52 -0.07 0.00 0.77 0.00 0.00 58.65 59.25 1owo h GLN 372 Cb 0.30 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 1owo h GLN 372 CO -0.22 1.16 -0.01 0.35 -1.93 0.00 0.00 178.83 178.18 1owo h PHE 373 N 0.72 0.76 -0.30 3.99 3.57 -0.38 -0.14 116.94 125.16 1owo h PHE 373 Ca 0.04 -0.10 -0.06 0.00 3.53 0.00 0.00 57.97 61.38 1owo h PHE 373 Cb 1.06 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 1owo h PHE 373 CO 0.07 0.72 -0.04 0.74 -2.23 0.00 0.00 178.31 177.57 1owo h PHE 374 N 0.67 0.61 -0.04 0.41 -1.00 -0.91 -2.69 116.94 114.00 1owo h PHE 374 Ca 0.13 -0.12 -0.03 0.00 2.81 0.00 0.00 57.97 60.76 1owo h PHE 374 Cb 0.44 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.84 1owo h PHE 374 CO 0.02 0.72 -0.11 0.52 -1.61 0.00 0.00 178.31 177.85 1owo h MET 375 N 0.33 0.05 0.00 1.51 2.86 -0.97 0.35 114.93 119.06 1owo h MET 375 Ca 0.08 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1owo h MET 375 Cb 0.51 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.16 1owo h MET 375 CO 0.02 0.17 0.00 1.04 1.06 0.00 0.00 176.91 179.20 1owo n GLN 376 N -4.38 0.62 0.00 1.72 6.02 -0.10 -3.52 117.38 117.75 1owo n GLN 376 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1owo n GLN 376 Cb 0.20 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1owo n GLN 376 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1owo n HIS 377 N -1.18 0.00 -2.48 1.08 8.25 -0.59 -4.22 115.22 116.07 1owo n HIS 377 Ca 0.17 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.21 1owo n HIS 377 Cb 0.19 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.27 1owo n HIS 377 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1owo s LEU 378 N -0.86 4.35 0.46 2.41 1.43 0.11 -4.41 118.68 122.17 1owo s LEU 378 Ca 0.00 1.91 0.31 0.00 -1.03 0.00 0.00 54.13 55.32 1owo s LEU 378 Cb 0.00 -3.57 1.30 0.00 0.03 0.00 0.00 46.19 43.94 1owo s LEU 378 CO 0.00 -0.46 1.91 1.62 0.23 0.00 0.00 176.35 179.65 1owo h VAL 379 N 4.68 0.00 -0.30 -1.59 3.04 -0.58 -1.96 116.25 119.53 1owo h VAL 379 Ca -0.40 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 64.90 1owo h VAL 379 Cb 1.20 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 31.78 1owo h VAL 379 CO 0.82 0.00 0.00 -0.90 -1.01 0.00 0.00 177.57 176.48 1owo n ASP 380 N -2.81 3.16 -4.00 3.17 5.68 -1.26 -4.59 116.55 115.90 1owo n ASP 380 Ca 0.01 -2.31 -0.57 0.00 -0.50 0.00 0.00 54.79 51.42 1owo n ASP 380 Cb 0.27 -0.31 -0.11 0.00 -1.14 0.00 0.00 41.12 39.82 1owo n ASP 380 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1owo n GLY 381 N 0.15 -0.09 2.77 6.12 0.00 -0.74 -4.89 105.19 108.52 1owo n GLY 381 Ca 0.14 1.02 -0.24 0.00 0.00 0.00 0.00 46.02 46.94 1owo n GLY 381 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1owo s ASP 382 N 5.09 1.79 0.16 1.61 2.15 -1.26 -5.06 116.67 121.16 1owo s ASP 382 Ca 1.09 -0.20 -0.25 0.00 0.43 0.00 0.00 52.55 53.62 1owo s ASP 382 Cb -1.38 -0.48 0.03 0.00 -0.30 0.00 0.00 42.92 40.79 1owo s ASP 382 CO 0.63 -0.21 1.58 0.25 -0.17 0.00 0.00 175.17 177.26 1owo h LEU 383 N 8.31 -1.31 -0.24 -1.34 5.85 -1.97 0.98 115.31 125.60 1owo h LEU 383 Ca -0.20 0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.78 1owo h LEU 383 Cb 1.12 0.59 -0.04 0.00 0.37 0.00 0.00 40.66 42.70 1owo h LEU 383 CO 0.28 -0.35 -0.04 0.00 -0.34 0.00 0.00 178.44 177.99 1owo h ALA 384 N 0.58 0.18 -0.06 1.25 0.00 -1.97 0.35 119.26 119.59 1owo h ALA 384 Ca 0.16 0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.98 1owo h ALA 384 Cb 0.57 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.54 1owo h ALA 384 CO -0.58 -0.46 -0.66 0.00 0.00 0.00 0.00 179.25 177.55 1owo h ALA 385 N 1.23 0.16 -0.22 0.00 0.00 -1.77 -0.95 119.26 117.72 1owo h ALA 385 Ca 0.12 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1owo h ALA 385 Cb 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1owo h ALA 385 CO -0.23 0.46 0.01 -0.97 0.00 0.00 0.00 179.25 178.52 1owo h ASN 386 N 0.15 0.37 -0.25 0.00 -1.24 0.11 0.31 115.58 115.03 1owo h ASN 386 Ca -0.07 -0.29 -0.08 0.00 0.71 0.00 0.00 56.30 56.57 1owo h ASN 386 Cb 1.33 -0.10 -0.02 0.00 0.73 0.00 0.00 38.32 40.26 1owo h ASN 386 CO 0.13 0.57 -0.10 -1.13 -1.29 0.00 0.00 177.43 175.61 1owo h ASN 387 N 0.16 0.62 -0.57 1.15 -0.73 -0.39 -1.28 115.58 114.54 1owo h ASN 387 Ca 0.06 -0.17 -0.10 0.00 1.87 0.00 0.00 56.30 57.97 1owo h ASN 387 Cb 0.37 -0.17 -0.02 0.00 0.27 0.00 0.00 38.32 38.77 1owo h ASN 387 CO 0.01 0.76 -0.02 1.23 -0.37 0.00 0.00 177.43 179.04 1owo h GLY 388 N 0.96 1.12 1.06 1.57 0.00 -0.86 -0.24 103.07 106.67 1owo h GLY 388 Ca 0.11 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.54 1owo h GLY 388 CO 0.03 0.76 0.14 -1.33 0.00 0.00 0.00 176.54 176.14 1owo h GLY 389 N 0.99 1.20 1.59 4.60 0.00 0.23 -2.23 103.07 109.44 1owo h GLY 389 Ca 0.17 -0.77 -0.27 0.00 0.00 0.00 0.00 47.33 46.45 1owo h GLY 389 CO 0.03 0.72 -1.22 1.49 0.00 0.00 0.00 176.54 177.55 1owo h TRP 390 N 1.04 0.56 -0.35 5.60 4.06 -1.11 -2.86 115.95 122.89 1owo h TRP 390 Ca 0.21 -0.39 -0.02 0.00 2.06 0.00 0.00 58.89 60.75 1owo h TRP 390 Cb 0.40 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.52 1owo h TRP 390 CO 0.03 1.29 0.14 1.96 -3.56 0.00 0.00 178.44 178.30 1owo h GLN 391 N 0.10 0.48 -0.88 0.49 1.08 -1.04 -1.45 115.11 113.90 1owo h GLN 391 Ca -0.14 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 56.98 1owo h GLN 391 Cb 1.94 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 29.23 1owo h GLN 391 CO 0.21 0.41 0.46 2.35 -0.95 0.00 0.00 178.83 181.30 1owo h TRP 392 N 0.49 1.23 0.00 2.96 7.01 -1.29 0.87 115.95 127.22 1owo h TRP 392 Ca 0.12 -0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.08 1owo h TRP 392 Cb 0.11 -0.39 0.00 0.00 -2.10 0.00 0.00 29.16 26.78 1owo h TRP 392 CO 0.00 0.87 0.00 -1.13 -2.79 0.00 0.00 178.44 175.39 1owo n SER 393 N -4.32 0.00 0.00 2.65 3.41 -0.55 -2.26 113.62 112.55 1owo n SER 393 Ca 0.09 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 1owo n SER 393 Cb 0.12 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1owo n SER 393 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1owo n ALA 394 N -1.17 0.57 -3.69 7.33 0.00 -0.93 -4.77 120.51 117.85 1owo n ALA 394 Ca 0.02 -0.22 -0.28 0.00 0.00 0.00 0.00 53.44 52.97 1owo n ALA 394 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.47 1owo n ALA 394 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1owo n SER 395 N 0.00 -4.00 -0.73 0.00 7.64 0.18 -4.83 113.62 111.87 1owo n SER 395 Ca 0.00 -0.63 0.13 0.00 1.01 0.00 0.00 58.87 59.38 1owo n SER 395 Cb 0.39 -3.26 0.32 0.00 -1.01 0.00 0.00 64.21 60.65 1owo n SER 395 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1owo n SER 396 N -2.52 2.26 0.00 6.43 3.41 -0.50 -4.77 113.62 117.93 1owo n SER 396 Ca 0.02 -1.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.87 1owo n SER 396 Cb 0.53 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1owo n SER 396 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1owo n GLY 397 N 1.27 3.33 3.80 5.00 0.00 -1.25 -0.00 105.19 117.33 1owo n GLY 397 Ca 0.17 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 1owo n GLY 397 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1owo s MET 398 N 3.37 2.58 -0.95 1.61 -1.94 -1.26 -4.31 119.30 118.40 1owo s MET 398 Ca 0.00 1.01 -0.26 0.00 -1.71 0.00 0.00 55.69 54.74 1owo s MET 398 Cb 0.00 -1.94 0.04 0.00 2.01 0.00 0.00 34.83 34.93 1owo s MET 398 CO 0.00 -1.37 0.54 -3.47 -0.01 0.00 0.00 175.02 170.71 1owo n ASP 399 N -3.32 -3.36 -4.76 3.03 2.03 0.10 -4.88 116.55 105.39 1owo n ASP 399 Ca 0.08 -1.03 -0.35 0.00 0.52 0.00 0.00 54.79 54.01 1owo n ASP 399 Cb 0.54 -1.27 0.02 0.00 -0.72 0.00 0.00 41.12 39.68 1owo n ASP 399 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1owo s PRO 400 N -6.73 3.08 0.13 -0.67 0.04 -1.26 -4.97 135.00 124.61 1owo s PRO 400 Ca 0.36 1.65 0.04 0.00 0.04 0.00 0.00 61.00 63.09 1owo s PRO 400 Cb -0.20 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1owo s PRO 400 CO 0.78 -1.08 -0.11 0.15 0.04 0.00 0.00 177.00 176.79 1owo s LYS 401 N -3.47 1.00 0.49 4.56 -0.14 -1.26 -5.12 119.74 115.80 1owo s LYS 401 Ca 0.73 -1.35 -0.21 0.00 -1.36 0.00 0.00 55.97 53.78 1owo s LYS 401 Cb -0.26 -0.63 -0.09 0.00 -1.68 0.00 0.00 37.83 35.17 1owo s LYS 401 CO 0.32 0.09 0.78 -2.30 -0.76 0.00 0.00 175.35 173.48 1owo n PRO 402 N 0.09 0.88 -1.59 -1.68 -0.02 -1.26 -4.82 135.00 126.60 1owo n PRO 402 Ca -0.12 0.33 -0.47 0.00 -2.02 0.00 0.00 63.50 61.21 1owo n PRO 402 Cb 0.59 -1.87 -0.03 0.00 -0.02 0.00 0.00 33.50 32.17 1owo n PRO 402 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1owo n LEU 403 N 0.40 1.81 -3.64 2.45 7.94 -1.26 -4.98 117.00 119.73 1owo n LEU 403 Ca 0.11 1.15 -0.15 0.00 -1.11 0.00 0.00 56.01 56.01 1owo n LEU 403 Cb 0.43 -1.27 -0.07 0.00 0.53 0.00 0.00 43.42 43.04 1owo n LEU 403 CO 0.53 -1.22 0.23 -0.60 -1.11 0.00 0.00 177.39 175.22 1owo s ARG 404 N -0.71 0.87 -0.07 1.96 3.52 -1.26 -5.16 118.95 118.10 1owo s ARG 404 Ca 0.68 -0.00 -0.00 0.00 -0.13 0.00 0.00 55.73 56.27 1owo s ARG 404 Cb -0.78 0.40 0.03 0.00 -1.56 0.00 0.00 34.95 33.04 1owo s ARG 404 CO 0.54 -0.27 -0.03 0.42 -0.81 0.00 0.00 175.30 175.16 1owo s ILE 405 N -1.39 0.56 0.49 4.11 1.01 -1.26 -5.03 121.20 119.69 1owo s ILE 405 Ca -0.12 -0.03 -0.22 0.00 0.00 0.00 0.00 60.65 60.28 1owo s ILE 405 Cb -0.02 -0.65 -0.07 0.00 0.01 0.00 0.00 42.46 41.73 1owo s ILE 405 CO 0.06 0.27 1.17 -0.36 0.00 0.00 0.00 174.94 176.09 1owo s PHE 406 N 1.61 2.77 -0.36 3.97 0.40 -1.26 -5.01 117.98 120.11 1owo s PHE 406 Ca 0.00 1.52 -0.02 0.00 -0.60 0.00 0.00 56.93 57.83 1owo s PHE 406 Cb -0.13 -3.40 0.08 0.00 0.51 0.00 0.00 43.02 40.08 1owo s PHE 406 CO -0.04 -1.65 0.11 1.21 0.70 0.00 0.00 175.22 175.54 1owo s ASN 407 N -1.42 5.10 0.34 1.36 3.84 -1.26 -4.94 114.94 117.96 1owo s ASN 407 Ca 0.67 -1.66 0.16 0.00 0.21 0.00 0.00 52.86 52.24 1owo s ASN 407 Cb -0.29 -1.78 1.18 0.00 -0.55 0.00 0.00 41.25 39.81 1owo s ASN 407 CO 0.34 -0.41 1.50 -2.65 -2.79 0.00 0.00 177.10 173.09 1owo n PRO 408 N 4.61 -0.06 -0.22 0.43 -0.02 -1.26 -0.07 135.00 138.41 1owo n PRO 408 Ca -0.07 1.33 -0.07 0.00 -2.02 0.00 0.00 63.50 62.67 1owo n PRO 408 Cb 0.42 -2.34 0.03 0.00 -0.02 0.00 0.00 33.50 31.60 1owo n PRO 408 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1owo h ALA 409 N 1.90 0.80 -0.29 3.55 0.00 -1.88 0.61 119.26 123.94 1owo h ALA 409 Ca 0.76 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.48 1owo h ALA 409 Cb 1.96 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1owo h ALA 409 CO -0.76 0.38 0.01 0.77 0.00 0.00 0.00 179.25 179.65 1owo h SER 410 N 0.85 0.49 -0.19 0.00 0.02 -0.79 -1.75 113.55 112.19 1owo h SER 410 Ca 0.21 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1owo h SER 410 Cb 0.15 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1owo h SER 410 CO -0.02 0.66 0.10 1.56 -1.14 0.00 0.00 176.83 177.99 1owo h GLN 411 N 0.29 0.26 -0.30 3.45 1.08 -1.29 0.06 115.11 118.67 1owo h GLN 411 Ca 0.08 -0.03 0.03 0.00 -1.45 0.00 0.00 58.65 57.28 1owo h GLN 411 Cb 0.41 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.75 1owo h GLN 411 CO 0.01 0.26 0.11 0.00 -0.95 0.00 0.00 178.83 178.26 1owo h ALA 412 N 0.99 0.34 -0.69 3.87 0.00 -0.83 0.13 119.26 123.07 1owo h ALA 412 Ca 0.07 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1owo h ALA 412 Cb 0.07 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1owo h ALA 412 CO -0.01 -0.29 0.20 -0.22 0.00 0.00 0.00 179.25 178.92 1owo h LYS 413 N 0.24 1.08 -0.10 0.00 3.64 -1.16 0.15 116.57 120.41 1owo h LYS 413 Ca 0.13 -0.24 -0.23 0.00 -1.27 0.00 0.00 60.65 59.05 1owo h LYS 413 Cb 0.10 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1owo h LYS 413 CO -0.13 0.94 -0.84 -0.22 -2.27 0.00 0.00 179.45 176.93 1owo h LYS 414 N 1.04 0.71 -0.04 1.90 3.64 -0.51 -3.03 116.57 120.27 1owo h LYS 414 Ca 0.22 -0.62 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1owo h LYS 414 Cb 0.32 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1owo h LYS 414 CO -0.00 1.23 0.00 1.19 -2.27 0.00 0.00 179.45 179.59 1owo n PHE 415 N -3.89 0.03 -2.71 1.91 3.72 0.41 -4.58 117.46 112.35 1owo n PHE 415 Ca -0.08 -0.04 -0.04 0.00 -0.05 0.00 0.00 57.45 57.24 1owo n PHE 415 Cb 0.78 -0.00 0.09 0.00 -0.94 0.00 0.00 39.48 39.41 1owo n PHE 415 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1owo n ASP 416 N 0.61 -0.43 -0.50 4.37 2.03 0.50 -4.12 116.55 119.02 1owo n ASP 416 Ca 0.07 -2.35 0.41 0.00 0.52 0.00 0.00 54.79 53.45 1owo n ASP 416 Cb 0.28 0.32 0.73 0.00 -0.72 0.00 0.00 41.12 41.73 1owo n ASP 416 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1owo h ALA 417 N 2.01 3.22 -0.21 -1.67 0.00 -1.39 0.73 119.26 121.95 1owo h ALA 417 Ca -0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1owo h ALA 417 Cb 1.27 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1owo h ALA 417 CO 0.05 -1.73 0.00 0.25 0.00 0.00 0.00 179.25 177.82 1owo n THR 418 N -4.27 0.27 -2.32 0.00 -2.24 -1.26 -4.91 114.28 99.56 1owo n THR 418 Ca 0.36 -0.64 -0.20 0.00 -2.27 0.00 0.00 64.05 61.30 1owo n THR 418 Cb 1.55 1.20 -0.02 0.00 -2.10 0.00 0.00 70.33 70.96 1owo n THR 418 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1owo n ALA 419 N 1.34 -0.60 -0.07 6.98 0.00 0.25 -4.78 120.51 123.64 1owo n ALA 419 Ca 0.16 0.18 -0.12 0.00 0.00 0.00 0.00 53.44 53.66 1owo n ALA 419 Cb 0.57 -2.14 -0.05 0.00 0.00 0.00 0.00 19.45 17.83 1owo n ALA 419 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1owo h THR 420 N 0.00 1.28 -0.58 0.00 2.02 -1.93 -1.84 112.91 111.85 1owo h THR 420 Ca -0.48 -0.97 -0.07 0.00 0.77 0.00 0.00 66.41 65.66 1owo h THR 420 Cb 1.36 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 69.25 1owo h THR 420 CO 0.58 0.30 0.10 0.22 0.37 0.00 0.00 175.52 177.08 1owo h TYR 421 N 0.11 0.97 -0.20 3.16 3.20 -1.90 -1.15 116.97 121.15 1owo h TYR 421 Ca 0.05 -0.12 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 1owo h TYR 421 Cb 0.46 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1owo h TYR 421 CO 0.05 0.83 0.03 0.82 -1.64 0.00 0.00 178.16 178.25 1owo h ILE 422 N 0.88 1.22 -0.01 1.81 2.04 -1.91 -2.62 117.51 118.92 1owo h ILE 422 Ca 0.18 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.23 1owo h ILE 422 Cb 0.38 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1owo h ILE 422 CO 0.01 0.23 -0.39 0.11 0.00 0.00 0.00 178.15 178.11 1owo h LYS 423 N 0.14 0.03 -0.59 2.37 1.57 -1.24 -0.01 116.57 118.83 1owo h LYS 423 Ca 0.06 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 1owo h LYS 423 Cb 0.31 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1owo h LYS 423 CO 0.00 0.41 0.28 -0.09 -0.57 0.00 0.00 179.45 179.48 1owo h ARG 424 N 0.02 0.85 -0.00 3.15 2.43 -0.98 -2.79 114.38 117.07 1owo h ARG 424 Ca -0.00 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 1owo h ARG 424 Cb 0.69 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1owo h ARG 424 CO 0.05 0.70 -0.75 0.91 -1.51 0.00 0.00 179.97 179.37 1owo n TRP 425 N -4.52 0.00 -3.20 2.20 7.02 -1.01 -4.38 117.44 113.54 1owo n TRP 425 Ca 0.04 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.27 1owo n TRP 425 Cb 0.13 -0.06 -0.06 0.00 -2.42 0.00 0.00 31.31 28.90 1owo n TRP 425 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 1owo n LEU 426 N -1.18 2.50 0.30 -0.99 4.77 -0.03 -4.83 117.00 117.54 1owo n LEU 426 Ca 0.06 -5.24 0.18 0.00 -0.03 0.00 0.00 56.01 50.98 1owo n LEU 426 Cb 0.36 -0.05 1.00 0.00 -2.33 0.00 0.00 43.42 42.39 1owo n LEU 426 CO 0.38 2.18 1.15 1.55 -1.33 0.00 0.00 177.39 181.31 1owo h PRO 427 N 3.62 0.00 0.00 3.23 0.13 -1.70 -1.23 132.00 136.06 1owo h PRO 427 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1owo h PRO 427 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1owo h PRO 427 CO 0.68 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.60 1owo n GLU 428 N -3.55 0.51 -0.10 0.86 0.00 -1.26 -2.16 120.64 114.94 1owo n GLU 428 Ca -0.02 0.04 0.08 0.00 0.00 0.00 0.00 57.16 57.25 1owo n GLU 428 Cb 0.12 -1.50 0.11 0.00 0.00 0.00 0.00 31.44 30.17 1owo n GLU 428 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1owo n LEU 429 N -1.10 2.03 0.29 -1.84 4.32 -0.46 -4.74 117.00 115.50 1owo n LEU 429 Ca 0.13 -2.69 0.18 0.00 -0.02 0.00 0.00 56.01 53.61 1owo n LEU 429 Cb 0.10 -0.32 0.88 0.00 -1.62 0.00 0.00 43.42 42.46 1owo n LEU 429 CO 0.13 0.62 1.05 -0.09 -1.22 0.00 0.00 177.39 177.89 1owo h ARG 430 N 0.00 0.00 0.00 3.23 1.12 -1.52 -2.40 114.38 114.81 1owo h ARG 430 Ca 0.00 0.00 -0.09 0.00 -1.11 0.00 0.00 59.98 58.78 1owo h ARG 430 Cb 0.98 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.93 1owo h ARG 430 CO 0.00 0.04 -0.44 1.12 -3.11 0.00 0.00 179.97 177.58 1owo h HIS 431 N 0.00 0.00 -4.15 2.20 2.07 -1.85 -3.46 115.15 109.96 1owo h HIS 431 Ca -0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.01 1owo h HIS 431 Cb 0.29 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.36 1owo h HIS 431 CO 0.00 0.44 0.40 0.08 -3.07 0.00 0.00 177.93 175.78 1owo s VAL 432 N -3.02 3.14 0.24 6.12 1.01 -0.91 -5.00 120.40 121.99 1owo s VAL 432 Ca 0.04 0.61 -0.30 0.00 0.00 0.00 0.00 61.98 62.34 1owo s VAL 432 Cb 0.07 -3.17 -0.09 0.00 0.00 0.00 0.00 36.38 33.20 1owo s VAL 432 CO 0.73 -0.25 1.05 -1.00 0.00 0.00 0.00 175.10 175.64 1owo s HIS 433 N -2.05 3.70 0.35 5.22 0.09 -1.26 -4.92 115.29 116.41 1owo s HIS 433 Ca 0.70 1.74 0.12 0.00 -0.00 0.00 0.00 55.06 57.62 1owo s HIS 433 Cb -0.23 -3.20 0.95 0.00 -0.00 0.00 0.00 32.58 30.10 1owo s HIS 433 CO 0.35 -0.28 1.75 -1.35 -0.00 0.00 0.00 174.74 175.22 1owo h PRO 434 N 4.24 0.52 -0.72 8.40 0.11 -1.95 0.58 132.00 143.19 1owo h PRO 434 Ca -0.46 -0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.72 1owo h PRO 434 Cb 1.21 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.13 1owo h PRO 434 CO 0.69 0.34 0.36 -0.22 -0.21 0.00 0.00 178.00 178.96 1owo h LYS 435 N 0.54 0.60 0.03 1.05 1.63 -1.91 -0.03 116.57 118.47 1owo h LYS 435 Ca 0.61 -0.04 -0.21 0.00 -0.85 0.00 0.00 60.65 60.16 1owo h LYS 435 Cb 1.28 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 32.76 1owo h LYS 435 CO -0.39 0.39 -0.98 -0.44 -3.45 0.00 0.00 179.45 174.59 1owo h ASP 436 N 0.61 0.22 0.15 4.20 3.32 -1.20 -2.36 116.42 121.36 1owo h ASP 436 Ca 0.36 -0.20 -0.12 0.00 0.02 0.00 0.00 57.03 57.09 1owo h ASP 436 Cb 0.38 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1owo h ASP 436 CO -0.27 1.07 -0.41 -0.07 -1.72 0.00 0.00 179.24 177.84 1owo h LEU 437 N 0.07 0.36 -0.04 1.55 3.38 -0.88 0.62 115.31 120.37 1owo h LEU 437 Ca -0.05 -0.16 -0.14 0.00 0.09 0.00 0.00 57.88 57.62 1owo h LEU 437 Cb 1.66 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 42.32 1owo h LEU 437 CO 0.15 0.74 -0.53 0.40 0.09 0.00 0.00 178.44 179.29 1owo h ILE 438 N 0.29 1.41 0.00 1.22 2.04 -1.02 -3.25 117.51 118.19 1owo h ILE 438 Ca 0.03 -1.95 -0.08 0.00 1.00 0.00 0.00 64.86 63.86 1owo h ILE 438 Cb 0.85 2.44 -0.01 0.00 -0.74 0.00 0.00 36.82 39.37 1owo h ILE 438 CO 0.07 0.57 -0.37 0.77 0.00 0.00 0.00 178.15 179.19 1owo h SER 439 N -0.05 0.00 0.00 1.72 4.64 -1.41 -3.38 113.55 115.07 1owo h SER 439 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1owo h SER 439 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1owo h SER 439 CO 0.11 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 177.04 1owo n GLY 440 N 0.63 0.73 3.29 -0.77 0.00 0.19 -4.83 105.19 104.43 1owo n GLY 440 Ca 0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.58 1owo n GLY 440 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1owo s GLU 441 N -0.22 3.18 -0.15 1.61 2.02 -1.08 -4.86 118.70 119.20 1owo s GLU 441 Ca 0.00 -2.12 -0.02 0.00 0.02 0.00 0.00 54.97 52.85 1owo s GLU 441 Cb 0.00 -4.27 -0.02 0.00 0.10 0.00 0.00 34.13 29.94 1owo s GLU 441 CO 0.00 -1.28 -0.08 0.42 0.02 0.00 0.00 175.26 174.33 1owo s ILE 442 N 0.79 3.42 0.23 -1.63 1.01 -1.26 -4.73 121.20 119.02 1owo s ILE 442 Ca 0.11 -0.52 -0.31 0.00 0.00 0.00 0.00 60.65 59.93 1owo s ILE 442 Cb -0.20 -2.48 -0.11 0.00 0.01 0.00 0.00 42.46 39.69 1owo s ILE 442 CO -0.03 0.50 1.54 0.42 0.00 0.00 0.00 174.94 177.36 1owo s THR 443 N 0.50 2.45 0.29 2.92 -4.23 -1.26 -4.82 115.64 111.50 1owo s THR 443 Ca -0.06 0.36 -0.02 0.00 -1.18 0.00 0.00 61.69 60.79 1owo s THR 443 Cb -0.15 -3.23 0.43 0.00 1.34 0.00 0.00 72.50 70.89 1owo s THR 443 CO 0.03 0.05 1.54 -2.65 -0.54 0.00 0.00 174.62 173.05 1owo n PRO 444 N 2.93 -0.08 -0.17 3.99 -0.02 -1.26 -0.88 135.00 139.50 1owo n PRO 444 Ca 0.10 1.50 -0.11 0.00 -2.02 0.00 0.00 63.50 62.97 1owo n PRO 444 Cb 0.39 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 1owo n PRO 444 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1owo h ILE 445 N 0.00 1.27 -0.02 4.25 -0.00 -1.93 -2.63 117.51 118.45 1owo h ILE 445 Ca 0.55 -1.26 0.00 0.00 -0.00 0.00 0.00 64.86 64.15 1owo h ILE 445 Cb 1.03 1.03 0.00 0.00 -0.00 0.00 0.00 36.82 38.89 1owo h ILE 445 CO -0.96 0.44 0.00 1.21 -0.00 0.00 0.00 178.15 178.84 1owo n GLU 446 N -4.19 1.17 -0.02 2.19 2.13 -0.06 -3.26 120.64 118.60 1owo n GLU 446 Ca 0.01 -0.25 0.08 0.00 0.66 0.00 0.00 57.16 57.65 1owo n GLU 446 Cb 0.40 -1.40 -0.16 0.00 0.27 0.00 0.00 31.44 30.55 1owo n GLU 446 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 1owo n ARG 447 N -0.61 0.65 0.00 5.31 0.63 -0.28 -4.79 116.66 117.58 1owo n ARG 447 Ca 0.18 -0.16 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 1owo n ARG 447 Cb 0.15 -1.48 0.00 0.00 0.45 0.00 0.00 32.46 31.58 1owo n ARG 447 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1owo n ARG 448 N -2.26 0.00 0.00 -0.14 3.00 -1.14 -0.86 116.66 115.25 1owo n ARG 448 Ca -0.07 0.00 0.14 0.00 -0.01 0.00 0.00 57.85 57.91 1owo n ARG 448 Cb 0.60 0.00 0.54 0.00 0.00 0.00 0.00 32.46 33.60 1owo n ARG 448 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1owo n GLY 449 N 0.00 -1.05 3.67 -0.13 0.00 -1.26 -4.86 105.19 101.57 1owo n GLY 449 Ca 0.00 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1owo n GLY 449 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1owo s TYR 450 N -2.63 2.22 0.85 1.61 5.04 -0.04 -4.96 117.35 119.43 1owo s TYR 450 Ca 0.24 0.29 -0.12 0.00 -2.44 0.00 0.00 57.07 55.04 1owo s TYR 450 Cb 0.19 -3.91 0.11 0.00 0.35 0.00 0.00 41.96 38.70 1owo s TYR 450 CO 0.52 -3.75 1.18 -1.25 -1.34 0.00 0.00 175.55 170.91 1owo s PRO 451 N 3.35 1.41 0.49 4.97 0.04 -1.26 -4.92 135.00 139.07 1owo s PRO 451 Ca 0.73 1.68 -0.09 0.00 0.04 0.00 0.00 61.00 63.35 1owo s PRO 451 Cb -0.36 -1.76 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 1owo s PRO 451 CO 0.31 -2.37 0.85 0.00 0.04 0.00 0.00 177.00 175.83 1owo s ALA 452 N -2.34 3.28 -0.08 8.56 0.00 -1.26 -4.35 121.76 125.57 1owo s ALA 452 Ca 0.71 -0.24 -0.39 0.00 0.00 0.00 0.00 51.96 52.04 1owo s ALA 452 Cb -0.26 -2.79 -0.17 0.00 0.00 0.00 0.00 23.12 19.90 1owo s ALA 452 CO 0.53 -0.29 1.48 -2.30 0.00 0.00 0.00 175.76 175.18 1owo n PRO 453 N -1.95 0.99 0.09 0.00 -0.02 -1.26 -4.31 135.00 128.55 1owo n PRO 453 Ca 0.03 0.36 0.12 0.00 -2.02 0.00 0.00 63.50 61.99 1owo n PRO 453 Cb 0.54 -2.00 0.45 0.00 -0.02 0.00 0.00 33.50 32.48 1owo n PRO 453 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1owo n ILE 454 N 3.26 0.71 -3.88 4.25 -5.35 0.22 -4.80 119.36 113.77 1owo n ILE 454 Ca 0.22 0.07 -0.09 0.00 -0.27 0.00 0.00 62.75 62.68 1owo n ILE 454 Cb 0.15 -0.91 -0.08 0.00 -1.74 0.00 0.00 39.64 37.05 1owo n ILE 454 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1owo s VAL 455 N -3.18 0.14 -0.49 7.28 -7.23 -1.26 -5.09 120.40 110.57 1owo s VAL 455 Ca 0.07 -1.19 -0.17 0.00 -1.81 0.00 0.00 61.98 58.89 1owo s VAL 455 Cb 0.11 -1.25 0.07 0.00 0.56 0.00 0.00 36.38 35.87 1owo s VAL 455 CO 0.44 -0.66 0.48 0.21 -0.31 0.00 0.00 175.10 175.27 1owo s ASN 456 N -2.68 6.17 0.23 4.85 3.84 -1.26 -4.97 114.94 121.13 1owo s ASN 456 Ca 0.03 -1.24 -0.16 0.00 0.21 0.00 0.00 52.86 51.69 1owo s ASN 456 Cb 0.04 -2.22 0.27 0.00 -0.55 0.00 0.00 41.25 38.78 1owo s ASN 456 CO -0.09 -0.75 1.56 -0.74 -2.79 0.00 0.00 177.10 174.28 1owo h HIS 457 N 8.85 -0.97 -0.47 0.43 -0.00 -1.98 -0.38 115.15 120.63 1owo h HIS 457 Ca -0.28 0.10 0.08 0.00 -0.00 0.00 0.00 60.37 60.26 1owo h HIS 457 Cb 1.10 0.57 -0.06 0.00 -0.00 0.00 0.00 27.41 29.02 1owo h HIS 457 CO 0.69 -0.40 0.10 -0.97 -0.00 0.00 0.00 177.93 177.34 1owo h ASN 458 N -0.02 0.02 -0.38 3.26 -1.24 -1.99 0.19 115.58 115.43 1owo h ASN 458 Ca 0.36 0.08 -0.12 0.00 0.71 0.00 0.00 56.30 57.33 1owo h ASN 458 Cb 0.61 0.11 -0.02 0.00 0.73 0.00 0.00 38.32 39.75 1owo h ASN 458 CO -0.96 0.04 -0.19 -0.07 -1.29 0.00 0.00 177.43 174.96 1owo h LEU 459 N 0.24 0.88 -0.82 0.34 3.38 -1.56 -2.09 115.31 115.68 1owo h LEU 459 Ca 0.23 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 1owo h LEU 459 Cb 0.30 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1owo h LEU 459 CO -0.30 1.05 -0.09 0.03 0.09 0.00 0.00 178.44 179.22 1owo h ARG 460 N 0.76 0.79 -0.62 1.13 2.47 -0.51 -1.22 114.38 117.18 1owo h ARG 460 Ca 0.11 -0.25 -0.10 0.00 -1.26 0.00 0.00 59.98 58.48 1owo h ARG 460 Cb 0.72 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.95 1owo h ARG 460 CO 0.06 0.85 0.01 0.37 0.56 0.00 0.00 179.97 181.82 1owo h GLN 461 N 0.72 1.08 -0.26 0.04 4.15 -0.45 -1.19 115.11 119.19 1owo h GLN 461 Ca 0.12 -0.34 -0.14 0.00 0.77 0.00 0.00 58.65 59.07 1owo h GLN 461 Cb 0.57 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1owo h GLN 461 CO 0.03 1.05 -0.40 0.87 -1.93 0.00 0.00 178.83 178.45 1owo h LYS 462 N 0.99 0.62 -0.26 1.69 1.57 -1.16 -2.69 116.57 117.33 1owo h LYS 462 Ca 0.18 -0.32 -0.03 0.00 -1.87 0.00 0.00 60.65 58.61 1owo h LYS 462 Cb 0.55 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1owo h LYS 462 CO 0.03 0.92 0.06 0.37 -0.57 0.00 0.00 179.45 180.26 1owo h GLN 463 N 0.51 0.42 -0.18 3.15 4.15 -0.96 -1.29 115.11 120.92 1owo h GLN 463 Ca 0.04 -0.11 -0.00 0.00 0.77 0.00 0.00 58.65 59.35 1owo h GLN 463 Cb 0.92 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.55 1owo h GLN 463 CO 0.08 0.53 0.09 0.35 -1.93 0.00 0.00 178.83 177.95 1owo h PHE 464 N 0.25 0.25 -0.72 3.99 3.04 -1.19 -1.35 116.94 121.20 1owo h PHE 464 Ca 0.08 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.01 1owo h PHE 464 Cb 0.30 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 38.69 1owo h PHE 464 CO 0.02 0.25 0.41 0.87 -2.02 0.00 0.00 178.31 177.83 1owo h LYS 465 N 0.17 1.00 -0.58 1.11 1.57 -1.48 -0.80 116.57 117.56 1owo h LYS 465 Ca 0.06 -0.11 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1owo h LYS 465 Cb 0.09 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.16 1owo h LYS 465 CO -0.01 0.74 0.34 0.00 -0.57 0.00 0.00 179.45 179.95 1owo h ALA 466 N 1.21 0.76 -0.35 3.86 0.00 -0.96 0.10 119.26 123.88 1owo h ALA 466 Ca 0.26 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 1owo h ALA 466 Cb 0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1owo h ALA 466 CO -0.04 0.05 -0.17 -0.07 0.00 0.00 0.00 179.25 179.02 1owo h LEU 467 N 0.67 0.62 0.22 0.00 3.38 -0.85 -1.41 115.31 117.94 1owo h LEU 467 Ca 0.24 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1owo h LEU 467 Cb 0.06 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1owo h LEU 467 CO -0.12 0.80 -0.11 0.22 0.09 0.00 0.00 178.44 179.33 1owo h TYR 468 N 0.57 -0.27 -0.45 1.13 3.20 -0.38 -2.18 116.97 118.59 1owo h TYR 468 Ca 0.09 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 1owo h TYR 468 Cb 0.61 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 1owo h TYR 468 CO 0.03 0.03 0.14 -0.91 -1.64 0.00 0.00 178.16 175.81 1owo h ASN 469 N -0.59 0.60 -0.31 -2.11 2.35 -0.79 0.30 115.58 115.02 1owo h ASN 469 Ca -0.03 -0.08 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 1owo h ASN 469 Cb 0.43 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1owo h ASN 469 CO 0.05 0.57 -0.10 1.56 -1.65 0.00 0.00 177.43 177.86 1owo h GLN 470 N 0.64 0.62 -0.16 0.81 4.20 -1.24 -1.35 115.11 118.63 1owo h GLN 470 Ca 0.15 -0.25 -0.17 0.00 0.06 0.00 0.00 58.65 58.44 1owo h GLN 470 Cb 0.19 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 1owo h GLN 470 CO -0.01 0.82 -0.62 1.25 -0.67 0.00 0.00 178.83 179.60 1owo h LEU 471 N 0.39 0.63 -0.48 1.46 5.85 -1.14 -0.57 115.31 121.45 1owo h LEU 471 Ca 0.08 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.49 1owo h LEU 471 Cb 0.60 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1owo h LEU 471 CO 0.04 1.09 0.19 0.50 -0.34 0.00 0.00 178.44 179.92 1owo h LYS 472 N 0.41 0.37 -0.15 1.25 3.64 -0.28 -2.66 116.57 119.14 1owo h LYS 472 Ca -0.01 -0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.17 1owo h LYS 472 Cb 1.18 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1owo h LYS 472 CO 0.12 0.24 -0.60 0.00 -2.27 0.00 0.00 179.45 176.94 1owo h ALA 473 N 1.30 0.28 0.00 5.00 0.00 -1.14 -3.12 119.26 121.58 1owo h ALA 473 Ca 0.22 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1owo h ALA 473 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1owo h ALA 473 CO -0.21 0.53 0.00 0.00 0.00 0.00 0.00 179.25 179.57 1owo n ALA 474 N -2.57 1.33 0.37 0.00 0.00 -0.23 -5.11 120.51 114.30 1owo n ALA 474 Ca -0.07 -0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.41 1owo n ALA 474 Cb 0.65 -1.02 0.04 0.00 0.00 0.00 0.00 19.45 19.11 1owo n ALA 474 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61