#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ier h ALA 4 N 0.00 1.17 0.00 -1.67 0.00 -2.04 0.89 119.26 117.62 3ier h ALA 4 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3ier h ALA 4 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ier h ALA 4 CO 0.00 0.08 0.00 0.36 0.00 0.00 0.00 179.25 179.69 3ier n LYS 5 N -3.42 0.07 -0.11 0.00 2.85 -1.26 -2.09 118.16 114.20 3ier n LYS 5 Ca -0.02 0.15 0.12 0.00 -1.05 0.00 0.00 58.31 57.52 3ier n LYS 5 Cb 0.21 -1.50 0.19 0.00 -0.65 0.00 0.00 35.03 33.29 3ier n LYS 5 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3ier n ASN 6 N -1.44 3.14 -4.41 -5.58 5.03 0.31 -4.77 115.26 107.53 3ier n ASN 6 Ca 0.06 -1.97 -0.41 0.00 0.87 0.00 0.00 54.58 53.13 3ier n ASN 6 Cb 0.21 -0.14 -0.11 0.00 -1.02 0.00 0.00 39.78 38.71 3ier n ASN 6 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3ier s ILE 7 N -1.71 4.81 0.07 2.41 -1.09 -0.89 -4.69 121.20 120.12 3ier s ILE 7 Ca 0.35 -0.73 -0.30 0.00 -2.23 0.00 0.00 60.65 57.73 3ier s ILE 7 Cb 0.21 -3.66 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 3ier s ILE 7 CO 0.31 -0.22 0.99 -0.54 -1.23 0.00 0.00 174.94 174.25 3ier s LYS 8 N 1.60 4.63 0.09 2.79 -0.14 -0.37 -4.89 119.74 123.45 3ier s LYS 8 Ca 0.03 1.48 0.10 0.00 -1.36 0.00 0.00 55.97 56.22 3ier s LYS 8 Cb -0.19 -3.40 -0.03 0.00 -1.68 0.00 0.00 37.83 32.53 3ier s LYS 8 CO 0.08 0.08 -0.26 0.15 -0.76 0.00 0.00 175.35 174.64 3ier s LYS 9 N 0.39 1.56 0.71 1.68 1.02 -1.26 -1.37 119.74 122.47 3ier s LYS 9 Ca 0.50 -1.23 -0.11 0.00 0.02 0.00 0.00 55.97 55.14 3ier s LYS 9 Cb -0.23 -1.91 0.02 0.00 -0.52 0.00 0.00 37.83 35.19 3ier s LYS 9 CO 0.30 0.47 1.07 0.20 -0.92 0.00 0.00 175.35 176.46 3ier s GLY 10 N -1.69 1.66 1.06 -3.33 0.00 -0.57 -4.86 107.32 99.58 3ier s GLY 10 Ca 0.13 -0.02 -0.16 0.00 0.00 0.00 0.00 44.72 44.67 3ier s GLY 10 CO 0.04 0.31 1.16 2.56 0.00 0.00 0.00 173.10 177.17 3ier s PRO 11 N -5.10 -0.06 0.43 2.90 0.05 -1.26 -4.59 135.00 127.37 3ier s PRO 11 Ca 0.58 0.03 -0.25 0.00 0.05 0.00 0.00 61.00 61.42 3ier s PRO 11 Cb -0.14 -1.72 -0.08 0.00 0.05 0.00 0.00 34.50 32.61 3ier s PRO 11 CO 0.55 -2.96 1.25 0.00 0.05 0.00 0.00 177.00 175.89 3ier s ALA 12 N -3.24 3.13 0.50 8.56 0.00 -1.26 -4.00 121.76 125.45 3ier s ALA 12 Ca 0.69 1.12 -0.22 0.00 0.00 0.00 0.00 51.96 53.55 3ier s ALA 12 Cb -0.11 -3.45 -0.06 0.00 0.00 0.00 0.00 23.12 19.50 3ier s ALA 12 CO 0.55 -0.78 1.25 -1.25 0.00 0.00 0.00 175.76 175.53 3ier s PRO 13 N -2.42 3.46 0.14 0.00 0.04 -1.26 -4.92 135.00 130.05 3ier s PRO 13 Ca 0.60 1.98 -0.23 0.00 0.04 0.00 0.00 61.00 63.39 3ier s PRO 13 Cb -0.35 -2.33 0.01 0.00 0.04 0.00 0.00 34.50 31.87 3ier s PRO 13 CO 0.43 -0.85 1.63 0.35 0.04 0.00 0.00 177.00 178.60 3ier h PHE 14 N 1.76 -0.64 -3.58 0.56 3.57 -1.93 -3.38 116.94 113.30 3ier h PHE 14 Ca -0.50 0.03 -0.67 0.00 3.53 0.00 0.00 57.97 60.36 3ier h PHE 14 Cb 1.27 0.31 -0.28 0.00 2.79 0.00 0.00 35.95 40.05 3ier h PHE 14 CO 0.50 -0.32 -0.80 0.71 -2.23 0.00 0.00 178.31 176.17 3ier s TYR 15 N -6.08 2.70 0.48 0.41 2.02 -1.26 -5.12 117.35 110.50 3ier s TYR 15 Ca -0.15 -0.60 -0.21 0.00 -0.37 0.00 0.00 57.07 55.74 3ier s TYR 15 Cb 0.11 -1.74 -0.11 0.00 -0.40 0.00 0.00 41.96 39.82 3ier s TYR 15 CO 0.67 -0.15 0.53 -2.30 -1.57 0.00 0.00 175.55 172.73 3ier n PRO 16 N 3.17 0.57 -2.05 -1.71 -0.02 -1.26 -4.85 135.00 128.85 3ier n PRO 16 Ca -0.18 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.09 3ier n PRO 16 Cb 0.53 -1.58 -0.03 0.00 -0.02 0.00 0.00 33.50 32.40 3ier n PRO 16 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3ier s LEU 17 N 1.44 4.35 0.40 2.45 2.96 -1.26 -4.97 118.68 124.05 3ier s LEU 17 Ca 0.65 2.34 -0.23 0.00 -0.22 0.00 0.00 54.13 56.67 3ier s LEU 17 Cb -0.54 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.49 3ier s LEU 17 CO 0.57 -0.82 0.96 -0.70 -1.32 0.00 0.00 176.35 175.05 3ier s GLU 18 N 2.49 4.30 0.89 1.98 2.12 -1.26 -5.05 118.70 124.18 3ier s GLU 18 Ca 0.70 1.24 -0.12 0.00 0.36 0.00 0.00 54.97 57.14 3ier s GLU 18 Cb -0.36 -2.40 0.13 0.00 0.26 0.00 0.00 34.13 31.75 3ier s GLU 18 CO 0.30 0.03 1.15 -0.51 -0.54 0.00 0.00 175.26 175.69 3ier s ASP 19 N -1.93 3.68 0.00 -1.70 1.01 -1.26 -4.98 116.67 111.49 3ier s ASP 19 Ca 0.58 0.90 0.00 0.00 0.71 0.00 0.00 52.55 54.74 3ier s ASP 19 Cb -0.14 -1.44 0.00 0.00 1.01 0.00 0.00 42.92 42.35 3ier s ASP 19 CO 0.18 -2.44 0.00 0.61 0.21 0.00 0.00 175.17 173.73 3ier n GLY 20 N -2.47 2.36 3.69 0.21 0.00 -1.26 -4.84 105.19 102.88 3ier n GLY 20 Ca 0.07 -1.84 -0.29 0.00 0.00 0.00 0.00 46.02 43.95 3ier n GLY 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ier s THR 21 N -2.60 2.46 0.40 2.61 -4.23 -1.26 -4.83 115.64 108.18 3ier s THR 21 Ca 0.00 0.15 0.06 0.00 -1.18 0.00 0.00 61.69 60.72 3ier s THR 21 Cb 0.00 -2.57 0.25 0.00 1.34 0.00 0.00 72.50 71.52 3ier s THR 21 CO 0.00 -0.19 2.04 0.00 -0.54 0.00 0.00 174.62 175.92 3ier h ALA 22 N -1.73 1.66 -0.31 3.99 0.00 -1.91 -2.12 119.26 118.84 3ier h ALA 22 Ca -0.51 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.19 3ier h ALA 22 Cb 1.30 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3ier h ALA 22 CO 0.54 0.30 -0.46 0.78 0.00 0.00 0.00 179.25 180.42 3ier h GLY 23 N 0.62 0.89 1.02 0.00 0.00 -1.92 -1.87 103.07 101.80 3ier h GLY 23 Ca 0.15 -0.96 -0.05 0.00 0.00 0.00 0.00 47.33 46.48 3ier h GLY 23 CO -0.03 0.86 0.19 0.83 0.00 0.00 0.00 176.54 178.40 3ier h GLU 24 N 0.65 0.98 -0.41 4.80 5.08 -1.77 -0.22 114.58 123.69 3ier h GLU 24 Ca 0.04 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.07 3ier h GLU 24 Cb 1.04 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 3ier h GLU 24 CO 0.10 0.86 -0.21 1.96 -1.00 0.00 0.00 179.01 180.73 3ier h GLN 25 N 0.90 0.87 -0.42 2.33 4.20 -1.27 -0.44 115.11 121.27 3ier h GLN 25 Ca 0.20 -0.38 -0.04 0.00 0.06 0.00 0.00 58.65 58.49 3ier h GLN 25 Cb 0.30 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 3ier h GLN 25 CO -0.01 1.02 0.12 -0.07 -0.67 0.00 0.00 178.83 179.22 3ier h LEU 26 N 0.68 0.63 -0.25 1.46 3.38 -1.29 -2.34 115.31 117.60 3ier h LEU 26 Ca 0.09 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.85 3ier h LEU 26 Cb 0.77 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 3ier h LEU 26 CO 0.06 0.69 0.13 -0.74 0.09 0.00 0.00 178.44 178.67 3ier h HIS 27 N 0.55 0.25 -0.60 1.13 2.76 -0.96 0.12 115.15 118.40 3ier h HIS 27 Ca 0.13 0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.22 3ier h HIS 27 Cb 0.29 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 3ier h HIS 27 CO 0.02 0.14 -0.00 -0.22 -1.30 0.00 0.00 177.93 176.57 3ier h LYS 28 N 0.28 1.06 -0.06 5.26 3.64 -0.99 -1.20 116.57 124.56 3ier h LYS 28 Ca 0.10 -0.34 -0.13 0.00 -1.27 0.00 0.00 60.65 59.01 3ier h LYS 28 Cb 0.01 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3ier h LYS 28 CO -0.06 1.04 -0.48 0.00 -2.27 0.00 0.00 179.45 177.68 3ier h ALA 29 N 0.98 0.13 -0.63 5.00 0.00 -1.24 -3.14 119.26 120.36 3ier h ALA 29 Ca 0.17 -0.51 0.01 0.00 0.00 0.00 0.00 54.91 54.58 3ier h ALA 29 Cb 0.56 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3ier h ALA 29 CO 0.03 0.31 0.42 0.52 0.00 0.00 0.00 179.25 180.53 3ier h MET 30 N -0.05 0.80 -0.92 0.00 2.86 -0.69 -2.47 114.93 114.46 3ier h MET 30 Ca -0.04 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3ier h MET 30 Cb 1.15 -0.18 -0.05 0.00 0.06 0.00 0.00 31.60 32.58 3ier h MET 30 CO 0.10 0.53 0.61 -0.22 1.06 0.00 0.00 176.91 178.99 3ier h LYS 31 N 0.83 1.20 -0.60 1.72 3.64 -1.21 0.44 116.57 122.58 3ier h LYS 31 Ca 0.24 -0.07 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 3ier h LYS 31 Cb -0.05 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.48 3ier h LYS 31 CO -0.06 0.80 0.15 -0.09 -2.27 0.00 0.00 179.45 177.98 3ier h ARG 32 N 1.24 0.96 -0.06 1.90 2.43 -1.40 -2.61 114.38 116.84 3ier h ARG 32 Ca 0.34 -0.23 -0.15 0.00 -0.81 0.00 0.00 59.98 59.13 3ier h ARG 32 Cb -0.13 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.28 3ier h ARG 32 CO -0.08 0.88 -0.63 1.88 -1.51 0.00 0.00 179.97 180.51 3ier h TYR 33 N 0.87 0.31 -0.01 2.20 0.05 -1.19 -2.80 116.97 116.40 3ier h TYR 33 Ca 0.19 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.85 3ier h TYR 33 Cb 0.35 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 3ier h TYR 33 CO 0.02 0.80 0.01 0.00 -1.05 0.00 0.00 178.16 177.95 3ier h ALA 34 N 1.16 1.85 -0.00 3.88 0.00 -0.60 -0.33 119.26 125.22 3ier h ALA 34 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ier h ALA 34 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3ier h ALA 34 CO 0.10 -0.01 -0.01 1.28 0.00 0.00 0.00 179.25 180.60 3ier n LEU 35 N -4.30 0.50 -4.10 0.00 4.77 -1.01 -4.15 117.00 108.71 3ier n LEU 35 Ca -0.03 -0.13 -0.35 0.00 -0.03 0.00 0.00 56.01 55.46 3ier n LEU 35 Cb 0.10 -0.03 -0.12 0.00 -2.33 0.00 0.00 43.42 41.03 3ier n LEU 35 CO 0.32 0.08 -0.16 -0.69 -1.33 0.00 0.00 177.39 175.61 3ier s VAL 36 N -2.08 3.20 0.35 4.08 1.01 -0.14 -5.08 120.40 121.74 3ier s VAL 36 Ca 0.42 -2.24 -0.28 0.00 0.00 0.00 0.00 61.98 59.88 3ier s VAL 36 Cb 0.21 -3.20 -0.12 0.00 0.00 0.00 0.00 36.38 33.28 3ier s VAL 36 CO 0.38 -0.71 1.37 -2.65 0.00 0.00 0.00 175.10 173.49 3ier n PRO 37 N 4.38 2.32 -0.03 2.72 -0.02 -1.26 -2.54 135.00 140.57 3ier n PRO 37 Ca -0.00 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3ier n PRO 37 Cb 0.41 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3ier n PRO 37 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ier n GLY 38 N 0.76 1.04 3.65 -1.23 0.00 -1.26 -5.00 105.19 103.14 3ier n GLY 38 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 3ier n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ier s THR 39 N -2.39 3.57 -0.21 2.61 2.01 -1.05 -4.96 115.64 115.21 3ier s THR 39 Ca 0.00 0.67 -0.22 0.00 0.31 0.00 0.00 61.69 62.45 3ier s THR 39 Cb 0.00 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.99 3ier s THR 39 CO 0.00 -0.14 0.69 -0.63 -0.69 0.00 0.00 174.62 173.86 3ier s ILE 40 N 4.71 4.96 -0.16 1.82 1.01 -1.26 -0.48 121.20 131.80 3ier s ILE 40 Ca 0.75 1.31 -0.17 0.00 0.00 0.00 0.00 60.65 62.54 3ier s ILE 40 Cb -0.31 -4.00 -0.14 0.00 0.01 0.00 0.00 42.46 38.03 3ier s ILE 40 CO 0.30 0.05 0.21 0.00 0.00 0.00 0.00 174.94 175.50 3ier h ALA 41 N 7.59 0.10 -2.90 9.38 0.00 -1.25 -3.28 119.26 128.91 3ier h ALA 41 Ca -0.28 -0.68 -0.33 0.00 0.00 0.00 0.00 54.91 53.62 3ier h ALA 41 Cb 1.13 0.39 -0.19 0.00 0.00 0.00 0.00 17.79 19.12 3ier h ALA 41 CO 0.80 0.38 -0.74 -0.06 0.00 0.00 0.00 179.25 179.63 3ier s PHE 42 N -2.17 1.04 -0.04 0.00 0.40 -1.00 -0.87 117.98 115.34 3ier s PHE 42 Ca -0.18 -0.60 -0.01 0.00 -0.60 0.00 0.00 56.93 55.53 3ier s PHE 42 Cb 0.02 -0.57 0.03 0.00 0.51 0.00 0.00 43.02 43.00 3ier s PHE 42 CO 0.42 -0.00 0.04 0.99 0.70 0.00 0.00 175.22 177.37 3ier s THR 43 N -2.12 -0.00 -0.44 0.64 2.01 -0.50 -1.09 115.64 114.14 3ier s THR 43 Ca 0.02 0.30 -0.20 0.00 0.31 0.00 0.00 61.69 62.12 3ier s THR 43 Cb -0.05 -0.20 0.02 0.00 0.01 0.00 0.00 72.50 72.29 3ier s THR 43 CO 0.00 0.16 0.63 -0.62 -0.69 0.00 0.00 174.62 174.10 3ier s ASP 44 N 1.73 6.31 0.55 3.53 -1.08 -0.34 -0.20 116.67 127.18 3ier s ASP 44 Ca -0.00 -0.38 0.34 0.00 -0.52 0.00 0.00 52.55 51.99 3ier s ASP 44 Cb -0.12 -2.31 1.50 0.00 -1.46 0.00 0.00 42.92 40.52 3ier s ASP 44 CO -0.03 -0.76 2.04 0.00 0.52 0.00 0.00 175.17 176.93 3ier h ALA 45 N 8.87 1.03 -0.00 3.66 0.00 -1.59 0.62 119.26 131.85 3ier h ALA 45 Ca -0.25 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.49 3ier h ALA 45 Cb 1.10 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ier h ALA 45 CO 0.89 0.05 -0.48 0.45 0.00 0.00 0.00 179.25 180.15 3ier h HIS 46 N 0.00 0.49 -0.01 0.00 3.86 -1.92 -3.36 115.15 114.20 3ier h HIS 46 Ca -0.00 -0.27 0.00 0.00 -1.16 0.00 0.00 60.37 58.94 3ier h HIS 46 Cb 0.44 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.85 3ier h HIS 46 CO 0.00 1.08 -0.20 0.44 0.86 0.00 0.00 177.93 180.11 3ier n ILE 47 N -4.31 0.00 -1.06 2.45 -5.35 -1.18 -4.99 119.36 104.92 3ier n ILE 47 Ca -0.10 -0.40 -0.02 0.00 -0.27 0.00 0.00 62.75 61.96 3ier n ILE 47 Cb 0.62 1.25 -0.01 0.00 -1.74 0.00 0.00 39.64 39.76 3ier n ILE 47 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3ier n GLU 48 N 0.28 -0.82 -2.97 6.28 1.02 0.22 -4.99 120.64 119.65 3ier n GLU 48 Ca 0.08 0.35 -0.40 0.00 -0.02 0.00 0.00 57.16 57.17 3ier n GLU 48 Cb 0.36 -4.06 -0.05 0.00 -0.02 0.00 0.00 31.44 27.68 3ier n GLU 48 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3ier s VAL 49 N -1.74 4.64 0.03 2.62 1.01 -1.21 -4.84 120.40 120.91 3ier s VAL 49 Ca 0.00 1.67 -0.00 0.00 0.00 0.00 0.00 61.98 63.65 3ier s VAL 49 Cb 0.00 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 3ier s VAL 49 CO 0.00 0.40 0.14 0.20 0.00 0.00 0.00 175.10 175.83 3ier s ASN 50 N -0.30 5.98 -0.05 3.32 0.01 -1.26 -1.19 114.94 121.45 3ier s ASN 50 Ca 0.38 0.19 0.03 0.00 -0.71 0.00 0.00 52.86 52.75 3ier s ASN 50 Cb -0.21 -1.77 0.01 0.00 0.41 0.00 0.00 41.25 39.68 3ier s ASN 50 CO 0.24 0.23 -0.12 -0.51 -1.51 0.00 0.00 177.10 175.43 3ier s ILE 51 N -1.34 1.06 0.70 0.60 2.07 -0.25 -5.01 121.20 119.04 3ier s ILE 51 Ca 0.28 -0.47 -0.07 0.00 -1.41 0.00 0.00 60.65 58.98 3ier s ILE 51 Cb -0.12 -0.96 0.05 0.00 0.13 0.00 0.00 42.46 41.56 3ier s ILE 51 CO 0.20 0.33 1.01 0.42 -1.91 0.00 0.00 174.94 174.99 3ier s THR 52 N 0.43 2.45 0.22 4.00 -4.23 -1.26 -0.91 115.64 116.33 3ier s THR 52 Ca -0.09 -0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 60.13 3ier s THR 52 Cb -0.13 -3.07 0.18 0.00 1.34 0.00 0.00 72.50 70.82 3ier s THR 52 CO 0.02 -0.07 1.84 1.88 -0.54 0.00 0.00 174.62 177.75 3ier h TYR 53 N -0.58 1.13 -0.38 3.99 -1.99 -1.10 -0.91 116.97 117.13 3ier h TYR 53 Ca -0.45 -0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.28 3ier h TYR 53 Cb 1.31 -0.36 -0.03 0.00 2.00 0.00 0.00 36.73 39.65 3ier h TYR 53 CO 0.35 0.79 0.22 0.00 -0.00 0.00 0.00 178.16 179.51 3ier h ALA 54 N 1.24 0.48 -0.62 3.88 0.00 -1.82 0.17 119.26 122.60 3ier h ALA 54 Ca 0.29 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.22 3ier h ALA 54 Cb 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3ier h ALA 54 CO -0.05 -0.13 0.39 0.93 0.00 0.00 0.00 179.25 180.39 3ier h GLU 55 N 0.44 0.75 -0.09 0.00 5.08 -1.85 -0.76 114.58 118.15 3ier h GLU 55 Ca 0.15 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3ier h GLU 55 Cb 0.02 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 3ier h GLU 55 CO -0.08 0.50 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.49 3ier h TYR 56 N 0.78 0.19 0.33 4.33 5.03 -0.80 -1.82 116.97 124.99 3ier h TYR 56 Ca 0.24 -0.04 -0.01 0.00 2.58 0.00 0.00 58.73 61.51 3ier h TYR 56 Cb -0.01 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.21 3ier h TYR 56 CO -0.05 0.47 -0.25 0.35 -1.32 0.00 0.00 178.16 177.36 3ier h PHE 57 N -0.15 -0.65 -0.55 -3.82 3.57 -0.65 0.43 116.94 115.12 3ier h PHE 57 Ca 0.02 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.56 3ier h PHE 57 Cb 0.40 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.35 3ier h PHE 57 CO 0.05 -0.37 0.32 0.93 -2.23 0.00 0.00 178.31 177.00 3ier h GLU 58 N -0.58 0.60 -0.17 1.11 5.08 -1.14 0.13 114.58 119.62 3ier h GLU 58 Ca -0.03 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 3ier h GLU 58 Cb 0.50 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 3ier h GLU 58 CO -0.00 0.40 -0.63 1.98 -1.00 0.00 0.00 179.01 179.75 3ier h MET 59 N 0.62 0.60 -0.65 2.33 4.05 -1.22 -0.85 114.93 119.81 3ier h MET 59 Ca 0.23 -0.42 0.02 0.00 -0.28 0.00 0.00 59.70 59.25 3ier h MET 59 Cb 0.07 0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 30.90 3ier h MET 59 CO -0.12 1.04 0.42 0.77 0.23 0.00 0.00 176.91 179.25 3ier h SER 60 N 0.44 0.71 -0.63 1.39 0.02 -0.58 -0.92 113.55 113.97 3ier h SER 60 Ca -0.01 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 3ier h SER 60 Cb 1.21 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.55 3ier h SER 60 CO 0.12 0.50 0.29 0.58 -1.14 0.00 0.00 176.83 177.18 3ier h VAL 61 N 0.84 1.22 -0.62 2.27 2.07 -0.91 -1.16 116.25 119.96 3ier h VAL 61 Ca 0.25 -0.65 -0.06 0.00 0.82 0.00 0.00 66.70 67.06 3ier h VAL 61 Cb -0.04 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 3ier h VAL 61 CO -0.08 0.26 0.15 0.03 0.02 0.00 0.00 177.57 177.95 3ier h ARG 62 N 0.87 1.00 -0.58 1.57 3.08 -0.77 -0.77 114.38 118.78 3ier h ARG 62 Ca 0.21 -0.24 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 3ier h ARG 62 Cb 0.15 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 3ier h ARG 62 CO -0.02 0.91 0.10 -0.07 -1.07 0.00 0.00 179.97 179.81 3ier h LEU 63 N 0.92 0.88 0.03 3.04 3.38 -1.03 -0.26 115.31 122.26 3ier h LEU 63 Ca 0.20 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ier h LEU 63 Cb 0.36 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3ier h LEU 63 CO 0.00 0.89 -0.01 0.00 0.09 0.00 0.00 178.44 179.41 3ier h ALA 64 N 1.22 -0.04 -0.74 1.53 0.00 -0.81 0.44 119.26 120.87 3ier h ALA 64 Ca 0.18 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3ier h ALA 64 Cb 0.38 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3ier h ALA 64 CO 0.01 -0.42 0.24 1.49 0.00 0.00 0.00 179.25 180.57 3ier h GLU 65 N -0.24 1.14 -0.50 0.00 4.57 -1.04 -1.36 114.58 117.14 3ier h GLU 65 Ca -0.00 -0.24 -0.03 0.00 -1.18 0.00 0.00 59.36 57.90 3ier h GLU 65 Cb 0.23 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 3ier h GLU 65 CO 0.01 0.96 0.18 0.00 -1.18 0.00 0.00 179.01 178.98 3ier h ALA 66 N 1.12 0.66 -0.84 2.92 0.00 -0.95 -0.54 119.26 121.62 3ier h ALA 66 Ca 0.24 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3ier h ALA 66 Cb 0.29 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3ier h ALA 66 CO -0.01 0.29 0.47 0.52 0.00 0.00 0.00 179.25 180.52 3ier h MET 67 N 0.68 1.17 -0.34 0.00 2.86 -0.70 0.23 114.93 118.84 3ier h MET 67 Ca 0.16 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3ier h MET 67 Cb 0.24 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 3ier h MET 67 CO -0.01 0.85 0.22 -0.22 1.06 0.00 0.00 176.91 178.81 3ier h LYS 68 N 1.18 0.45 -0.12 1.72 3.64 -0.96 -0.37 116.57 122.11 3ier h LYS 68 Ca 0.30 -0.03 -0.13 0.00 -1.27 0.00 0.00 60.65 59.52 3ier h LYS 68 Cb 0.01 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3ier h LYS 68 CO -0.05 0.31 -0.48 0.00 -2.27 0.00 0.00 179.45 176.96 3ier h ARG 69 N 0.45 0.32 -0.15 1.90 2.47 -0.78 -1.13 114.38 117.46 3ier h ARG 69 Ca 0.12 -0.18 -0.03 0.00 -1.26 0.00 0.00 59.98 58.64 3ier h ARG 69 Cb -0.03 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.29 3ier h ARG 69 CO -0.03 0.73 -0.03 -0.92 0.56 0.00 0.00 179.97 180.29 3ier h TYR 70 N 0.25 0.21 0.00 3.04 3.20 -0.27 -3.46 116.97 119.94 3ier h TYR 70 Ca 0.01 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3ier h TYR 70 Cb 0.95 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.15 3ier h TYR 70 CO 0.02 0.25 0.00 0.41 -1.64 0.00 0.00 178.16 177.20 3ier n GLY 71 N -1.17 0.60 3.76 1.82 0.00 -0.43 -5.09 105.19 104.68 3ier n GLY 71 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 3ier n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ier s LEU 72 N 0.00 4.61 0.00 0.99 1.43 -0.26 -4.99 118.68 120.47 3ier s LEU 72 Ca 0.00 1.80 0.00 0.00 -1.03 0.00 0.00 54.13 54.90 3ier s LEU 72 Cb 0.00 -3.47 0.00 0.00 0.03 0.00 0.00 46.19 42.75 3ier s LEU 72 CO 0.00 0.16 0.00 -0.46 0.23 0.00 0.00 176.35 176.28 3ier n ASN 73 N 1.66 0.00 0.09 2.29 0.23 -1.26 -4.26 115.26 114.01 3ier n ASN 73 Ca -0.03 -0.42 0.07 0.00 -0.53 0.00 0.00 54.58 53.67 3ier n ASN 73 Cb 0.48 0.00 0.34 0.00 -2.08 0.00 0.00 39.78 38.52 3ier n ASN 73 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3ier n THR 74 N 0.00 1.41 1.65 5.53 -2.24 -1.26 -1.15 114.28 118.23 3ier n THR 74 Ca 0.00 0.60 0.15 0.00 -2.27 0.00 0.00 64.05 62.53 3ier n THR 74 Cb 0.00 -1.59 0.71 0.00 -2.10 0.00 0.00 70.33 67.35 3ier n THR 74 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3ier n ASN 75 N -1.93 0.61 -4.54 3.42 3.02 -1.26 -4.81 115.26 109.76 3ier n ASN 75 Ca -0.01 -1.01 -0.24 0.00 -0.03 0.00 0.00 54.58 53.29 3ier n ASN 75 Cb 0.03 -0.02 -0.09 0.00 -0.61 0.00 0.00 39.78 39.09 3ier n ASN 75 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 3ier s HIS 76 N -2.15 2.48 0.18 3.10 3.76 -0.30 -5.08 115.29 117.27 3ier s HIS 76 Ca 0.39 -0.28 0.11 0.00 -0.15 0.00 0.00 55.06 55.13 3ier s HIS 76 Cb 0.21 -1.11 -0.04 0.00 1.11 0.00 0.00 32.58 32.75 3ier s HIS 76 CO 0.39 0.64 -0.24 1.03 -0.85 0.00 0.00 174.74 175.72 3ier s ARG 77 N -3.44 1.46 0.16 1.40 0.52 -1.26 -2.85 118.95 114.95 3ier s ARG 77 Ca 0.29 -1.47 0.10 0.00 -0.52 0.00 0.00 55.73 54.13 3ier s ARG 77 Cb -0.06 -1.79 -0.04 0.00 0.52 0.00 0.00 34.95 33.58 3ier s ARG 77 CO 0.16 0.39 -0.22 0.96 0.02 0.00 0.00 175.30 176.62 3ier s ILE 78 N -1.58 2.07 -0.02 1.52 -4.36 -0.50 -1.43 121.20 116.90 3ier s ILE 78 Ca 0.19 -1.89 -0.00 0.00 -0.26 0.00 0.00 60.65 58.68 3ier s ILE 78 Cb -0.08 -1.93 -0.04 0.00 1.25 0.00 0.00 42.46 41.66 3ier s ILE 78 CO 0.09 -0.15 0.06 -0.69 0.24 0.00 0.00 174.94 174.48 3ier s VAL 79 N -1.65 4.59 -0.19 8.37 1.01 -0.62 -0.95 120.40 130.95 3ier s VAL 79 Ca 0.16 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.75 3ier s VAL 79 Cb -0.08 -3.06 0.03 0.00 0.00 0.00 0.00 36.38 33.26 3ier s VAL 79 CO 0.07 0.40 -0.18 -0.69 0.00 0.00 0.00 175.10 174.70 3ier s VAL 80 N -1.13 2.01 -0.30 2.92 1.01 -0.79 -0.39 120.40 123.74 3ier s VAL 80 Ca 0.21 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.19 3ier s VAL 80 Cb -0.12 -1.87 0.09 0.00 0.00 0.00 0.00 36.38 34.49 3ier s VAL 80 CO 0.11 0.45 0.07 0.00 0.00 0.00 0.00 175.10 175.73 3ier s SER 82 N 1.51 -0.36 0.96 0.00 0.15 -1.26 -2.19 113.70 112.52 3ier s SER 82 Ca 0.08 0.47 -0.11 0.00 0.70 0.00 0.00 55.95 57.09 3ier s SER 82 Cb -0.18 0.40 0.17 0.00 -1.71 0.00 0.00 66.02 64.70 3ier s SER 82 CO -0.20 -0.28 1.12 -1.83 1.20 0.00 0.00 173.24 173.25 3ier s GLU 83 N -0.80 0.67 0.36 5.44 1.03 -1.26 -4.66 118.70 119.47 3ier s GLU 83 Ca -0.00 1.35 -0.28 0.00 0.03 0.00 0.00 54.97 56.07 3ier s GLU 83 Cb -0.02 -1.70 -0.12 0.00 -0.80 0.00 0.00 34.13 31.50 3ier s GLU 83 CO -0.01 -2.80 1.38 0.09 -1.33 0.00 0.00 175.26 172.59 3ier n ASN 84 N -4.33 3.24 -3.70 0.83 3.02 -1.26 -4.86 115.26 108.19 3ier n ASN 84 Ca 0.10 1.22 -0.06 0.00 -0.03 0.00 0.00 54.58 55.80 3ier n ASN 84 Cb 0.53 -1.55 -0.01 0.00 -0.61 0.00 0.00 39.78 38.14 3ier n ASN 84 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3ier s SER 85 N -0.23 -0.20 0.51 6.41 1.04 -1.26 -4.59 113.70 115.38 3ier s SER 85 Ca 0.54 -0.63 0.17 0.00 0.48 0.00 0.00 55.95 56.52 3ier s SER 85 Cb -0.53 0.68 1.27 0.00 0.10 0.00 0.00 66.02 67.54 3ier s SER 85 CO 0.63 -1.27 2.13 -0.07 0.98 0.00 0.00 173.24 175.64 3ier h LEU 86 N 2.00 0.00 0.00 2.42 3.38 -1.95 -3.03 115.31 118.12 3ier h LEU 86 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3ier h LEU 86 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3ier h LEU 86 CO 0.26 0.03 -0.68 0.00 0.09 0.00 0.00 178.44 178.14 3ier n GLN 87 N -4.45 0.18 -0.15 1.13 3.00 -1.26 -4.56 117.38 111.27 3ier n GLN 87 Ca -0.03 0.03 -0.04 0.00 -0.01 0.00 0.00 57.00 56.95 3ier n GLN 87 Cb 0.12 -1.59 0.02 0.00 0.00 0.00 0.00 30.24 28.79 3ier n GLN 87 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.06 177.41 3ier h PHE 88 N 0.00 -0.48 0.00 1.08 3.04 -1.86 -1.68 116.94 117.04 3ier h PHE 88 Ca 0.00 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.00 3ier h PHE 88 Cb 0.65 0.28 0.00 0.00 2.56 0.00 0.00 35.95 39.44 3ier h PHE 88 CO 0.00 -0.28 0.00 1.19 -2.02 0.00 0.00 178.31 177.20 3ier n PHE 89 N -5.39 0.00 -0.00 0.41 3.01 -1.26 -3.97 117.46 110.25 3ier n PHE 89 Ca 0.04 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.38 3ier n PHE 89 Cb 0.30 -0.30 -0.07 0.00 -0.01 0.00 0.00 39.48 39.40 3ier n PHE 89 CO 0.00 0.00 0.00 0.52 1.01 0.00 0.00 176.76 178.29 3ier h MET 90 N 0.00 0.11 0.00 -1.08 2.86 -1.60 0.09 114.93 115.31 3ier h MET 90 Ca 0.00 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 3ier h MET 90 Cb 0.27 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 3ier h MET 90 CO 0.00 0.21 -0.36 -1.00 1.06 0.00 0.00 176.91 176.82 3ier h PRO 91 N -0.02 0.00 0.23 -0.22 0.13 -1.73 -1.90 132.00 128.48 3ier h PRO 91 Ca 0.02 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.14 3ier h PRO 91 Cb 0.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.28 3ier h PRO 91 CO -0.00 0.36 -0.11 0.28 -0.23 0.00 0.00 178.00 178.30 3ier h VAL 92 N 0.00 0.84 -0.40 1.56 2.07 -1.62 -2.18 116.25 116.51 3ier h VAL 92 Ca -0.00 -0.39 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 3ier h VAL 92 Cb 1.01 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 3ier h VAL 92 CO 0.05 0.09 0.22 -0.07 0.02 0.00 0.00 177.57 177.87 3ier h LEU 93 N -0.50 0.50 -0.72 2.57 3.38 -1.01 -1.92 115.31 117.61 3ier h LEU 93 Ca -0.03 -0.09 0.07 0.00 0.09 0.00 0.00 57.88 57.92 3ier h LEU 93 Cb 0.38 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 3ier h LEU 93 CO 0.05 0.45 0.39 1.23 0.09 0.00 0.00 178.44 180.65 3ier h GLY 94 N 0.51 1.07 1.02 0.83 0.00 -1.31 -0.99 103.07 104.20 3ier h GLY 94 Ca 0.14 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 3ier h GLY 94 CO -0.02 0.13 0.05 0.00 0.00 0.00 0.00 176.54 176.70 3ier h ALA 95 N 1.39 0.72 -0.35 3.60 0.00 -1.24 -2.88 119.26 120.50 3ier h ALA 95 Ca 0.33 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3ier h ALA 95 Cb 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3ier h ALA 95 CO -0.22 0.50 0.02 -0.07 0.00 0.00 0.00 179.25 179.49 3ier h LEU 96 N 0.80 0.50 -1.96 0.00 3.38 -0.95 0.22 115.31 117.31 3ier h LEU 96 Ca 0.16 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3ier h LEU 96 Cb 0.46 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 3ier h LEU 96 CO 0.02 0.56 -0.11 -0.26 0.09 0.00 0.00 178.44 178.74 3ier h PHE 97 N 0.52 0.00 0.00 1.13 0.04 -0.98 -3.13 116.94 114.53 3ier h PHE 97 Ca 0.11 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.88 3ier h PHE 97 Cb 0.30 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.45 3ier h PHE 97 CO 0.01 0.11 -0.00 0.44 -0.60 0.00 0.00 178.31 178.27 3ier n ILE 98 N -3.84 1.12 -1.09 -0.55 -5.35 -0.25 -1.27 119.36 108.13 3ier n ILE 98 Ca -0.02 -1.17 -0.01 0.00 -0.27 0.00 0.00 62.75 61.27 3ier n ILE 98 Cb 0.21 0.40 -0.01 0.00 -1.74 0.00 0.00 39.64 38.50 3ier n ILE 98 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3ier n GLY 99 N -0.63 0.48 3.68 3.28 0.00 0.60 -4.41 105.19 108.20 3ier n GLY 99 Ca 0.02 -1.02 -0.38 0.00 0.00 0.00 0.00 46.02 44.64 3ier n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ier s VAL 100 N -2.05 5.18 0.46 1.61 1.01 -0.37 -4.10 120.40 122.14 3ier s VAL 100 Ca 0.00 0.80 -0.23 0.00 0.00 0.00 0.00 61.98 62.55 3ier s VAL 100 Cb 0.00 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 3ier s VAL 100 CO 0.00 0.26 1.21 0.00 0.00 0.00 0.00 175.10 176.57 3ier s ALA 101 N 1.17 2.99 -0.14 5.51 0.00 -1.13 -4.24 121.76 125.92 3ier s ALA 101 Ca 0.21 1.03 0.00 0.00 0.00 0.00 0.00 51.96 53.21 3ier s ALA 101 Cb -0.15 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.54 3ier s ALA 101 CO 0.08 -0.78 -0.14 0.08 0.00 0.00 0.00 175.76 175.01 3ier s VAL 102 N -1.46 2.84 -0.32 0.00 1.01 -0.33 -1.40 120.40 120.73 3ier s VAL 102 Ca 0.63 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.91 3ier s VAL 102 Cb -0.32 -2.20 0.08 0.00 0.00 0.00 0.00 36.38 33.95 3ier s VAL 102 CO 0.39 0.52 0.02 0.00 0.00 0.00 0.00 175.10 176.02 3ier s ALA 103 N 0.62 2.84 0.05 5.51 0.00 -0.13 -1.08 121.76 129.56 3ier s ALA 103 Ca -0.08 -2.21 -0.30 0.00 0.00 0.00 0.00 51.96 49.37 3ier s ALA 103 Cb -0.16 -1.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 3ier s ALA 103 CO 0.03 -1.51 0.97 -2.14 0.00 0.00 0.00 175.76 173.10 3ier s PRO 104 N 1.04 4.62 -0.16 0.00 0.02 -1.25 -1.88 135.00 137.39 3ier s PRO 104 Ca 0.03 1.42 -0.03 0.00 0.02 0.00 0.00 61.00 62.44 3ier s PRO 104 Cb -0.20 -3.42 -0.02 0.00 0.02 0.00 0.00 34.50 30.88 3ier s PRO 104 CO -0.06 0.07 -0.06 0.00 -0.33 0.00 0.00 177.00 176.62 3ier s ALA 105 N 0.56 2.86 -0.18 -1.55 0.00 -0.20 -4.67 121.76 118.57 3ier s ALA 105 Ca 0.49 -0.90 -0.40 0.00 0.00 0.00 0.00 51.96 51.15 3ier s ALA 105 Cb -0.22 -1.48 -0.17 0.00 0.00 0.00 0.00 23.12 21.25 3ier s ALA 105 CO 0.29 0.11 1.58 -1.71 0.00 0.00 0.00 175.76 176.02 3ier n ASN 106 N 3.76 1.93 -0.14 0.00 2.85 -1.26 -4.22 115.26 118.17 3ier n ASN 106 Ca -0.18 1.10 0.13 0.00 -0.11 0.00 0.00 54.58 55.53 3ier n ASN 106 Cb 0.52 -1.12 0.71 0.00 1.24 0.00 0.00 39.78 41.14 3ier n ASN 106 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 3ier n ASP 107 N 4.22 0.44 -0.38 1.20 5.75 -1.26 -2.50 116.55 124.03 3ier n ASP 107 Ca 0.24 -1.27 0.06 0.00 -0.01 0.00 0.00 54.79 53.81 3ier n ASP 107 Cb 0.12 -0.01 0.03 0.00 -1.03 0.00 0.00 41.12 40.23 3ier n ASP 107 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 3ier n ILE 108 N -0.60 0.00 -1.59 2.12 -6.64 -1.26 -4.94 119.36 106.45 3ier n ILE 108 Ca 0.20 -0.45 -0.47 0.00 -1.77 0.00 0.00 62.75 60.26 3ier n ILE 108 Cb 0.16 1.20 -0.03 0.00 -1.44 0.00 0.00 39.64 39.53 3ier n ILE 108 CO 0.00 0.00 0.00 -1.22 -1.77 0.00 0.00 176.55 173.56 3ier n TYR 109 N 0.27 1.35 -1.78 4.28 4.01 -1.04 -4.99 117.16 119.27 3ier n TYR 109 Ca 0.06 0.67 -0.28 0.00 -0.16 0.00 0.00 57.90 58.19 3ier n TYR 109 Cb 0.27 -2.28 0.20 0.00 -0.31 0.00 0.00 39.34 37.22 3ier n TYR 109 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3ier n ASN 110 N 1.75 -0.12 -0.10 7.72 0.23 -1.26 -4.73 115.26 118.75 3ier n ASN 110 Ca 0.13 -1.42 0.26 0.00 -0.53 0.00 0.00 54.58 53.02 3ier n ASN 110 Cb 0.28 -0.95 0.72 0.00 -2.08 0.00 0.00 39.78 37.75 3ier n ASN 110 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3ier h GLU 111 N 0.00 0.00 0.03 -3.83 3.07 -1.94 -2.48 114.58 109.43 3ier h GLU 111 Ca -0.40 0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.40 3ier h GLU 111 Cb 1.12 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.03 3ier h GLU 111 CO 0.28 0.00 -0.24 0.00 -1.40 0.00 0.00 179.01 177.65 3ier h ARG 112 N 0.00 0.11 0.00 2.33 3.08 -1.99 -1.28 114.38 116.62 3ier h ARG 112 Ca 0.36 -0.16 -0.09 0.00 0.07 0.00 0.00 59.98 60.16 3ier h ARG 112 Cb 1.58 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.68 3ier h ARG 112 CO -0.00 1.02 -0.43 0.93 -1.07 0.00 0.00 179.97 180.42 3ier h GLU 113 N -0.73 0.00 -0.29 0.04 5.08 -1.88 -1.70 114.58 115.09 3ier h GLU 113 Ca -0.04 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.25 3ier h GLU 113 Cb 1.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3ier h GLU 113 CO 0.05 0.43 -0.10 1.25 -1.00 0.00 0.00 179.01 179.63 3ier h LEU 114 N 0.00 0.60 -0.58 1.33 5.85 -1.48 -0.76 115.31 120.27 3ier h LEU 114 Ca -0.00 -0.38 -0.07 0.00 0.84 0.00 0.00 57.88 58.26 3ier h LEU 114 Cb 0.92 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 3ier h LEU 114 CO 0.06 0.84 0.09 0.25 -0.34 0.00 0.00 178.44 179.33 3ier h LEU 115 N 0.34 0.92 -0.04 2.25 5.85 -0.97 -0.29 115.31 123.38 3ier h LEU 115 Ca 0.07 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.54 3ier h LEU 115 Cb 0.60 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 3ier h LEU 115 CO 0.03 0.95 -0.02 -1.13 -0.34 0.00 0.00 178.44 177.94 3ier h ASN 116 N 0.86 -0.06 -0.12 1.25 -0.73 -1.14 0.46 115.58 116.10 3ier h ASN 116 Ca 0.17 0.01 0.03 0.00 1.87 0.00 0.00 56.30 58.39 3ier h ASN 116 Cb 0.43 0.03 -0.03 0.00 0.27 0.00 0.00 38.32 39.02 3ier h ASN 116 CO 0.01 -0.02 -0.07 -1.28 -0.37 0.00 0.00 177.43 175.70 3ier h SER 117 N -0.01 -0.23 1.50 1.15 0.87 -0.98 -2.67 113.55 113.19 3ier h SER 117 Ca 0.02 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3ier h SER 117 Cb 0.04 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 3ier h SER 117 CO -0.05 -0.10 0.00 0.24 -0.53 0.00 0.00 176.83 176.40 3ier h MET 118 N -0.07 0.00 0.00 2.24 2.86 -0.82 -2.21 114.93 116.93 3ier h MET 118 Ca 0.07 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.62 3ier h MET 118 Cb 0.17 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 3ier h MET 118 CO -0.16 0.00 -0.45 -0.97 1.06 0.00 0.00 176.91 176.39 3ier h ASN 119 N 0.00 0.00 0.05 1.22 -1.24 0.09 -1.38 115.58 114.32 3ier h ASN 119 Ca 0.00 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 3ier h ASN 119 Cb 0.75 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.81 3ier h ASN 119 CO 0.00 0.45 -0.35 0.40 -1.29 0.00 0.00 177.43 176.64 3ier h ILE 120 N 0.00 1.63 0.00 2.57 2.04 -1.07 -3.36 117.51 119.33 3ier h ILE 120 Ca -0.00 -2.30 -0.10 0.00 1.00 0.00 0.00 64.86 63.45 3ier h ILE 120 Cb 0.90 3.16 -0.01 0.00 -0.74 0.00 0.00 36.82 40.12 3ier h ILE 120 CO 0.06 0.63 -0.49 0.77 0.00 0.00 0.00 178.15 179.12 3ier h SER 121 N -0.64 0.00 -6.03 1.72 4.64 -1.48 -3.49 113.55 108.27 3ier h SER 121 Ca -0.06 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 60.95 3ier h SER 121 Cb 1.22 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.37 3ier h SER 121 CO 0.07 0.49 -0.73 0.00 -0.87 0.00 0.00 176.83 175.78 3ier n GLN 122 N -3.52 -1.40 -2.87 4.77 1.13 -0.52 -4.79 117.38 110.18 3ier n GLN 122 Ca -0.00 0.81 -0.34 0.00 -1.94 0.00 0.00 57.00 55.54 3ier n GLN 122 Cb 0.60 -4.36 -0.07 0.00 0.11 0.00 0.00 30.24 26.52 3ier n GLN 122 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 3ier s PRO 123 N -4.89 4.25 -0.02 -1.09 0.04 -1.26 -4.53 135.00 127.50 3ier s PRO 123 Ca 0.27 1.07 -0.05 0.00 0.04 0.00 0.00 61.00 62.33 3ier s PRO 123 Cb -0.09 -2.34 -0.28 0.00 0.04 0.00 0.00 34.50 31.83 3ier s PRO 123 CO 0.83 0.06 0.75 1.15 0.04 0.00 0.00 177.00 179.83 3ier h THR 124 N 2.06 1.03 -4.19 1.26 2.02 -1.43 -3.22 112.91 110.43 3ier h THR 124 Ca -0.48 -2.66 -0.53 0.00 0.77 0.00 0.00 66.41 63.50 3ier h THR 124 Cb 1.18 2.72 -0.30 0.00 -1.74 0.00 0.00 68.15 70.02 3ier h THR 124 CO 0.62 0.82 -0.83 -0.69 0.37 0.00 0.00 175.52 175.82 3ier s VAL 125 N -2.60 1.29 -0.16 3.16 1.01 -1.24 -1.26 120.40 120.61 3ier s VAL 125 Ca -0.12 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.19 3ier s VAL 125 Cb 0.06 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 35.37 3ier s VAL 125 CO 0.85 0.37 -0.21 -0.69 0.00 0.00 0.00 175.10 175.42 3ier s VAL 126 N -0.28 2.10 -0.18 2.92 1.01 -0.47 -1.60 120.40 123.90 3ier s VAL 126 Ca 0.04 -0.95 -0.16 0.00 0.00 0.00 0.00 61.98 60.91 3ier s VAL 126 Cb -0.07 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 3ier s VAL 126 CO -0.00 0.54 0.39 -0.36 0.00 0.00 0.00 175.10 175.67 3ier s PHE 127 N 1.01 3.41 0.02 5.22 0.40 0.48 -1.15 117.98 127.37 3ier s PHE 127 Ca -0.02 0.65 0.01 0.00 -0.60 0.00 0.00 56.93 56.97 3ier s PHE 127 Cb -0.14 -2.50 -0.01 0.00 0.51 0.00 0.00 43.02 40.88 3ier s PHE 127 CO -0.06 0.06 -0.04 0.54 0.70 0.00 0.00 175.22 176.42 3ier s VAL 128 N 1.06 0.27 0.83 -0.44 0.11 -0.31 -0.95 120.40 120.97 3ier s VAL 128 Ca 0.20 -0.58 -0.10 0.00 -2.93 0.00 0.00 61.98 58.56 3ier s VAL 128 Cb -0.14 -0.32 0.10 0.00 -1.53 0.00 0.00 36.38 34.49 3ier s VAL 128 CO 0.07 -0.21 1.12 -0.94 -3.33 0.00 0.00 175.10 171.82 3ier s SER 129 N -0.83 3.80 0.28 3.54 1.04 -0.93 -0.66 113.70 119.94 3ier s SER 129 Ca -0.06 1.99 0.02 0.00 0.48 0.00 0.00 55.95 58.38 3ier s SER 129 Cb -0.06 -2.54 0.64 0.00 0.10 0.00 0.00 66.02 64.16 3ier s SER 129 CO -0.00 -2.51 1.77 0.11 0.98 0.00 0.00 173.24 173.59 3ier h LYS 130 N -1.45 0.68 0.00 4.02 1.57 -1.94 -1.62 116.57 117.83 3ier h LYS 130 Ca -0.43 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3ier h LYS 130 Cb 1.25 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.40 3ier h LYS 130 CO 0.47 0.45 0.00 0.36 -0.57 0.00 0.00 179.45 180.16 3ier n LYS 131 N -4.82 0.03 0.00 3.15 2.85 -1.26 -2.58 118.16 115.53 3ier n LYS 131 Ca 0.20 0.14 0.11 0.00 -1.05 0.00 0.00 58.31 57.71 3ier n LYS 131 Cb 0.50 -1.54 0.01 0.00 -0.65 0.00 0.00 35.03 33.35 3ier n LYS 131 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3ier n GLY 132 N 0.81 0.18 0.15 2.58 0.00 -0.62 -4.66 105.19 103.64 3ier n GLY 132 Ca 0.05 -0.64 -0.07 0.00 0.00 0.00 0.00 46.02 45.37 3ier n GLY 132 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3ier h LEU 133 N 2.75 0.13 -0.45 0.99 5.85 -1.41 -2.39 115.31 120.78 3ier h LEU 133 Ca 0.00 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.80 3ier h LEU 133 Cb 0.78 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 3ier h LEU 133 CO 0.00 0.11 0.22 1.56 -0.34 0.00 0.00 178.44 179.99 3ier h GLN 134 N 0.27 0.42 -0.69 1.25 1.08 -1.83 -0.62 115.11 114.99 3ier h GLN 134 Ca 0.15 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 3ier h GLN 134 Cb 0.13 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 3ier h GLN 134 CO -0.16 0.28 0.45 0.87 -0.95 0.00 0.00 178.83 179.32 3ier h LYS 135 N 0.43 0.92 -0.66 1.46 1.57 -1.80 -1.12 116.57 117.38 3ier h LYS 135 Ca 0.20 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 3ier h LYS 135 Cb 0.12 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 3ier h LYS 135 CO -0.15 0.62 0.17 0.82 -0.57 0.00 0.00 179.45 180.34 3ier h ILE 136 N 0.94 1.25 -0.59 1.86 1.08 -0.97 -0.51 117.51 120.57 3ier h ILE 136 Ca 0.25 -0.90 -0.06 0.00 -0.39 0.00 0.00 64.86 63.76 3ier h ILE 136 Cb -0.09 0.56 -0.03 0.00 -3.07 0.00 0.00 36.82 34.19 3ier h ILE 136 CO -0.05 0.34 0.11 -0.07 -0.69 0.00 0.00 178.15 177.79 3ier h LEU 137 N 0.98 0.89 -0.37 1.44 3.38 -0.75 0.14 115.31 121.02 3ier h LEU 137 Ca 0.21 -0.19 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 3ier h LEU 137 Cb 0.32 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3ier h LEU 137 CO -0.00 0.89 -0.45 0.78 0.09 0.00 0.00 178.44 179.74 3ier h ASN 138 N 0.89 0.97 -0.64 -0.43 2.35 -0.81 -2.78 115.58 115.13 3ier h ASN 138 Ca 0.19 -0.47 -0.02 0.00 -0.55 0.00 0.00 56.30 55.44 3ier h ASN 138 Cb 0.37 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 3ier h ASN 138 CO 0.01 1.27 0.32 0.58 -1.65 0.00 0.00 177.43 177.96 3ier h VAL 139 N 0.71 1.22 -0.36 2.81 2.07 -0.86 -3.03 116.25 118.80 3ier h VAL 139 Ca 0.04 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 3ier h VAL 139 Cb 1.05 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 3ier h VAL 139 CO 0.11 0.25 0.22 -0.61 0.02 0.00 0.00 177.57 177.55 3ier h GLN 140 N 0.89 0.48 -0.77 1.57 4.15 -0.52 0.31 115.11 121.22 3ier h GLN 140 Ca 0.22 -0.03 0.21 0.00 0.77 0.00 0.00 58.65 59.82 3ier h GLN 140 Cb 0.09 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.64 3ier h GLN 140 CO -0.03 0.34 0.55 0.87 -1.93 0.00 0.00 178.83 178.62 3ier h LYS 141 N 0.50 0.05 -0.01 1.69 1.57 -1.37 -2.35 116.57 116.65 3ier h LYS 141 Ca 0.13 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3ier h LYS 141 Cb -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3ier h LYS 141 CO -0.03 0.03 -0.40 1.63 -0.57 0.00 0.00 179.45 180.11 3ier n LYS 142 N -4.33 1.70 -3.58 3.15 5.02 0.97 -4.72 118.16 116.37 3ier n LYS 142 Ca 0.15 -0.68 -0.28 0.00 -2.02 0.00 0.00 58.31 55.48 3ier n LYS 142 Cb 0.80 -1.27 -0.11 0.00 -0.02 0.00 0.00 35.03 34.43 3ier n LYS 142 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ier s LEU 143 N -2.16 2.60 0.29 -0.35 1.43 -0.53 -4.97 118.68 114.99 3ier s LEU 143 Ca 0.12 -3.28 0.20 0.00 -1.03 0.00 0.00 54.13 50.15 3ier s LEU 143 Cb 0.13 -0.87 1.07 0.00 0.03 0.00 0.00 46.19 46.55 3ier s LEU 143 CO 0.45 -0.15 1.62 -0.81 0.23 0.00 0.00 176.35 177.69 3ier n PRO 144 N 2.63 0.14 0.11 1.29 -0.04 -1.24 -1.80 135.00 136.08 3ier n PRO 144 Ca 0.25 0.60 0.18 0.00 -0.04 0.00 0.00 63.50 64.49 3ier n PRO 144 Cb 0.43 -1.92 0.75 0.00 -0.04 0.00 0.00 33.50 32.71 3ier n PRO 144 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 3ier h ILE 145 N 0.00 0.60 -2.17 0.52 2.10 -1.90 -3.37 117.51 113.30 3ier h ILE 145 Ca 0.00 0.00 -0.52 0.00 1.08 0.00 0.00 64.86 65.42 3ier h ILE 145 Cb 0.05 0.78 -0.04 0.00 -1.09 0.00 0.00 36.82 36.52 3ier h ILE 145 CO 0.00 0.00 1.31 -0.63 -1.08 0.00 0.00 178.15 177.75 3ier s ILE 146 N -4.82 3.43 -0.21 2.19 1.01 -0.75 -4.32 121.20 117.73 3ier s ILE 146 Ca -0.05 0.29 0.21 0.00 0.00 0.00 0.00 60.65 61.10 3ier s ILE 146 Cb 0.17 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.64 3ier s ILE 146 CO 0.63 -0.90 1.03 1.56 0.00 0.00 0.00 174.94 177.26 3ier h GLN 147 N 14.15 0.00 -2.40 2.79 4.20 -1.35 -3.48 115.11 129.01 3ier h GLN 147 Ca -0.27 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.37 3ier h GLN 147 Cb 1.15 0.00 -0.24 0.00 0.30 0.00 0.00 27.48 28.69 3ier h GLN 147 CO 1.19 0.10 -0.16 0.21 -0.67 0.00 0.00 178.83 179.50 3ier s LYS 148 N -3.22 0.54 -0.12 1.46 2.47 -1.21 -5.05 119.74 114.60 3ier s LYS 148 Ca -0.01 0.92 0.03 0.00 -1.56 0.00 0.00 55.97 55.35 3ier s LYS 148 Cb 0.09 0.09 0.01 0.00 -1.46 0.00 0.00 37.83 36.56 3ier s LYS 148 CO 0.79 -0.14 -0.22 0.42 0.16 0.00 0.00 175.35 176.36 3ier s ILE 149 N 1.24 2.02 -0.09 5.43 1.01 -1.26 -1.37 121.20 128.19 3ier s ILE 149 Ca -0.08 -0.97 0.05 0.00 0.00 0.00 0.00 60.65 59.65 3ier s ILE 149 Cb -0.06 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.63 3ier s ILE 149 CO -0.12 0.55 -0.24 -0.63 0.00 0.00 0.00 174.94 174.49 3ier s ILE 150 N 0.65 2.07 -0.12 2.92 1.01 -0.30 -4.35 121.20 123.08 3ier s ILE 150 Ca -0.11 -1.03 -0.23 0.00 0.00 0.00 0.00 60.65 59.28 3ier s ILE 150 Cb -0.16 -1.77 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 3ier s ILE 150 CO 0.02 0.56 0.71 -0.63 0.00 0.00 0.00 174.94 175.60 3ier s ILE 151 N 0.18 5.01 -0.07 2.92 -1.09 -0.21 -1.16 121.20 126.77 3ier s ILE 151 Ca -0.14 1.41 -0.22 0.00 -2.23 0.00 0.00 60.65 59.47 3ier s ILE 151 Cb -0.17 -4.03 -0.30 0.00 -1.58 0.00 0.00 42.46 36.38 3ier s ILE 151 CO 0.07 0.17 0.81 0.24 -1.23 0.00 0.00 174.94 175.01 3ier h MET 152 N 7.04 0.24 -1.59 2.79 2.86 -1.22 -2.78 114.93 122.27 3ier h MET 152 Ca -0.36 -0.40 -0.70 0.00 -2.06 0.00 0.00 59.70 56.17 3ier h MET 152 Cb 1.17 0.15 -0.31 0.00 0.06 0.00 0.00 31.60 32.67 3ier h MET 152 CO 0.78 1.19 0.57 -0.40 1.06 0.00 0.00 176.91 180.11 3ier n ASP 153 N -4.19 6.89 -4.06 1.22 5.75 -1.26 -4.72 116.55 116.18 3ier n ASP 153 Ca -0.15 -3.80 -0.14 0.00 -0.01 0.00 0.00 54.79 50.69 3ier n ASP 153 Cb 0.77 -0.89 -0.12 0.00 -1.03 0.00 0.00 41.12 39.86 3ier n ASP 153 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3ier s SER 154 N -1.87 0.94 -0.13 -1.12 0.15 -1.26 -4.86 113.70 105.55 3ier s SER 154 Ca 0.54 -0.49 -0.11 0.00 0.70 0.00 0.00 55.95 56.59 3ier s SER 154 Cb 0.45 0.01 -0.09 0.00 -1.71 0.00 0.00 66.02 64.67 3ier s SER 154 CO -0.25 -0.14 0.17 0.11 1.20 0.00 0.00 173.24 174.33 3ier h LYS 155 N 4.70 0.00 -7.62 5.44 1.79 -1.93 -3.41 116.57 115.54 3ier h LYS 155 Ca -0.35 0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.66 3ier h LYS 155 Cb 1.20 0.00 0.12 0.00 -1.58 0.00 0.00 32.23 31.97 3ier h LYS 155 CO 0.42 0.36 0.37 0.95 -1.08 0.00 0.00 179.45 180.47 3ier s THR 156 N -1.95 2.05 0.83 -0.16 -4.23 -1.26 -4.31 115.64 106.60 3ier s THR 156 Ca -0.11 -0.07 -0.15 0.00 -1.18 0.00 0.00 61.69 60.18 3ier s THR 156 Cb 0.00 -2.98 -0.02 0.00 1.34 0.00 0.00 72.50 70.85 3ier s THR 156 CO 0.28 0.00 0.41 0.47 -0.54 0.00 0.00 174.62 175.24 3ier n ASP 157 N -3.39 -1.80 -3.54 3.99 9.92 -1.26 -4.20 116.55 116.26 3ier n ASP 157 Ca 0.11 0.47 -0.22 0.00 -0.53 0.00 0.00 54.79 54.62 3ier n ASP 157 Cb 0.60 -1.19 -0.15 0.00 -0.64 0.00 0.00 41.12 39.75 3ier n ASP 157 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 3ier s TYR 158 N -2.11 -0.07 -1.40 1.24 5.04 -0.07 -4.87 117.35 115.11 3ier s TYR 158 Ca 0.61 -0.02 -0.10 0.00 -2.44 0.00 0.00 57.07 55.12 3ier s TYR 158 Cb -0.29 -0.51 0.03 0.00 0.35 0.00 0.00 41.96 41.55 3ier s TYR 158 CO 0.63 -0.57 1.12 1.04 -1.34 0.00 0.00 175.55 176.43 3ier n GLN 159 N 5.30 -7.23 -0.64 4.97 6.02 -1.26 -1.23 117.38 123.31 3ier n GLN 159 Ca -0.06 0.76 0.00 0.00 -0.01 0.00 0.00 57.00 57.69 3ier n GLN 159 Cb 0.49 -5.77 0.00 0.00 1.02 0.00 0.00 30.24 25.98 3ier n GLN 159 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ier n GLY 160 N -1.89 1.36 3.88 1.08 0.00 -1.26 -5.03 105.19 103.34 3ier n GLY 160 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3ier n GLY 160 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ier s PHE 161 N -3.51 3.58 0.64 1.61 0.40 -0.36 -5.10 117.98 115.24 3ier s PHE 161 Ca 0.00 0.48 -0.16 0.00 -0.60 0.00 0.00 56.93 56.65 3ier s PHE 161 Cb 0.00 -1.91 -0.01 0.00 0.51 0.00 0.00 43.02 41.62 3ier s PHE 161 CO 0.00 0.71 1.13 -0.65 0.70 0.00 0.00 175.22 177.11 3ier s GLN 162 N -1.28 2.82 0.71 0.44 -0.21 -1.26 -0.89 119.66 119.98 3ier s GLN 162 Ca 0.18 1.51 -0.01 0.00 0.02 0.00 0.00 55.36 57.07 3ier s GLN 162 Cb -0.12 -1.94 0.12 0.00 1.00 0.00 0.00 33.01 32.06 3ier s GLN 162 CO 0.08 -1.25 0.98 -1.54 -2.12 0.00 0.00 175.29 171.43 3ier s SER 163 N -2.29 4.44 0.22 5.90 1.04 -1.26 -1.04 113.70 120.70 3ier s SER 163 Ca 0.70 -0.31 -0.06 0.00 0.48 0.00 0.00 55.95 56.75 3ier s SER 163 Cb -0.23 -0.12 0.19 0.00 0.10 0.00 0.00 66.02 65.96 3ier s SER 163 CO 0.39 -1.80 1.75 0.24 0.98 0.00 0.00 173.24 174.80 3ier h MET 164 N -0.48 1.06 -0.11 4.02 0.00 -1.72 0.50 114.93 118.21 3ier h MET 164 Ca -0.37 -0.25 -0.01 0.00 0.00 0.00 0.00 59.70 59.07 3ier h MET 164 Cb 1.27 -0.14 -0.00 0.00 0.00 0.00 0.00 31.60 32.72 3ier h MET 164 CO 0.42 0.94 0.02 1.88 0.00 0.00 0.00 176.91 180.17 3ier h TYR 165 N 1.01 0.19 0.00 -0.22 -1.99 -1.83 -1.32 116.97 112.82 3ier h TYR 165 Ca 0.21 -0.03 -0.10 0.00 2.00 0.00 0.00 58.73 60.81 3ier h TYR 165 Cb 0.36 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 3ier h TYR 165 CO 0.03 0.37 -0.49 1.79 -0.00 0.00 0.00 178.16 179.86 3ier h THR 166 N -0.05 0.88 -0.19 -2.88 1.35 -1.73 -1.80 112.91 108.49 3ier h THR 166 Ca 0.03 -2.12 -0.01 0.00 -0.55 0.00 0.00 66.41 63.77 3ier h THR 166 Cb 0.29 2.35 -0.01 0.00 -1.73 0.00 0.00 68.15 69.05 3ier h THR 166 CO 0.00 0.48 0.10 0.15 -0.25 0.00 0.00 175.52 176.00 3ier h PHE 167 N 0.00 0.27 0.00 4.73 3.57 -0.83 -1.57 116.94 123.11 3ier h PHE 167 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 3ier h PHE 167 Cb 1.31 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.96 3ier h PHE 167 CO 0.00 0.27 -0.00 0.28 -2.23 0.00 0.00 178.31 176.63 3ier h VAL 168 N 0.19 1.00 -0.04 1.41 2.07 -1.10 -2.29 116.25 117.49 3ier h VAL 168 Ca 0.07 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.59 3ier h VAL 168 Cb 0.10 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3ier h VAL 168 CO -0.01 0.00 0.03 0.74 0.02 0.00 0.00 177.57 178.35 3ier h THR 169 N -0.00 0.86 0.00 2.57 2.02 -1.28 -0.22 112.91 116.86 3ier h THR 169 Ca -0.00 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.09 3ier h THR 169 Cb 0.00 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 3ier h THR 169 CO 0.00 0.00 -0.43 0.28 0.37 0.00 0.00 175.52 175.74 3ier h SER 170 N 0.00 0.00 0.00 4.18 0.02 -0.71 -3.36 113.55 113.68 3ier h SER 170 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3ier h SER 170 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 3ier h SER 170 CO -0.00 0.43 -0.19 1.41 -1.14 0.00 0.00 176.83 177.34 3ier n HIS 171 N -3.81 0.00 -2.41 3.45 -0.00 -0.66 -5.03 115.22 106.75 3ier n HIS 171 Ca -0.01 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.30 3ier n HIS 171 Cb 0.49 -0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.44 3ier n HIS 171 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3ier s LEU 172 N -2.20 4.51 0.80 2.41 1.43 -0.18 -4.79 118.68 120.66 3ier s LEU 172 Ca 0.00 2.30 -0.11 0.00 -1.03 0.00 0.00 54.13 55.30 3ier s LEU 172 Cb 0.01 -3.62 0.07 0.00 0.03 0.00 0.00 46.19 42.68 3ier s LEU 172 CO 0.07 -0.24 1.09 -2.16 0.23 0.00 0.00 176.35 175.33 3ier s PRO 173 N -1.17 2.09 0.31 1.29 0.04 -1.26 -4.96 135.00 131.34 3ier s PRO 173 Ca 0.47 0.94 -0.30 0.00 0.04 0.00 0.00 61.00 62.15 3ier s PRO 173 Cb -0.33 -1.90 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 3ier s PRO 173 CO 0.41 -1.69 1.54 -2.30 0.04 0.00 0.00 177.00 175.00 3ier n PRO 174 N -3.53 2.63 -1.00 0.56 -0.02 -1.26 -2.47 135.00 129.91 3ier n PRO 174 Ca 0.08 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 3ier n PRO 174 Cb 0.54 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 3ier n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ier n GLY 175 N 1.69 0.51 3.64 -1.23 0.00 -1.26 -4.97 105.19 103.57 3ier n GLY 175 Ca 0.07 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.60 3ier n GLY 175 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ier n PHE 176 N -2.93 1.97 -4.09 1.61 7.35 -1.03 -4.97 117.46 115.38 3ier n PHE 176 Ca 0.00 0.42 -0.32 0.00 -0.76 0.00 0.00 57.45 56.78 3ier n PHE 176 Cb 0.01 -2.46 -0.16 0.00 0.35 0.00 0.00 39.48 37.23 3ier n PHE 176 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 3ier s ASN 177 N 0.73 3.53 0.43 -2.13 3.84 -1.26 -5.00 114.94 115.08 3ier s ASN 177 Ca 0.81 -0.89 0.20 0.00 0.21 0.00 0.00 52.86 53.18 3ier s ASN 177 Cb -0.79 -1.46 0.95 0.00 -0.55 0.00 0.00 41.25 39.41 3ier s ASN 177 CO 0.41 -0.08 1.88 -0.33 -2.79 0.00 0.00 177.10 176.20 3ier h GLU 178 N 7.90 0.00 0.00 0.43 3.07 -1.94 -2.27 114.58 121.77 3ier h GLU 178 Ca -0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.51 3ier h GLU 178 Cb 1.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.01 3ier h GLU 178 CO 0.56 0.28 -0.47 0.66 -1.40 0.00 0.00 179.01 178.65 3ier n TYR 179 N -3.73 0.01 0.24 4.33 4.02 -1.26 -3.67 117.16 117.09 3ier n TYR 179 Ca -0.01 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 57.99 3ier n TYR 179 Cb 0.38 -0.28 -0.00 0.00 -0.02 0.00 0.00 39.34 39.43 3ier n TYR 179 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3ier n ASP 180 N -1.51 0.66 -4.72 7.72 8.00 -0.90 -4.98 116.55 120.82 3ier n ASP 180 Ca 0.06 0.14 -0.41 0.00 0.71 0.00 0.00 54.79 55.28 3ier n ASP 180 Cb 0.34 0.72 0.01 0.00 -0.02 0.00 0.00 41.12 42.17 3ier n ASP 180 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3ier n PHE 181 N -2.40 2.33 -4.15 1.24 -0.00 -0.95 -5.01 117.46 108.51 3ier n PHE 181 Ca 0.00 0.50 -0.30 0.00 -0.00 0.00 0.00 57.45 57.65 3ier n PHE 181 Cb 0.52 -2.41 -0.16 0.00 -0.00 0.00 0.00 39.48 37.42 3ier n PHE 181 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 3ier s VAL 182 N -1.17 1.61 0.79 -2.13 1.01 -1.26 -5.06 120.40 114.20 3ier s VAL 182 Ca 0.59 -0.67 -0.13 0.00 0.00 0.00 0.00 61.98 61.77 3ier s VAL 182 Cb -0.51 -1.49 0.08 0.00 0.00 0.00 0.00 36.38 34.45 3ier s VAL 182 CO 0.59 0.46 1.18 -2.16 0.00 0.00 0.00 175.10 175.18 3ier s PRO 183 N 1.33 1.77 0.55 2.72 0.04 -1.26 -4.97 135.00 135.19 3ier s PRO 183 Ca 0.02 1.65 -0.19 0.00 0.04 0.00 0.00 61.00 62.51 3ier s PRO 183 Cb -0.13 -1.80 -0.05 0.00 0.04 0.00 0.00 34.50 32.55 3ier s PRO 183 CO -0.08 -2.09 1.13 -1.21 0.04 0.00 0.00 177.00 174.79 3ier s GLU 184 N -4.24 3.29 -0.09 4.56 0.41 -0.40 -5.00 118.70 117.23 3ier s GLU 184 Ca 0.71 1.60 0.01 0.00 -0.41 0.00 0.00 54.97 56.88 3ier s GLU 184 Cb -0.26 -2.00 -0.02 0.00 -1.78 0.00 0.00 34.13 30.07 3ier s GLU 184 CO 0.50 -0.90 -0.12 0.45 -0.49 0.00 0.00 175.26 174.71 3ier s SER 185 N -1.83 4.20 0.25 -0.19 0.15 -1.26 -4.75 113.70 110.26 3ier s SER 185 Ca 0.72 -0.21 -0.22 0.00 0.70 0.00 0.00 55.95 56.95 3ier s SER 185 Cb -0.24 -1.28 0.04 0.00 -1.71 0.00 0.00 66.02 62.83 3ier s SER 185 CO 0.28 0.26 0.80 0.72 1.20 0.00 0.00 173.24 176.51 3ier s PHE 186 N -0.24 -0.15 -0.19 3.44 -0.12 -1.26 -5.12 117.98 114.34 3ier s PHE 186 Ca 0.02 -0.27 -0.29 0.00 -0.05 0.00 0.00 56.93 56.33 3ier s PHE 186 Cb -0.13 0.70 -0.03 0.00 -0.63 0.00 0.00 43.02 42.93 3ier s PHE 186 CO 0.03 -1.13 1.54 0.34 -0.05 0.00 0.00 175.22 175.95 3ier s ASP 187 N -2.94 6.54 0.00 1.98 3.68 -1.26 -4.77 116.67 119.90 3ier s ASP 187 Ca 0.12 1.70 0.29 0.00 2.13 0.00 0.00 52.55 56.79 3ier s ASP 187 Cb -0.05 -2.53 1.25 0.00 -1.45 0.00 0.00 42.92 40.14 3ier s ASP 187 CO 0.06 -1.11 1.92 -2.11 0.13 0.00 0.00 175.17 174.06 3ier n ARG 188 N 7.37 0.12 0.04 4.34 1.85 -1.26 -0.97 116.66 128.16 3ier n ARG 188 Ca 0.17 -0.01 -0.16 0.00 -1.00 0.00 0.00 57.85 56.85 3ier n ARG 188 Cb 0.45 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.22 3ier n ARG 188 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 3ier h ASP 189 N 0.03 0.32 0.61 2.89 3.32 -1.95 0.01 116.42 121.65 3ier h ASP 189 Ca 0.00 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.53 3ier h ASP 189 Cb 0.45 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3ier h ASP 189 CO 0.00 1.45 -1.22 0.29 -1.72 0.00 0.00 179.24 178.03 3ier n LYS 190 N -3.39 0.52 -3.47 3.56 5.02 -1.09 -4.76 118.16 114.54 3ier n LYS 190 Ca -0.19 0.01 -0.38 0.00 -2.02 0.00 0.00 58.31 55.74 3ier n LYS 190 Cb 1.04 -1.69 -0.08 0.00 -0.02 0.00 0.00 35.03 34.29 3ier n LYS 190 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3ier s THR 191 N -3.35 5.25 0.06 -0.18 2.01 -0.14 -5.02 115.64 114.27 3ier s THR 191 Ca -0.01 0.54 -0.30 0.00 0.31 0.00 0.00 61.69 62.23 3ier s THR 191 Cb 0.12 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 3ier s THR 191 CO 0.82 0.28 1.09 -0.63 -0.69 0.00 0.00 174.62 175.49 3ier s ILE 192 N 1.21 4.35 -0.24 1.82 -1.09 -1.26 -1.39 121.20 124.60 3ier s ILE 192 Ca 0.15 1.74 -0.18 0.00 -2.23 0.00 0.00 60.65 60.13 3ier s ILE 192 Cb -0.14 -4.11 -0.16 0.00 -1.58 0.00 0.00 42.46 36.46 3ier s ILE 192 CO 0.07 0.16 -0.01 0.00 -1.23 0.00 0.00 174.94 173.93 3ier n ALA 193 N 3.64 0.95 -2.64 9.38 0.00 0.50 -3.84 120.51 128.50 3ier n ALA 193 Ca 0.07 -0.74 -0.20 0.00 0.00 0.00 0.00 53.44 52.57 3ier n ALA 193 Cb 0.48 -0.29 -0.14 0.00 0.00 0.00 0.00 19.45 19.50 3ier n ALA 193 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ier s LEU 194 N -7.72 2.07 -0.36 0.00 2.01 -1.06 -1.19 118.68 112.43 3ier s LEU 194 Ca -0.33 -0.27 -0.01 0.00 0.01 0.00 0.00 54.13 53.53 3ier s LEU 194 Cb 0.09 -0.57 0.09 0.00 0.01 0.00 0.00 46.19 45.82 3ier s LEU 194 CO 0.55 0.10 0.11 -0.63 1.01 0.00 0.00 176.35 177.49 3ier s ILE 195 N -0.44 2.98 0.12 -0.59 1.01 -0.24 -0.35 121.20 123.69 3ier s ILE 195 Ca 0.03 -1.90 0.02 0.00 0.00 0.00 0.00 60.65 58.80 3ier s ILE 195 Cb -0.05 -2.97 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 3ier s ILE 195 CO -0.00 -0.48 0.25 -0.04 0.00 0.00 0.00 174.94 174.66 3ier s MET 196 N 1.13 3.40 0.11 2.79 -1.94 0.05 -3.84 119.30 121.00 3ier s MET 196 Ca 0.04 -0.56 -0.13 0.00 -1.71 0.00 0.00 55.69 53.33 3ier s MET 196 Cb -0.21 -2.97 -0.06 0.00 2.01 0.00 0.00 34.83 33.59 3ier s MET 196 CO -0.04 0.55 0.49 -0.80 -0.01 0.00 0.00 175.02 175.22 3ier s ASN 197 N -2.95 6.79 -0.34 3.03 0.01 -1.26 0.37 114.94 120.58 3ier s ASN 197 Ca 0.34 1.00 0.14 0.00 -0.71 0.00 0.00 52.86 53.63 3ier s ASN 197 Cb -0.12 -2.26 0.43 0.00 0.41 0.00 0.00 41.25 39.71 3ier s ASN 197 CO 0.28 0.16 1.34 -1.54 -1.51 0.00 0.00 177.10 175.83 3ier n SER 198 N 1.00 -0.66 -0.62 -1.22 3.41 -0.04 -4.92 113.62 110.57 3ier n SER 198 Ca -0.07 -2.31 -0.06 0.00 -0.26 0.00 0.00 58.87 56.17 3ier n SER 198 Cb 0.52 0.41 -0.00 0.00 -0.26 0.00 0.00 64.21 64.88 3ier n SER 198 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ier n LEU 204 N -0.94 -0.37 -4.54 1.04 4.77 -1.26 -0.16 117.00 115.54 3ier n LEU 204 Ca -0.06 0.13 -0.37 0.00 -0.03 0.00 0.00 56.01 55.68 3ier n LEU 204 Cb 0.85 -0.13 0.06 0.00 -2.33 0.00 0.00 43.42 41.87 3ier n LEU 204 CO -0.04 -0.57 0.30 -2.65 -1.33 0.00 0.00 177.39 173.09 3ier n PRO 205 N 0.18 0.56 -3.68 3.23 -0.02 -1.26 -5.02 135.00 129.00 3ier n PRO 205 Ca 0.02 0.23 -0.20 0.00 -2.02 0.00 0.00 63.50 61.53 3ier n PRO 205 Cb 0.05 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 3ier n PRO 205 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ier s LYS 206 N -2.71 2.88 -0.21 -0.52 1.02 0.77 -4.91 119.74 116.06 3ier s LYS 206 Ca 0.71 -1.18 -0.11 0.00 0.02 0.00 0.00 55.97 55.41 3ier s LYS 206 Cb -0.39 -2.62 -0.05 0.00 -0.52 0.00 0.00 37.83 34.26 3ier s LYS 206 CO 0.52 0.08 0.18 0.20 -0.92 0.00 0.00 175.35 175.41 3ier s GLY 207 N -4.07 2.05 -0.35 -3.33 0.00 -1.26 -0.86 107.32 99.51 3ier s GLY 207 Ca 0.43 -0.70 -0.12 0.00 0.00 0.00 0.00 44.72 44.33 3ier s GLY 207 CO 0.28 0.30 0.21 0.14 0.00 0.00 0.00 173.10 174.03 3ier s VAL 208 N 0.63 4.90 -0.22 1.40 1.01 0.16 -0.54 120.40 127.74 3ier s VAL 208 Ca 0.10 -0.50 -0.26 0.00 0.00 0.00 0.00 61.98 61.31 3ier s VAL 208 Cb -0.12 -3.59 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 3ier s VAL 208 CO 0.01 -0.09 0.90 0.00 0.00 0.00 0.00 175.10 175.93 3ier s ALA 209 N 1.64 3.62 -0.29 5.51 0.00 -0.66 -0.77 121.76 130.82 3ier s ALA 209 Ca 0.04 0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.03 3ier s ALA 209 Cb -0.18 -3.36 0.06 0.00 0.00 0.00 0.00 23.12 19.65 3ier s ALA 209 CO 0.08 -0.89 -0.03 -0.51 0.00 0.00 0.00 175.76 174.40 3ier s LEU 210 N 2.77 3.86 0.82 0.00 1.43 0.53 -1.45 118.68 126.64 3ier s LEU 210 Ca 0.39 -1.47 -0.13 0.00 -1.03 0.00 0.00 54.13 51.89 3ier s LEU 210 Cb -0.16 -1.63 0.07 0.00 0.03 0.00 0.00 46.19 44.50 3ier s LEU 210 CO 0.08 -0.26 1.05 -2.65 0.23 0.00 0.00 176.35 174.81 3ier n PRO 211 N 4.49 0.11 -0.30 1.29 -0.02 -1.26 -0.37 135.00 138.94 3ier n PRO 211 Ca -0.11 0.11 0.20 0.00 -2.02 0.00 0.00 63.50 61.67 3ier n PRO 211 Cb 0.42 -2.31 0.47 0.00 -0.02 0.00 0.00 33.50 32.06 3ier n PRO 211 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3ier h HIS 212 N -0.96 0.70 -0.95 6.00 3.86 -0.99 -1.00 115.15 121.81 3ier h HIS 212 Ca -0.46 0.02 0.20 0.00 -1.16 0.00 0.00 60.37 58.98 3ier h HIS 212 Cb 1.30 -0.21 -0.11 0.00 1.06 0.00 0.00 27.41 29.45 3ier h HIS 212 CO 0.44 0.13 0.53 -0.09 0.86 0.00 0.00 177.93 179.80 3ier h ARG 213 N 0.47 0.59 -0.44 2.45 2.43 -1.29 -1.75 114.38 116.85 3ier h ARG 213 Ca 0.55 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.59 3ier h ARG 213 Cb 1.27 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 3ier h ARG 213 CO -0.27 0.39 -0.09 1.79 -1.51 0.00 0.00 179.97 180.27 3ier h THR 214 N 0.61 1.26 -0.37 0.20 1.35 -1.33 -1.26 112.91 113.37 3ier h THR 214 Ca 0.57 -1.15 -0.12 0.00 -0.55 0.00 0.00 66.41 65.16 3ier h THR 214 Cb 0.98 1.02 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 3ier h THR 214 CO -0.44 0.40 -0.27 0.00 -0.25 0.00 0.00 175.52 174.96 3ier h ALA 215 N 1.17 0.83 -0.88 6.62 0.00 -1.54 -1.55 119.26 123.91 3ier h ALA 215 Ca 0.12 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.69 3ier h ALA 215 Cb 0.57 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 3ier h ALA 215 CO 0.04 0.64 0.56 0.00 0.00 0.00 0.00 179.25 180.49 3ier h VAL 217 N 1.07 1.26 -0.95 0.00 2.07 -1.09 -2.57 116.25 116.03 3ier h VAL 217 Ca 0.37 -0.92 0.22 0.00 0.82 0.00 0.00 66.70 67.19 3ier h VAL 217 Cb 0.08 1.34 -0.12 0.00 -1.52 0.00 0.00 31.29 31.07 3ier h VAL 217 CO -0.14 0.29 0.52 -0.09 0.02 0.00 0.00 177.57 178.17 3ier h ARG 218 N 0.24 0.56 0.00 1.57 9.65 -0.82 -0.34 114.38 125.24 3ier h ARG 218 Ca 0.07 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 58.88 3ier h ARG 218 Cb 0.42 -0.13 -0.01 0.00 -1.39 0.00 0.00 29.97 28.87 3ier h ARG 218 CO 0.01 0.37 -0.18 0.74 2.80 0.00 0.00 179.97 183.72 3ier h PHE 219 N 0.57 0.00 0.00 2.20 0.04 -0.58 0.26 116.94 119.43 3ier h PHE 219 Ca 0.59 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 61.24 3ier h PHE 219 Cb 1.04 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.20 3ier h PHE 219 CO -0.05 0.18 -0.44 1.03 -0.60 0.00 0.00 178.31 178.42 3ier h SER 220 N 0.00 0.39 -1.00 2.17 0.87 -0.80 -3.26 113.55 111.92 3ier h SER 220 Ca -0.00 -0.77 0.02 0.00 -1.23 0.00 0.00 61.79 59.81 3ier h SER 220 Cb 0.52 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.31 3ier h SER 220 CO 0.02 1.11 0.66 0.45 -0.53 0.00 0.00 176.83 178.54 3ier h HIS 221 N -0.29 1.25 -0.54 2.24 3.86 -0.52 -3.03 115.15 118.11 3ier h HIS 221 Ca -0.06 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 3ier h HIS 221 Cb 1.18 -0.42 -0.03 0.00 1.06 0.00 0.00 27.41 29.20 3ier h HIS 221 CO 0.16 0.76 0.20 0.00 0.86 0.00 0.00 177.93 179.91 3ier h ALA 222 N 1.39 1.34 -0.26 2.45 0.00 -0.57 -2.07 119.26 121.53 3ier h ALA 222 Ca 0.38 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3ier h ALA 222 Cb -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3ier h ALA 222 CO -0.10 0.49 0.00 2.89 0.00 0.00 0.00 179.25 182.53 3ier n ARG 223 N -4.33 2.31 -2.03 0.00 1.85 -1.23 -1.00 116.66 112.22 3ier n ARG 223 Ca 0.04 -1.95 -0.42 0.00 -1.00 0.00 0.00 57.85 54.52 3ier n ARG 223 Cb 0.17 -1.48 -0.03 0.00 -1.05 0.00 0.00 32.46 30.07 3ier n ARG 223 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3ier s ASP 224 N -1.63 6.69 0.55 2.89 -1.08 -0.80 -4.55 116.67 118.75 3ier s ASP 224 Ca 0.36 2.49 0.33 0.00 -0.52 0.00 0.00 52.55 55.20 3ier s ASP 224 Cb 0.21 -2.59 1.51 0.00 -1.46 0.00 0.00 42.92 40.59 3ier s ASP 224 CO 0.31 -0.75 2.05 -0.65 0.52 0.00 0.00 175.17 176.65 3ier h PRO 225 N 6.79 0.00 0.00 4.34 0.11 -1.86 0.17 132.00 141.56 3ier h PRO 225 Ca -0.42 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.42 3ier h PRO 225 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 3ier h PRO 225 CO 0.89 0.07 -1.47 -0.89 -0.21 0.00 0.00 178.00 176.39 3ier n ILE 226 N -3.28 1.54 1.11 4.15 2.08 -1.26 -4.61 119.36 119.09 3ier n ILE 226 Ca -0.01 -0.10 0.12 0.00 0.56 0.00 0.00 62.75 63.33 3ier n ILE 226 Cb 0.27 -2.01 0.20 0.00 -0.75 0.00 0.00 39.64 37.35 3ier n ILE 226 CO 0.00 0.00 0.00 0.49 0.56 0.00 0.00 176.55 177.60 3ier n PHE 227 N -4.37 0.00 -0.38 1.39 3.01 -1.22 -1.17 117.46 114.72 3ier n PHE 227 Ca -0.35 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.11 3ier n PHE 227 Cb 0.73 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.20 3ier n PHE 227 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ier n GLY 228 N 1.31 5.16 3.17 1.37 0.00 0.04 -4.76 105.19 111.48 3ier n GLY 228 Ca 0.15 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 3ier n GLY 228 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ier s ASN 229 N 1.25 2.85 0.29 1.61 -0.87 -0.17 -4.77 114.94 115.12 3ier s ASN 229 Ca 0.00 -0.52 -0.30 0.00 -1.57 0.00 0.00 52.86 50.47 3ier s ASN 229 Cb 0.00 -1.30 -0.11 0.00 -0.02 0.00 0.00 41.25 39.82 3ier s ASN 229 CO 0.00 0.12 1.56 -1.58 -2.57 0.00 0.00 177.10 174.63 3ier s GLN 230 N 0.48 4.15 -0.40 -0.60 0.74 -1.26 -4.34 119.66 118.43 3ier s GLN 230 Ca -0.16 2.52 -0.28 0.00 0.05 0.00 0.00 55.36 57.49 3ier s GLN 230 Cb -0.17 -3.04 -0.01 0.00 1.10 0.00 0.00 33.01 30.89 3ier s GLN 230 CO 0.06 -0.58 1.67 0.42 -0.55 0.00 0.00 175.29 176.31 3ier s ILE 231 N -0.05 3.61 -0.04 -2.34 1.01 -1.26 -4.96 121.20 117.16 3ier s ILE 231 Ca 0.62 0.59 0.04 0.00 0.00 0.00 0.00 60.65 61.90 3ier s ILE 231 Cb -0.46 -3.90 -0.00 0.00 0.01 0.00 0.00 42.46 38.11 3ier s ILE 231 CO 0.48 -0.62 -0.17 -0.63 0.00 0.00 0.00 174.94 174.00 3ier s ILE 232 N 6.67 1.40 0.57 2.92 1.01 -1.26 -5.14 121.20 127.37 3ier s ILE 232 Ca 0.71 -0.70 -0.21 0.00 0.00 0.00 0.00 60.65 60.45 3ier s ILE 232 Cb -0.18 -1.20 -0.04 0.00 0.01 0.00 0.00 42.46 41.05 3ier s ILE 232 CO 0.31 0.40 1.33 -2.65 0.00 0.00 0.00 174.94 174.34 3ier n PRO 233 N 3.10 1.54 -2.14 2.79 -0.02 -1.26 -2.75 135.00 136.26 3ier n PRO 233 Ca -0.18 0.57 -0.19 0.00 -2.02 0.00 0.00 63.50 61.68 3ier n PRO 233 Cb 0.53 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.43 3ier n PRO 233 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3ier n ASP 234 N -1.18 -5.51 -4.72 2.55 8.00 -1.26 -4.99 116.55 109.44 3ier n ASP 234 Ca 0.12 0.12 -0.42 0.00 0.71 0.00 0.00 54.79 55.32 3ier n ASP 234 Cb 0.45 -4.59 -0.03 0.00 -0.02 0.00 0.00 41.12 36.93 3ier n ASP 234 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ier s THR 235 N -2.90 3.58 -0.02 -3.53 2.01 -1.11 -4.96 115.64 108.70 3ier s THR 235 Ca 0.00 1.19 0.05 0.00 0.31 0.00 0.00 61.69 63.24 3ier s THR 235 Cb 0.00 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.74 3ier s THR 235 CO 0.00 0.12 -0.17 0.00 -0.69 0.00 0.00 174.62 173.88 3ier s ALA 236 N 0.72 1.48 -0.00 7.40 0.00 -1.26 -1.09 121.76 129.00 3ier s ALA 236 Ca 0.59 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.89 3ier s ALA 236 Cb -0.34 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 3ier s ALA 236 CO 0.32 0.33 -0.22 0.42 0.00 0.00 0.00 175.76 176.61 3ier s ILE 237 N -0.24 2.47 -0.25 0.00 1.01 -0.03 -1.68 121.20 122.47 3ier s ILE 237 Ca 0.03 -1.08 -0.05 0.00 0.00 0.00 0.00 60.65 59.55 3ier s ILE 237 Cb -0.08 -1.94 -0.00 0.00 0.01 0.00 0.00 42.46 40.44 3ier s ILE 237 CO 0.00 0.50 0.01 -0.22 0.00 0.00 0.00 174.94 175.23 3ier s LEU 238 N -0.92 3.30 -0.21 2.97 2.96 -0.08 -0.35 118.68 126.36 3ier s LEU 238 Ca 0.12 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 3ier s LEU 238 Cb -0.10 -1.81 0.03 0.00 0.50 0.00 0.00 46.19 44.81 3ier s LEU 238 CO 0.01 -0.08 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.26 3ier s SER 239 N 1.49 3.65 -0.12 3.68 0.15 0.03 -1.33 113.70 121.24 3ier s SER 239 Ca 0.04 -0.79 0.15 0.00 0.70 0.00 0.00 55.95 56.05 3ier s SER 239 Cb -0.15 -1.54 0.37 0.00 -1.71 0.00 0.00 66.02 62.98 3ier s SER 239 CO -0.00 -0.05 1.27 0.55 1.20 0.00 0.00 173.24 176.20 3ier n VAL 240 N 4.61 1.88 -3.15 4.45 3.14 -1.21 -2.71 118.33 125.34 3ier n VAL 240 Ca -0.19 -1.83 -0.30 0.00 -2.96 0.00 0.00 64.34 59.05 3ier n VAL 240 Cb 0.48 -0.09 -0.04 0.00 -1.06 0.00 0.00 33.84 33.13 3ier n VAL 240 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 3ier s VAL 241 N -2.46 4.86 0.20 1.55 -7.23 -1.26 -4.84 120.40 111.21 3ier s VAL 241 Ca 0.32 0.48 -0.30 0.00 -1.81 0.00 0.00 61.98 60.68 3ier s VAL 241 Cb 0.26 -3.69 -0.08 0.00 0.56 0.00 0.00 36.38 33.43 3ier s VAL 241 CO 0.07 -0.32 1.27 -2.16 -0.31 0.00 0.00 175.10 173.64 3ier s PRO 242 N -3.42 4.43 0.49 4.82 0.04 -1.26 -4.72 135.00 135.37 3ier s PRO 242 Ca 0.49 1.99 0.28 0.00 0.04 0.00 0.00 61.00 63.80 3ier s PRO 242 Cb -0.11 -3.21 1.16 0.00 0.04 0.00 0.00 34.50 32.39 3ier s PRO 242 CO 0.27 -0.19 1.92 0.74 0.04 0.00 0.00 177.00 179.78 3ier h PHE 243 N 5.27 0.00 0.00 0.56 0.04 -1.91 -2.72 116.94 118.18 3ier h PHE 243 Ca -0.45 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.32 3ier h PHE 243 Cb 1.21 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.36 3ier h PHE 243 CO 0.62 0.13 0.00 -2.39 -0.60 0.00 0.00 178.31 176.07 3ier n HIS 244 N -3.32 0.04 -3.88 -0.55 1.44 -1.26 -3.25 115.22 104.43 3ier n HIS 244 Ca -0.00 0.01 -0.21 0.00 -2.01 0.00 0.00 57.72 55.51 3ier n HIS 244 Cb 0.36 -0.52 -0.03 0.00 0.12 0.00 0.00 29.99 29.93 3ier n HIS 244 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 3ier s HIS 245 N -3.00 3.21 0.33 -1.40 5.65 -1.03 -4.78 115.29 114.27 3ier s HIS 245 Ca 0.14 -0.13 0.01 0.00 0.25 0.00 0.00 55.06 55.33 3ier s HIS 245 Cb 0.19 -1.64 0.57 0.00 -1.18 0.00 0.00 32.58 30.51 3ier s HIS 245 CO 0.53 0.33 1.99 0.78 -0.65 0.00 0.00 174.74 177.72 3ier h GLY 246 N 1.21 0.96 1.00 1.59 0.00 -1.87 -0.02 103.07 105.94 3ier h GLY 246 Ca -0.49 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 46.46 3ier h GLY 246 CO 0.59 0.36 -0.12 -2.75 0.00 0.00 0.00 176.54 174.62 3ier h PHE 247 N 0.92 -0.30 -0.51 5.60 3.57 -1.87 -1.44 116.94 122.91 3ier h PHE 247 Ca 0.25 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.68 3ier h PHE 247 Cb -0.08 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 3ier h PHE 247 CO 0.00 -0.19 0.09 0.78 -2.23 0.00 0.00 178.31 176.77 3ier h GLY 248 N -0.32 0.90 0.84 2.40 0.00 -1.43 -2.57 103.07 102.88 3ier h GLY 248 Ca -0.03 -0.59 -0.04 0.00 0.00 0.00 0.00 47.33 46.67 3ier h GLY 248 CO 0.05 0.55 -0.01 1.98 0.00 0.00 0.00 176.54 179.11 3ier h MET 249 N 0.72 0.41 0.00 4.80 1.85 -0.92 -2.19 114.93 119.60 3ier h MET 249 Ca 0.16 -0.14 -0.01 0.00 -0.61 0.00 0.00 59.70 59.09 3ier h MET 249 Cb 0.38 -0.03 -0.00 0.00 0.43 0.00 0.00 31.60 32.38 3ier h MET 249 CO 0.01 0.61 -1.30 1.19 -0.40 0.00 0.00 176.91 177.01 3ier n PHE 250 N -4.64 0.71 -0.03 1.39 3.72 -0.55 -1.45 117.46 116.60 3ier n PHE 250 Ca -0.04 0.21 -0.14 0.00 -0.05 0.00 0.00 57.45 57.43 3ier n PHE 250 Cb 0.25 -0.85 -0.09 0.00 -0.94 0.00 0.00 39.48 37.85 3ier n PHE 250 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 3ier h THR 251 N 0.00 1.42 -0.45 4.37 1.35 -1.55 -3.06 112.91 114.99 3ier h THR 251 Ca -0.02 -1.43 -0.01 0.00 -0.55 0.00 0.00 66.41 64.40 3ier h THR 251 Cb 1.05 2.23 -0.02 0.00 -1.73 0.00 0.00 68.15 69.67 3ier h THR 251 CO 0.00 0.40 0.24 0.74 -0.25 0.00 0.00 175.52 176.65 3ier h THR 252 N -0.32 1.17 -0.92 6.82 2.02 -1.36 0.16 112.91 120.48 3ier h THR 252 Ca 0.00 -0.44 0.07 0.00 0.77 0.00 0.00 66.41 66.81 3ier h THR 252 Cb 0.70 0.63 -0.06 0.00 -1.74 0.00 0.00 68.15 67.68 3ier h THR 252 CO 0.03 0.18 0.60 -0.07 0.37 0.00 0.00 175.52 176.62 3ier h LEU 253 N 0.59 0.93 -0.48 2.58 3.38 -1.37 -0.30 115.31 120.63 3ier h LEU 253 Ca 0.16 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.97 3ier h LEU 253 Cb 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3ier h LEU 253 CO -0.02 0.59 -0.60 1.23 0.09 0.00 0.00 178.44 179.73 3ier h GLY 254 N 1.05 0.57 1.31 0.83 0.00 -1.19 -1.98 103.07 103.65 3ier h GLY 254 Ca 0.40 -0.70 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 3ier h GLY 254 CO -0.15 0.63 0.34 -0.97 0.00 0.00 0.00 176.54 176.38 3ier h TYR 255 N 0.39 0.89 -0.53 5.60 0.05 0.29 -1.74 116.97 121.92 3ier h TYR 255 Ca -0.00 -0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.71 3ier h TYR 255 Cb 1.15 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 38.58 3ier h TYR 255 CO 0.05 0.64 0.14 -0.07 -1.05 0.00 0.00 178.16 177.86 3ier h LEU 256 N 0.91 0.79 -1.38 3.88 3.38 -0.75 -1.24 115.31 120.89 3ier h LEU 256 Ca 0.23 -0.22 0.10 0.00 0.09 0.00 0.00 57.88 58.08 3ier h LEU 256 Cb 0.05 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 3ier h LEU 256 CO -0.03 0.80 0.51 0.40 0.09 0.00 0.00 178.44 180.21 3ier h ILE 257 N 0.73 0.93 0.00 1.22 1.08 -1.09 -2.38 117.51 118.01 3ier h ILE 257 Ca 0.17 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 3ier h ILE 257 Cb 0.31 0.19 0.00 0.00 -3.07 0.00 0.00 36.82 34.25 3ier h ILE 257 CO -0.00 0.12 -0.16 0.00 -0.69 0.00 0.00 178.15 177.42 3ier n GLY 259 N 1.50 0.47 3.90 0.00 0.00 -0.55 -4.90 105.19 105.61 3ier n GLY 259 Ca 0.06 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 3ier n GLY 259 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ier s PHE 260 N -2.03 3.02 -0.37 1.61 0.08 -0.73 -4.88 117.98 114.68 3ier s PHE 260 Ca 0.00 0.78 -0.17 0.00 0.12 0.00 0.00 56.93 57.66 3ier s PHE 260 Cb 0.00 -3.39 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 3ier s PHE 260 CO 0.00 -1.64 0.46 0.50 -0.10 0.00 0.00 175.22 174.44 3ier s ARG 261 N -5.51 3.46 -0.53 0.44 3.52 -0.25 -4.47 118.95 115.61 3ier s ARG 261 Ca 0.61 -0.39 -0.16 0.00 -0.13 0.00 0.00 55.73 55.66 3ier s ARG 261 Cb -0.11 -3.85 0.11 0.00 -1.56 0.00 0.00 34.95 29.54 3ier s ARG 261 CO 0.49 -0.67 0.51 0.08 -0.81 0.00 0.00 175.30 174.90 3ier s VAL 262 N 2.24 5.15 -0.24 7.11 1.01 -0.05 -0.85 120.40 134.77 3ier s VAL 262 Ca 0.15 -1.30 -0.26 0.00 0.00 0.00 0.00 61.98 60.57 3ier s VAL 262 Cb -0.16 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 31.91 3ier s VAL 262 CO 0.13 -0.84 0.91 -0.69 0.00 0.00 0.00 175.10 174.62 3ier s VAL 263 N 1.79 4.77 0.15 2.92 1.01 0.53 -1.41 120.40 130.16 3ier s VAL 263 Ca 0.05 1.74 0.07 0.00 0.00 0.00 0.00 61.98 63.84 3ier s VAL 263 Cb -0.28 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 3ier s VAL 263 CO 0.05 -0.13 -0.03 -1.48 0.00 0.00 0.00 175.10 173.51 3ier s LEU 264 N 3.00 3.24 -0.02 3.92 0.05 0.72 -0.79 118.68 128.80 3ier s LEU 264 Ca 0.38 -0.39 0.04 0.00 0.05 0.00 0.00 54.13 54.21 3ier s LEU 264 Cb -0.15 -1.93 -0.01 0.00 -2.05 0.00 0.00 46.19 42.05 3ier s LEU 264 CO 0.07 0.12 -0.12 -0.04 -0.55 0.00 0.00 176.35 175.83 3ier s MET 265 N -2.72 1.09 0.00 1.48 -1.94 -1.10 -1.50 119.30 114.60 3ier s MET 265 Ca 0.26 -0.43 0.19 0.00 -1.71 0.00 0.00 55.69 54.00 3ier s MET 265 Cb -0.10 -1.02 -0.08 0.00 2.01 0.00 0.00 34.83 35.64 3ier s MET 265 CO 0.17 0.22 0.89 2.48 -0.01 0.00 0.00 175.02 178.78 3ier n TYR 266 N 2.96 0.00 -3.78 -0.03 0.18 -1.26 -4.55 117.16 110.67 3ier n TYR 266 Ca -0.16 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.50 3ier n TYR 266 Cb 0.55 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.40 3ier n TYR 266 CO 0.00 0.00 0.00 -0.98 -2.08 0.00 0.00 176.86 173.80 3ier s ARG 267 N -2.37 0.31 0.13 -3.48 1.70 -1.26 -4.83 118.95 109.15 3ier s ARG 267 Ca 0.12 0.35 -0.31 0.00 -0.47 0.00 0.00 55.73 55.43 3ier s ARG 267 Cb 0.15 0.15 -0.08 0.00 -0.57 0.00 0.00 34.95 34.60 3ier s ARG 267 CO 0.58 -0.04 1.32 0.12 -1.08 0.00 0.00 175.30 176.20 3ier s PHE 268 N 0.11 3.30 -0.06 5.89 5.36 -1.26 -5.02 117.98 126.31 3ier s PHE 268 Ca -0.00 1.12 -0.04 0.00 -0.96 0.00 0.00 56.93 57.05 3ier s PHE 268 Cb -0.02 -3.59 0.02 0.00 -0.34 0.00 0.00 43.02 39.09 3ier s PHE 268 CO 0.00 -1.95 0.15 -1.21 -1.46 0.00 0.00 175.22 170.75 3ier s GLU 269 N 0.72 0.14 0.10 10.12 2.02 -1.26 -5.08 118.70 125.46 3ier s GLU 269 Ca 0.61 0.27 -0.24 0.00 0.02 0.00 0.00 54.97 55.63 3ier s GLU 269 Cb -0.35 -0.02 -0.11 0.00 0.10 0.00 0.00 34.13 33.75 3ier s GLU 269 CO 0.32 -0.08 1.70 1.49 0.02 0.00 0.00 175.26 178.72 3ier h GLU 270 N 6.44 -0.15 -0.16 1.61 4.81 -1.99 -1.20 114.58 123.94 3ier h GLU 270 Ca -0.32 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.88 3ier h GLU 270 Cb 1.18 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 3ier h GLU 270 CO 0.42 -0.10 -0.06 0.93 -0.73 0.00 0.00 179.01 179.47 3ier h GLU 271 N -0.16 0.32 -0.61 1.92 5.08 -1.99 -1.97 114.58 117.17 3ier h GLU 271 Ca 0.03 -0.13 0.05 0.00 -1.00 0.00 0.00 59.36 58.31 3ier h GLU 271 Cb 0.18 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 3ier h GLU 271 CO -0.07 0.62 0.33 1.25 -1.00 0.00 0.00 179.01 180.14 3ier h LEU 272 N 0.00 0.49 -0.10 1.33 5.85 -1.98 0.83 115.31 121.73 3ier h LEU 272 Ca 0.04 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.80 3ier h LEU 272 Cb 0.51 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3ier h LEU 272 CO 0.02 0.32 0.02 0.15 -0.34 0.00 0.00 178.44 178.61 3ier h PHE 273 N 0.62 0.03 -0.24 1.25 3.04 -1.14 0.72 116.94 121.22 3ier h PHE 273 Ca 0.27 0.01 -0.16 0.00 3.98 0.00 0.00 57.97 62.07 3ier h PHE 273 Cb 0.17 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.67 3ier h PHE 273 CO -0.09 0.01 -0.49 -0.07 -2.02 0.00 0.00 178.31 175.66 3ier h LEU 274 N 0.06 0.70 -0.41 0.59 3.38 -1.14 -1.67 115.31 116.81 3ier h LEU 274 Ca 0.04 -0.35 -0.16 0.00 0.09 0.00 0.00 57.88 57.50 3ier h LEU 274 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3ier h LEU 274 CO -0.06 1.07 -0.42 -0.09 0.09 0.00 0.00 178.44 179.03 3ier h ARG 275 N 0.51 0.87 -0.46 1.13 2.43 -0.75 -1.98 114.38 116.14 3ier h ARG 275 Ca 0.03 -0.48 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 3ier h ARG 275 Cb 1.03 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 3ier h ARG 275 CO 0.10 1.12 0.26 0.77 -1.51 0.00 0.00 179.97 180.71 3ier h SER 276 N 0.70 0.57 -0.50 -3.80 0.02 -0.75 0.22 113.55 110.01 3ier h SER 276 Ca 0.05 -0.08 0.08 0.00 -0.84 0.00 0.00 61.79 61.00 3ier h SER 276 Cb 1.01 -0.14 -0.07 0.00 0.14 0.00 0.00 62.40 63.34 3ier h SER 276 CO 0.10 0.48 0.11 -0.07 -1.14 0.00 0.00 176.83 176.31 3ier h LEU 277 N 0.61 0.02 0.66 5.07 3.38 -1.00 -1.83 115.31 122.22 3ier h LEU 277 Ca 0.16 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 3ier h LEU 277 Cb 0.03 0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3ier h LEU 277 CO -0.03 0.04 -0.32 -0.61 0.09 0.00 0.00 178.44 177.62 3ier h GLN 278 N 0.25 -0.85 -0.03 1.13 4.15 -1.10 -2.11 115.11 116.55 3ier h GLN 278 Ca 0.25 0.06 -0.15 0.00 0.77 0.00 0.00 58.65 59.57 3ier h GLN 278 Cb 0.33 0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 3ier h GLN 278 CO -0.32 -0.53 -0.69 -0.44 -1.93 0.00 0.00 178.83 174.93 3ier h ASP 279 N -1.08 0.17 -0.17 -0.69 3.32 -0.53 -1.89 116.42 115.55 3ier h ASP 279 Ca -0.09 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.85 3ier h ASP 279 Cb 0.71 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.22 3ier h ASP 279 CO 0.15 0.80 0.00 -1.22 -1.72 0.00 0.00 179.24 177.25 3ier n TYR 280 N -3.78 0.21 -3.92 4.55 4.01 -0.69 -4.95 117.16 112.58 3ier n TYR 280 Ca -0.02 -0.10 -0.25 0.00 -0.16 0.00 0.00 57.90 57.37 3ier n TYR 280 Cb 0.67 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.69 3ier n TYR 280 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3ier n LYS 281 N 0.58 -3.51 -1.83 -0.72 5.02 -0.71 -4.85 118.16 112.13 3ier n LYS 281 Ca 0.17 0.43 -0.41 0.00 -2.02 0.00 0.00 58.31 56.48 3ier n LYS 281 Cb 0.40 -4.62 -0.02 0.00 -0.02 0.00 0.00 35.03 30.78 3ier n LYS 281 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ier s ILE 282 N -3.92 2.20 -0.11 -0.18 -1.09 -0.83 -4.73 121.20 112.55 3ier s ILE 282 Ca 0.00 0.17 0.15 0.00 -2.23 0.00 0.00 60.65 58.75 3ier s ILE 282 Cb -0.00 -3.11 -0.23 0.00 -1.58 0.00 0.00 42.46 37.53 3ier s ILE 282 CO 0.88 0.03 0.44 0.00 -1.23 0.00 0.00 174.94 175.06 3ier n GLN 283 N 2.09 0.65 -3.78 2.79 6.02 -0.67 -3.04 117.38 121.45 3ier n GLN 283 Ca 0.07 0.17 -0.14 0.00 -0.01 0.00 0.00 57.00 57.09 3ier n GLN 283 Cb 0.38 -1.69 -0.16 0.00 1.02 0.00 0.00 30.24 29.80 3ier n GLN 283 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3ier s SER 284 N -5.82 0.04 -0.01 1.08 0.15 -1.20 -0.44 113.70 107.51 3ier s SER 284 Ca -0.07 0.07 0.07 0.00 0.70 0.00 0.00 55.95 56.73 3ier s SER 284 Cb 0.07 -0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.34 3ier s SER 284 CO 0.83 -0.12 -0.23 0.00 1.20 0.00 0.00 173.24 174.92 3ier s ALA 285 N 0.95 1.92 -0.12 5.45 0.00 -0.62 -0.90 121.76 128.45 3ier s ALA 285 Ca -0.08 -1.02 -0.00 0.00 0.00 0.00 0.00 51.96 50.86 3ier s ALA 285 Cb -0.11 -0.47 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 3ier s ALA 285 CO -0.03 0.47 -0.10 -0.51 0.00 0.00 0.00 175.76 175.59 3ier s LEU 286 N -0.66 2.91 -0.01 0.00 1.43 -0.45 -0.68 118.68 121.22 3ier s LEU 286 Ca 0.09 -0.22 0.05 0.00 -1.03 0.00 0.00 54.13 53.01 3ier s LEU 286 Cb -0.09 -1.66 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 3ier s LEU 286 CO -0.00 0.21 -0.16 -0.76 0.23 0.00 0.00 176.35 175.87 3ier s LEU 287 N 0.08 2.04 0.84 1.79 1.43 -1.08 -3.33 118.68 120.44 3ier s LEU 287 Ca -0.04 -0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 3ier s LEU 287 Cb -0.14 -0.82 0.10 0.00 0.03 0.00 0.00 46.19 45.36 3ier s LEU 287 CO 0.04 0.19 1.16 0.68 0.23 0.00 0.00 176.35 178.65 3ier s VAL 288 N -0.39 2.32 0.26 -1.59 -7.23 -1.26 -4.29 120.40 108.22 3ier s VAL 288 Ca 0.06 0.12 -0.02 0.00 -1.81 0.00 0.00 61.98 60.33 3ier s VAL 288 Cb -0.06 -2.38 0.23 0.00 0.56 0.00 0.00 36.38 34.73 3ier s VAL 288 CO -0.01 -0.12 1.76 -0.65 -0.31 0.00 0.00 175.10 175.78 3ier h PRO 289 N -1.28 0.60 0.00 4.82 0.11 -2.00 -1.66 132.00 132.59 3ier h PRO 289 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3ier h PRO 289 Cb 1.27 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3ier h PRO 289 CO 0.45 0.40 0.00 0.25 -0.21 0.00 0.00 178.00 178.89 3ier n THR 290 N -4.87 0.03 0.19 -1.15 -2.24 -1.26 -2.16 114.28 102.82 3ier n THR 290 Ca 0.16 0.01 0.08 0.00 -2.27 0.00 0.00 64.05 62.03 3ier n THR 290 Cb 0.41 -0.52 0.16 0.00 -2.10 0.00 0.00 70.33 68.28 3ier n THR 290 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3ier h LEU 291 N 0.00 0.00 -0.28 3.22 3.38 -1.66 -2.30 115.31 117.67 3ier h LEU 291 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3ier h LEU 291 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3ier h LEU 291 CO 0.00 0.25 -0.09 -0.26 0.09 0.00 0.00 178.44 178.43 3ier h PHE 292 N 0.00 0.63 -0.68 1.13 0.04 -1.40 -1.04 116.94 115.62 3ier h PHE 292 Ca -0.00 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.63 3ier h PHE 292 Cb 1.12 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 39.09 3ier h PHE 292 CO 0.00 0.77 0.43 0.77 -0.60 0.00 0.00 178.31 179.68 3ier h SER 293 N 0.30 0.79 -0.04 2.17 0.02 -1.60 -1.92 113.55 113.26 3ier h SER 293 Ca 0.07 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3ier h SER 293 Cb 0.58 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 3ier h SER 293 CO 0.03 0.58 0.03 0.15 -1.14 0.00 0.00 176.83 176.48 3ier h PHE 294 N 0.92 0.05 0.00 3.45 3.04 -1.11 -3.05 116.94 120.24 3ier h PHE 294 Ca 0.25 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.20 3ier h PHE 294 Cb -0.08 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.41 3ier h PHE 294 CO 0.00 0.04 0.00 0.74 -2.02 0.00 0.00 178.31 177.07 3ier h PHE 295 N 0.05 0.00 0.00 0.41 0.04 -0.96 0.75 116.94 117.24 3ier h PHE 295 Ca 0.02 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 3ier h PHE 295 Cb -0.00 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 3ier h PHE 295 CO -0.07 0.00 -0.01 0.00 -0.60 0.00 0.00 178.31 177.63 3ier h ALA 296 N 2.01 1.01 0.00 2.45 0.00 -1.24 -2.98 119.26 120.50 3ier h ALA 296 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3ier h ALA 296 Cb 0.58 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3ier h ALA 296 CO 0.00 0.01 -1.43 1.63 0.00 0.00 0.00 179.25 179.46 3ier n LYS 297 N -3.10 0.63 -2.13 0.00 5.02 0.22 -4.93 118.16 113.87 3ier n LYS 297 Ca -0.00 0.06 -0.40 0.00 -2.02 0.00 0.00 58.31 55.95 3ier n LYS 297 Cb 0.27 -1.73 -0.01 0.00 -0.02 0.00 0.00 35.03 33.53 3ier n LYS 297 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3ier s SER 298 N -5.25 6.52 0.00 4.39 0.15 -0.96 -4.93 113.70 113.62 3ier s SER 298 Ca -0.03 2.60 0.01 0.00 0.70 0.00 0.00 55.95 59.23 3ier s SER 298 Cb 0.10 -2.64 0.01 0.00 -1.71 0.00 0.00 66.02 61.79 3ier s SER 298 CO 0.83 -0.70 0.59 0.35 1.20 0.00 0.00 173.24 175.51 3ier n THR 299 N 0.36 0.11 0.57 6.45 -2.24 -1.26 -4.69 114.28 113.58 3ier n THR 299 Ca 0.02 -0.55 0.12 0.00 -2.27 0.00 0.00 64.05 61.37 3ier n THR 299 Cb 0.43 0.97 0.28 0.00 -2.10 0.00 0.00 70.33 69.91 3ier n THR 299 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3ier h LEU 300 N 0.24 0.00 -0.89 3.22 5.85 -1.98 -3.33 115.31 118.42 3ier h LEU 300 Ca 0.00 -0.10 0.18 0.00 0.84 0.00 0.00 57.88 58.80 3ier h LEU 300 Cb 0.10 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.02 3ier h LEU 300 CO 0.00 0.05 0.44 0.40 -0.34 0.00 0.00 178.44 178.99 3ier h ILE 301 N 0.00 0.62 -0.09 4.05 2.04 -1.94 0.23 117.51 122.42 3ier h ILE 301 Ca 0.00 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.70 3ier h ILE 301 Cb 0.76 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3ier h ILE 301 CO 0.00 0.10 0.33 0.44 0.00 0.00 0.00 178.15 179.02 3ier h ASP 302 N 0.54 0.00 -0.09 1.72 5.19 -1.87 -2.71 116.42 119.19 3ier h ASP 302 Ca 0.52 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.93 3ier h ASP 302 Cb 0.86 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.37 3ier h ASP 302 CO -0.43 0.00 0.00 0.29 -3.12 0.00 0.00 179.24 175.98 3ier n LYS 303 N -3.10 1.97 -4.35 3.56 5.02 0.81 -4.91 118.16 117.16 3ier n LYS 303 Ca -0.00 -1.42 -0.26 0.00 -2.02 0.00 0.00 58.31 54.61 3ier n LYS 303 Cb 0.41 -1.46 -0.10 0.00 -0.02 0.00 0.00 35.03 33.86 3ier n LYS 303 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3ier s TYR 304 N -1.90 2.50 -0.59 2.13 1.51 -1.03 -5.08 117.35 114.91 3ier s TYR 304 Ca 0.34 -0.27 -0.21 0.00 -1.01 0.00 0.00 57.07 55.92 3ier s TYR 304 Cb 0.20 -1.20 0.08 0.00 -0.11 0.00 0.00 41.96 40.93 3ier s TYR 304 CO 0.31 0.54 0.79 0.34 -1.11 0.00 0.00 175.55 176.42 3ier s ASP 305 N -2.93 6.20 -0.35 2.29 -1.08 -1.26 -4.87 116.67 114.67 3ier s ASP 305 Ca 0.25 -1.08 0.07 0.00 -0.52 0.00 0.00 52.55 51.27 3ier s ASP 305 Cb -0.08 -2.35 0.50 0.00 -1.46 0.00 0.00 42.92 39.53 3ier s ASP 305 CO 0.14 -1.17 1.51 0.18 0.52 0.00 0.00 175.17 176.35 3ier n LEU 306 N 6.82 4.93 0.04 -1.34 4.77 -1.26 -4.30 117.00 126.66 3ier n LEU 306 Ca -0.06 -4.05 0.12 0.00 -0.03 0.00 0.00 56.01 51.99 3ier n LEU 306 Cb 0.44 -0.64 0.48 0.00 -2.33 0.00 0.00 43.42 41.38 3ier n LEU 306 CO 0.60 1.46 0.87 -1.54 -1.33 0.00 0.00 177.39 177.45 3ier n SER 307 N -1.02 0.23 0.02 -1.43 3.41 -1.26 -1.92 113.62 111.65 3ier n SER 307 Ca 0.41 0.53 0.13 0.00 -0.26 0.00 0.00 58.87 59.68 3ier n SER 307 Cb 1.01 -0.59 0.40 0.00 -0.26 0.00 0.00 64.21 64.77 3ier n SER 307 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3ier n ASN 308 N -1.73 0.37 -4.67 4.04 3.02 -1.26 -4.87 115.26 110.16 3ier n ASN 308 Ca 0.05 0.20 -0.43 0.00 -0.03 0.00 0.00 54.58 54.37 3ier n ASN 308 Cb 0.30 -0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.26 3ier n ASN 308 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3ier s LEU 309 N -3.36 4.22 -0.22 3.41 2.96 -0.81 -4.15 118.68 120.72 3ier s LEU 309 Ca 0.11 1.75 0.10 0.00 -0.22 0.00 0.00 54.13 55.88 3ier s LEU 309 Cb 0.17 -3.54 -0.20 0.00 0.50 0.00 0.00 46.19 43.11 3ier s LEU 309 CO 0.62 -0.72 -0.07 1.57 -1.32 0.00 0.00 176.35 176.44 3ier n HIS 310 N 6.21 0.00 -3.62 5.38 -0.00 0.42 -5.02 115.22 118.58 3ier n HIS 310 Ca 0.13 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.72 3ier n HIS 310 Cb 0.45 -0.95 -0.06 0.00 -0.00 0.00 0.00 29.99 29.43 3ier n HIS 310 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.34 174.51 3ier s GLU 311 N -2.48 0.98 -0.10 1.57 -1.05 -0.38 -4.96 118.70 112.27 3ier s GLU 311 Ca -0.21 -0.30 0.04 0.00 -0.15 0.00 0.00 54.97 54.35 3ier s GLU 311 Cb 0.07 0.44 -0.00 0.00 -0.44 0.00 0.00 34.13 34.20 3ier s GLU 311 CO 0.68 -0.34 -0.24 0.42 0.95 0.00 0.00 175.26 176.73 3ier s ILE 312 N -2.45 2.10 -0.08 1.83 1.01 -1.26 -1.59 121.20 120.76 3ier s ILE 312 Ca -0.05 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.63 3ier s ILE 312 Cb -0.01 -1.80 -0.02 0.00 0.01 0.00 0.00 42.46 40.64 3ier s ILE 312 CO -0.02 0.56 -0.18 0.00 0.00 0.00 0.00 174.94 175.30 3ier s ALA 313 N 0.35 2.47 0.15 9.38 0.00 0.15 -1.15 121.76 133.11 3ier s ALA 313 Ca -0.18 -0.98 0.06 0.00 0.00 0.00 0.00 51.96 50.86 3ier s ALA 313 Cb -0.18 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 21.96 3ier s ALA 313 CO 0.09 0.41 0.01 -1.54 0.00 0.00 0.00 175.76 174.73 3ier s SER 314 N -0.19 4.92 -0.11 0.00 1.04 -0.43 -2.62 113.70 116.29 3ier s SER 314 Ca -0.01 -0.30 -0.12 0.00 0.48 0.00 0.00 55.95 56.00 3ier s SER 314 Cb -0.13 -1.11 -0.26 0.00 0.10 0.00 0.00 66.02 64.61 3ier s SER 314 CO 0.03 0.11 0.46 1.23 0.98 0.00 0.00 173.24 176.05 3ier h GLY 315 N 2.90 0.29 0.00 7.32 0.00 -1.83 -2.42 103.07 109.33 3ier h GLY 315 Ca -0.47 -0.73 0.00 0.00 0.00 0.00 0.00 47.33 46.13 3ier h GLY 315 CO 0.59 0.64 0.00 0.61 0.00 0.00 0.00 176.54 178.38 3ier n GLY 316 N 1.83 0.00 3.62 4.60 0.00 -1.25 -4.10 105.19 109.89 3ier n GLY 316 Ca -0.29 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 3ier n GLY 316 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ier s PRO 318 N 0.00 0.75 0.16 1.61 0.04 -1.26 -2.09 135.00 134.20 3ier s PRO 318 Ca 0.00 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.13 3ier s PRO 318 Cb 0.00 0.24 -0.05 0.00 0.04 0.00 0.00 34.50 34.73 3ier s PRO 318 CO 0.00 -0.13 0.37 -0.51 0.04 0.00 0.00 177.00 176.77 3ier s LEU 319 N 1.12 4.26 0.31 -3.56 1.43 -1.26 -5.05 118.68 115.92 3ier s LEU 319 Ca -0.06 0.47 -0.29 0.00 -1.03 0.00 0.00 54.13 53.22 3ier s LEU 319 Cb -0.05 -3.21 -0.11 0.00 0.03 0.00 0.00 46.19 42.85 3ier s LEU 319 CO -0.11 0.02 1.56 -0.94 0.23 0.00 0.00 176.35 177.10 3ier s SER 320 N -2.77 6.38 0.30 2.29 1.04 -1.26 -4.86 113.70 114.81 3ier s SER 320 Ca 0.39 2.96 0.05 0.00 0.48 0.00 0.00 55.95 59.84 3ier s SER 320 Cb -0.12 -2.64 0.77 0.00 0.10 0.00 0.00 66.02 64.13 3ier s SER 320 CO 0.27 -0.89 1.68 0.50 0.98 0.00 0.00 173.24 175.78 3ier h LYS 321 N 4.33 0.35 0.09 4.02 3.11 -1.96 -1.85 116.57 124.66 3ier h LYS 321 Ca -0.48 -0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.33 3ier h LYS 321 Cb 1.23 -0.08 0.00 0.00 -1.00 0.00 0.00 32.23 32.38 3ier h LYS 321 CO 0.75 0.23 -0.04 0.93 -2.81 0.00 0.00 179.45 178.51 3ier h GLU 322 N 0.36 -0.12 -0.67 1.90 4.39 -2.00 -2.74 114.58 115.71 3ier h GLU 322 Ca 0.58 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.28 3ier h GLU 322 Cb 1.14 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.79 3ier h GLU 322 CO -0.56 0.27 0.39 0.28 -1.16 0.00 0.00 179.01 178.23 3ier h VAL 323 N -0.53 1.20 -0.36 3.13 2.07 -1.87 -1.10 116.25 118.79 3ier h VAL 323 Ca -0.01 -0.48 0.08 0.00 0.82 0.00 0.00 66.70 67.11 3ier h VAL 323 Cb 0.44 0.30 -0.08 0.00 -1.52 0.00 0.00 31.29 30.43 3ier h VAL 323 CO 0.02 0.22 -0.20 1.23 0.02 0.00 0.00 177.57 178.85 3ier h GLY 324 N 0.91 0.04 1.27 2.17 0.00 -1.41 -0.86 103.07 105.19 3ier h GLY 324 Ca 0.24 0.25 -0.11 0.00 0.00 0.00 0.00 47.33 47.71 3ier h GLY 324 CO -0.04 -0.19 -0.17 0.83 0.00 0.00 0.00 176.54 176.97 3ier h GLU 325 N -0.14 0.85 -0.01 4.80 5.08 -1.14 -1.24 114.58 122.77 3ier h GLU 325 Ca 0.18 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3ier h GLU 325 Cb 0.42 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 3ier h GLU 325 CO -0.45 0.95 0.01 0.00 -1.00 0.00 0.00 179.01 178.52 3ier h ALA 326 N 1.05 0.02 -0.26 3.43 0.00 -0.97 -1.49 119.26 121.04 3ier h ALA 326 Ca 0.11 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3ier h ALA 326 Cb 0.69 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3ier h ALA 326 CO 0.05 -0.46 0.13 0.28 0.00 0.00 0.00 179.25 179.25 3ier h VAL 327 N -0.03 0.99 -0.67 0.00 2.07 -1.11 -1.13 116.25 116.37 3ier h VAL 327 Ca 0.00 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.46 3ier h VAL 327 Cb 0.04 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 3ier h VAL 327 CO -0.00 0.05 0.41 0.00 0.02 0.00 0.00 177.57 178.05 3ier h ALA 328 N 1.13 0.88 -0.20 1.67 0.00 -1.15 -1.99 119.26 119.61 3ier h ALA 328 Ca 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3ier h ALA 328 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3ier h ALA 328 CO -0.07 0.17 0.03 -0.22 0.00 0.00 0.00 179.25 179.15 3ier h LYS 329 N 0.81 0.33 -0.09 0.00 3.64 -1.12 0.41 116.57 120.55 3ier h LYS 329 Ca 0.27 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 3ier h LYS 329 Cb 0.03 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3ier h LYS 329 CO -0.11 0.49 0.07 0.00 -2.27 0.00 0.00 179.45 177.63 3ier h ARG 330 N 0.11 0.00 -0.24 1.90 3.08 -0.81 -1.47 114.38 116.96 3ier h ARG 330 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3ier h ARG 330 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 3ier h ARG 330 CO 0.00 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.09 3ier n PHE 331 N -4.44 0.30 -3.62 3.04 3.72 -0.78 -4.80 117.46 110.88 3ier n PHE 331 Ca -0.01 -0.15 -0.22 0.00 -0.05 0.00 0.00 57.45 57.02 3ier n PHE 331 Cb 0.18 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.79 3ier n PHE 331 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 3ier n HIS 332 N 1.11 -2.32 -4.29 1.38 8.25 -0.44 -5.01 115.22 113.89 3ier n HIS 332 Ca 0.18 0.93 -0.27 0.00 -0.26 0.00 0.00 57.72 58.30 3ier n HIS 332 Cb 0.53 -4.73 -0.09 0.00 1.12 0.00 0.00 29.99 26.81 3ier n HIS 332 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3ier s LEU 333 N -6.83 2.95 0.57 2.41 1.43 0.01 -5.03 118.68 114.19 3ier s LEU 333 Ca 0.25 -0.58 0.35 0.00 -1.03 0.00 0.00 54.13 53.12 3ier s LEU 333 Cb -0.12 -1.65 1.60 0.00 0.03 0.00 0.00 46.19 46.06 3ier s LEU 333 CO 0.77 0.11 2.08 1.55 0.23 0.00 0.00 176.35 181.08 3ier h PRO 334 N 2.97 0.00 0.00 1.29 0.13 -1.93 -3.38 132.00 131.08 3ier h PRO 334 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3ier h PRO 334 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3ier h PRO 334 CO 0.54 0.03 0.00 0.41 -0.23 0.00 0.00 178.00 178.75 3ier n GLY 335 N -0.31 -1.22 3.79 1.56 0.00 -1.26 -5.01 105.19 102.74 3ier n GLY 335 Ca -0.01 -0.99 -0.38 0.00 0.00 0.00 0.00 46.02 44.64 3ier n GLY 335 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ier s ILE 336 N -2.19 5.15 -0.90 -0.61 -1.09 -1.26 -4.74 121.20 115.56 3ier s ILE 336 Ca 0.00 0.77 -0.25 0.00 -2.23 0.00 0.00 60.65 58.94 3ier s ILE 336 Cb 0.00 -3.70 0.03 0.00 -1.58 0.00 0.00 42.46 37.22 3ier s ILE 336 CO 0.00 0.49 1.45 -0.60 -1.23 0.00 0.00 174.94 175.05 3ier s ARG 337 N -0.43 3.34 0.10 2.79 6.06 -0.30 -4.97 118.95 125.54 3ier s ARG 337 Ca 0.22 -0.69 -0.17 0.00 -2.50 0.00 0.00 55.73 52.59 3ier s ARG 337 Cb -0.15 -4.91 -0.07 0.00 0.06 0.00 0.00 34.95 29.88 3ier s ARG 337 CO 0.10 -2.30 0.56 -0.65 -2.50 0.00 0.00 175.30 170.52 3ier s GLN 338 N 5.47 4.10 0.21 5.12 -0.21 -1.26 -1.32 119.66 131.78 3ier s GLN 338 Ca 0.45 0.63 0.11 0.00 0.02 0.00 0.00 55.36 56.58 3ier s GLN 338 Cb -0.04 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 30.82 3ier s GLN 338 CO 0.00 0.57 -0.21 0.20 -2.12 0.00 0.00 175.29 173.73 3ier s GLY 339 N -1.36 1.75 -0.05 3.09 0.00 -0.91 -1.34 107.32 108.50 3ier s GLY 339 Ca 0.33 -1.68 -0.01 0.00 0.00 0.00 0.00 44.72 43.36 3ier s GLY 339 CO 0.19 -1.72 0.00 -0.47 0.00 0.00 0.00 173.10 171.10 3ier s TYR 340 N -1.88 0.51 0.30 1.90 6.14 0.01 -3.76 117.35 120.57 3ier s TYR 340 Ca 0.23 -0.07 -0.19 0.00 0.64 0.00 0.00 57.07 57.67 3ier s TYR 340 Cb -0.07 -0.64 0.04 0.00 0.42 0.00 0.00 41.96 41.71 3ier s TYR 340 CO 0.12 -0.24 0.80 0.20 0.64 0.00 0.00 175.55 177.07 3ier s GLY 341 N 1.58 0.08 0.27 8.97 0.00 -0.89 -0.95 107.32 116.38 3ier s GLY 341 Ca -0.01 -0.43 0.04 0.00 0.00 0.00 0.00 44.72 44.31 3ier s GLY 341 CO -0.03 0.02 0.01 1.08 0.00 0.00 0.00 173.10 174.18 3ier s LEU 342 N -3.02 2.19 0.29 0.66 1.43 -1.26 -4.87 118.68 114.10 3ier s LEU 342 Ca 0.14 -1.27 0.00 0.00 -1.03 0.00 0.00 54.13 51.97 3ier s LEU 342 Cb -0.05 -0.33 0.51 0.00 0.03 0.00 0.00 46.19 46.35 3ier s LEU 342 CO 0.08 -0.53 1.88 0.74 0.23 0.00 0.00 176.35 178.75 3ier h THR 343 N 2.34 1.03 0.00 5.49 2.02 -1.93 -0.34 112.91 121.52 3ier h THR 343 Ca -0.39 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.43 3ier h THR 343 Cb 1.23 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3ier h THR 343 CO 0.66 0.19 0.00 -0.33 0.37 0.00 0.00 175.52 176.41 3ier h GLU 344 N 1.05 0.00 -0.39 6.66 3.07 -1.95 -2.16 114.58 120.87 3ier h GLU 344 Ca 0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.29 3ier h GLU 344 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3ier h GLU 344 CO -0.19 0.00 0.00 0.25 -1.40 0.00 0.00 179.01 177.67 3ier n THR 345 N -2.30 1.81 0.00 1.13 -2.24 -0.15 -0.51 114.28 112.03 3ier n THR 345 Ca 0.00 -1.43 0.00 0.00 -2.27 0.00 0.00 64.05 60.35 3ier n THR 345 Cb 0.14 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 3ier n THR 345 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3ier n THR 346 N 0.23 0.00 -2.79 4.28 -1.04 -0.81 -4.54 114.28 109.60 3ier n THR 346 Ca 0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.21 3ier n THR 346 Cb 0.76 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.27 3ier n THR 346 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 3ier n SER 347 N 1.64 0.00 -4.73 8.00 2.88 -1.26 -4.76 113.62 115.39 3ier n SER 347 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 3ier n SER 347 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 3ier n SER 347 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ier s ALA 348 N -1.88 3.41 -0.55 -1.46 0.00 -1.26 -4.22 121.76 115.80 3ier s ALA 348 Ca 0.00 0.89 0.10 0.00 0.00 0.00 0.00 51.96 52.95 3ier s ALA 348 Cb 0.00 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.62 3ier s ALA 348 CO 0.00 -0.34 0.47 0.44 0.00 0.00 0.00 175.76 176.33 3ier n ILE 349 N 2.77 0.00 -5.03 0.00 -0.00 -0.12 -4.88 119.36 112.10 3ier n ILE 349 Ca 0.05 -0.27 -0.31 0.00 -0.00 0.00 0.00 62.75 62.22 3ier n ILE 349 Cb 0.45 1.01 -0.17 0.00 -0.00 0.00 0.00 39.64 40.94 3ier n ILE 349 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 3ier s LEU 350 N -2.40 2.03 -0.03 7.28 1.43 -1.02 -1.34 118.68 124.64 3ier s LEU 350 Ca 0.05 -0.53 -0.02 0.00 -1.03 0.00 0.00 54.13 52.59 3ier s LEU 350 Cb 0.08 -1.34 0.01 0.00 0.03 0.00 0.00 46.19 44.97 3ier s LEU 350 CO 0.41 0.13 0.07 -0.63 0.23 0.00 0.00 176.35 176.56 3ier s ILE 351 N 0.48 -0.00 -0.04 -0.59 1.01 -0.03 -0.81 121.20 121.21 3ier s ILE 351 Ca -0.16 0.02 -0.31 0.00 0.00 0.00 0.00 60.65 60.19 3ier s ILE 351 Cb -0.17 -0.10 -0.10 0.00 0.01 0.00 0.00 42.46 42.10 3ier s ILE 351 CO 0.06 0.01 1.98 0.41 0.00 0.00 0.00 174.94 177.40 3ier n THR 352 N 3.14 0.65 -2.64 2.92 -1.04 -0.45 -1.26 114.28 115.61 3ier n THR 352 Ca -0.13 -0.17 -0.35 0.00 -2.04 0.00 0.00 64.05 61.36 3ier n THR 352 Cb 0.59 -2.18 -0.05 0.00 -1.82 0.00 0.00 70.33 66.87 3ier n THR 352 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3ier s PRO 353 N 4.61 4.08 0.17 -2.82 0.04 -1.26 -4.84 135.00 134.98 3ier s PRO 353 Ca 0.92 1.34 -0.33 0.00 0.04 0.00 0.00 61.00 62.97 3ier s PRO 353 Cb -0.52 -2.30 -0.14 0.00 0.04 0.00 0.00 34.50 31.58 3ier s PRO 353 CO 0.45 -0.18 1.59 -1.91 0.04 0.00 0.00 177.00 176.99 3ier n GLU 354 N -0.49 2.24 0.00 4.56 4.07 -0.32 -0.17 120.64 130.53 3ier n GLU 354 Ca 0.07 0.81 0.00 0.00 -0.06 0.00 0.00 57.16 57.98 3ier n GLU 354 Cb 0.52 -2.59 0.00 0.00 -0.06 0.00 0.00 31.44 29.31 3ier n GLU 354 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3ier n GLY 355 N 3.44 1.82 2.24 8.31 0.00 -1.26 -4.86 105.19 114.87 3ier n GLY 355 Ca 0.17 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.74 3ier n GLY 355 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ier n ASP 356 N 2.54 6.66 -4.77 1.61 2.03 0.76 -4.96 116.55 120.42 3ier n ASP 356 Ca 0.00 -3.24 -0.38 0.00 0.52 0.00 0.00 54.79 51.68 3ier n ASP 356 Cb 0.00 -1.12 -0.01 0.00 -0.72 0.00 0.00 41.12 39.27 3ier n ASP 356 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 3ier s ASP 357 N -0.04 6.23 -0.01 1.67 -4.77 -1.24 -4.44 116.67 114.07 3ier s ASP 357 Ca 0.47 2.48 0.05 0.00 -3.30 0.00 0.00 52.55 52.25 3ier s ASP 357 Cb 0.34 -2.62 -0.01 0.00 -1.09 0.00 0.00 42.92 39.54 3ier s ASP 357 CO -0.11 -0.89 -0.15 -0.54 0.70 0.00 0.00 175.17 174.18 3ier s LYS 358 N -2.44 1.21 0.00 2.11 1.02 -1.26 -5.09 119.74 115.29 3ier s LYS 358 Ca 0.60 -0.57 0.00 0.00 0.02 0.00 0.00 55.97 56.03 3ier s LYS 358 Cb -0.33 -1.18 0.00 0.00 -0.52 0.00 0.00 37.83 35.80 3ier s LYS 358 CO 0.42 0.32 0.00 -2.30 -0.92 0.00 0.00 175.35 172.87 3ier n PRO 359 N 2.63 0.00 -1.66 -1.68 -0.02 -1.26 -1.84 135.00 131.17 3ier n PRO 359 Ca -0.15 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.00 3ier n PRO 359 Cb 0.55 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 34.08 3ier n PRO 359 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ier n GLY 360 N 0.00 5.92 3.78 -1.23 0.00 -1.26 -4.96 105.19 107.43 3ier n GLY 360 Ca 0.00 -2.44 -0.37 0.00 0.00 0.00 0.00 46.02 43.20 3ier n GLY 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ier s ALA 361 N -3.81 3.16 0.08 4.61 0.00 -0.77 -4.55 121.76 120.49 3ier s ALA 361 Ca 0.59 0.70 0.07 0.00 0.00 0.00 0.00 51.96 53.31 3ier s ALA 361 Cb 0.47 -3.27 -0.22 0.00 0.00 0.00 0.00 23.12 20.10 3ier s ALA 361 CO -0.09 -0.13 1.14 -0.24 0.00 0.00 0.00 175.76 176.43 3ier h VAL 362 N 2.43 1.51 0.00 0.00 3.04 -0.73 -3.45 116.25 119.05 3ier h VAL 362 Ca -0.48 -3.24 0.00 0.00 -1.01 0.00 0.00 66.70 61.98 3ier h VAL 362 Cb 1.21 2.78 0.00 0.00 -2.01 0.00 0.00 31.29 33.27 3ier h VAL 362 CO 0.64 0.88 0.00 0.61 -1.01 0.00 0.00 177.57 178.68 3ier n GLY 363 N 1.42 0.72 3.41 3.17 0.00 -1.21 -2.98 105.19 109.72 3ier n GLY 363 Ca -0.05 -1.60 -0.26 0.00 0.00 0.00 0.00 46.02 44.11 3ier n GLY 363 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ier s LYS 364 N -2.00 1.48 0.17 1.61 1.02 -0.39 -0.13 119.74 121.51 3ier s LYS 364 Ca 0.00 -1.51 -0.32 0.00 0.02 0.00 0.00 55.97 54.16 3ier s LYS 364 Cb 0.00 -1.77 -0.12 0.00 -0.52 0.00 0.00 37.83 35.42 3ier s LYS 364 CO 0.00 0.38 1.73 0.28 -0.92 0.00 0.00 175.35 176.83 3ier n VAL 365 N 0.27 0.11 -1.53 3.17 0.31 -1.26 -0.85 118.33 118.55 3ier n VAL 365 Ca -0.13 -0.02 -0.30 0.00 -0.01 0.00 0.00 64.34 63.88 3ier n VAL 365 Cb 0.56 -1.94 0.08 0.00 -0.91 0.00 0.00 33.84 31.63 3ier n VAL 365 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 3ier s VAL 366 N 1.61 3.43 0.21 2.52 -7.23 -0.45 -4.10 120.40 116.40 3ier s VAL 366 Ca 0.78 0.47 -0.30 0.00 -1.81 0.00 0.00 61.98 61.11 3ier s VAL 366 Cb -0.53 -3.18 -0.16 0.00 0.56 0.00 0.00 36.38 33.07 3ier s VAL 366 CO 0.35 -0.61 0.95 -2.65 -0.31 0.00 0.00 175.10 172.83 3ier n PRO 367 N -3.34 0.90 -0.20 4.82 -0.02 -1.26 -1.92 135.00 133.99 3ier n PRO 367 Ca 0.07 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3ier n PRO 367 Cb 0.55 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 3ier n PRO 367 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3ier n PHE 368 N 0.65 0.00 -3.99 6.00 3.72 -1.26 -4.94 117.46 117.64 3ier n PHE 368 Ca 0.14 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.31 3ier n PHE 368 Cb 0.27 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.75 3ier n PHE 368 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3ier s PHE 369 N -3.03 2.77 0.04 1.38 0.40 -0.81 -4.28 117.98 114.46 3ier s PHE 369 Ca 0.00 -0.36 0.05 0.00 -0.60 0.00 0.00 56.93 56.02 3ier s PHE 369 Cb 0.00 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.80 3ier s PHE 369 CO 0.00 0.27 -0.13 -1.21 0.70 0.00 0.00 175.22 174.85 3ier s GLU 370 N -3.90 0.86 0.01 0.44 2.02 0.14 -1.52 118.70 116.75 3ier s GLU 370 Ca 0.39 -0.78 -0.00 0.00 0.02 0.00 0.00 54.97 54.60 3ier s GLU 370 Cb -0.04 -0.85 -0.01 0.00 0.10 0.00 0.00 34.13 33.33 3ier s GLU 370 CO 0.24 0.21 -0.01 0.00 0.02 0.00 0.00 175.26 175.71 3ier s ALA 371 N -0.95 0.07 0.17 5.21 0.00 -0.47 -0.77 121.76 125.02 3ier s ALA 371 Ca 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 3ier s ALA 371 Cb -0.08 0.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.12 3ier s ALA 371 CO 0.01 -0.13 0.16 -1.59 0.00 0.00 0.00 175.76 174.21 3ier s LYS 372 N -1.14 1.12 -0.03 0.00 -2.85 -0.34 -1.24 119.74 115.27 3ier s LYS 372 Ca -0.12 -1.45 0.06 0.00 -1.00 0.00 0.00 55.97 53.46 3ier s LYS 372 Cb -0.08 0.30 -0.02 0.00 -2.06 0.00 0.00 37.83 35.96 3ier s LYS 372 CO -0.01 -0.37 -0.20 0.14 0.10 0.00 0.00 175.35 175.01 3ier s VAL 373 N -4.07 2.55 0.10 1.79 -7.23 -1.26 -1.11 120.40 111.17 3ier s VAL 373 Ca 0.28 -0.95 0.10 0.00 -1.81 0.00 0.00 61.98 59.60 3ier s VAL 373 Cb 0.06 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 35.01 3ier s VAL 373 CO 0.06 0.56 -0.26 0.68 -0.31 0.00 0.00 175.10 175.83 3ier s VAL 374 N -0.69 2.19 0.17 1.32 -7.23 -0.40 -0.38 120.40 115.38 3ier s VAL 374 Ca 0.11 -1.63 -0.33 0.00 -1.81 0.00 0.00 61.98 58.32 3ier s VAL 374 Cb -0.10 -1.92 -0.15 0.00 0.56 0.00 0.00 36.38 34.76 3ier s VAL 374 CO 0.00 0.17 1.26 -0.67 -0.31 0.00 0.00 175.10 175.55 3ier n ASP 375 N 1.19 1.75 0.12 4.85 -0.08 0.39 -0.97 116.55 123.80 3ier n ASP 375 Ca -0.18 1.13 -0.03 0.00 -1.51 0.00 0.00 54.79 54.21 3ier n ASP 375 Cb 0.53 -1.26 0.10 0.00 2.34 0.00 0.00 41.12 42.83 3ier n ASP 375 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 3ier h LEU 376 N 3.88 0.03 0.00 -2.67 3.38 -1.89 -1.56 115.31 116.48 3ier h LEU 376 Ca -0.44 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.45 3ier h LEU 376 Cb 1.32 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 3ier h LEU 376 CO 0.73 0.73 -1.46 -0.90 0.09 0.00 0.00 178.44 177.63 3ier n ASP 377 N -3.71 0.55 -0.09 -0.43 5.75 -1.26 -4.67 116.55 112.69 3ier n ASP 377 Ca -0.01 0.22 -0.10 0.00 -0.01 0.00 0.00 54.79 54.89 3ier n ASP 377 Cb 0.69 0.87 -0.13 0.00 -1.03 0.00 0.00 41.12 41.52 3ier n ASP 377 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3ier n THR 378 N -2.61 1.23 -0.55 2.12 -2.24 -1.22 -5.03 114.28 105.98 3ier n THR 378 Ca -0.05 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 3ier n THR 378 Cb 0.65 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 3ier n THR 378 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ier n GLY 379 N 2.04 0.76 3.78 3.38 0.00 -0.59 -5.03 105.19 109.53 3ier n GLY 379 Ca -0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 3ier n GLY 379 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ier s LYS 380 N -0.45 3.83 0.32 1.61 2.20 -1.26 -4.63 119.74 121.36 3ier s LYS 380 Ca 0.00 1.68 -0.27 0.00 -0.36 0.00 0.00 55.97 57.01 3ier s LYS 380 Cb 0.00 -2.39 -0.09 0.00 -1.51 0.00 0.00 37.83 33.84 3ier s LYS 380 CO 0.00 -0.47 1.05 0.99 -0.36 0.00 0.00 175.35 176.56 3ier s THR 381 N -1.62 3.69 0.30 3.43 2.01 -1.26 0.15 115.64 122.34 3ier s THR 381 Ca 0.63 1.53 0.09 0.00 0.31 0.00 0.00 61.69 64.25 3ier s THR 381 Cb -0.26 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.30 3ier s THR 381 CO 0.31 0.24 0.08 -0.76 -0.69 0.00 0.00 174.62 173.80 3ier s LEU 382 N -1.87 3.26 0.00 4.42 1.43 0.48 -4.81 118.68 121.59 3ier s LEU 382 Ca 0.49 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 3ier s LEU 382 Cb -0.27 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.20 3ier s LEU 382 CO 0.34 -0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.38 3ier n GLY 383 N -1.04 1.14 3.77 -3.19 0.00 -1.26 -4.71 105.19 99.90 3ier n GLY 383 Ca -0.05 -1.98 -0.35 0.00 0.00 0.00 0.00 46.02 43.63 3ier n GLY 383 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ier s VAL 384 N 0.76 3.06 -1.28 1.61 1.01 -1.26 -2.71 120.40 121.59 3ier s VAL 384 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.65 3ier s VAL 384 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.11 3ier s VAL 384 CO 0.00 -0.14 0.00 0.59 0.00 0.00 0.00 175.10 175.55 3ier n ASN 385 N -1.32 -3.70 -4.54 3.32 3.02 0.48 -4.95 115.26 107.56 3ier n ASN 385 Ca 0.12 0.27 -0.33 0.00 -0.03 0.00 0.00 54.58 54.61 3ier n ASN 385 Cb 0.51 -3.32 -0.12 0.00 -0.61 0.00 0.00 39.78 36.23 3ier n ASN 385 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3ier s GLN 386 N -3.87 2.55 -0.08 3.52 -0.21 -1.10 -4.98 119.66 115.48 3ier s GLN 386 Ca 0.00 -0.69 -0.17 0.00 0.02 0.00 0.00 55.36 54.52 3ier s GLN 386 Cb 0.00 -2.46 -0.05 0.00 1.00 0.00 0.00 33.01 31.50 3ier s GLN 386 CO 0.00 0.62 0.46 1.03 -2.12 0.00 0.00 175.29 175.28 3ier s ARG 387 N -1.04 4.25 0.03 2.91 0.52 -1.26 -4.40 118.95 119.95 3ier s ARG 387 Ca 0.14 0.45 -0.02 0.00 -0.52 0.00 0.00 55.73 55.78 3ier s ARG 387 Cb -0.11 -3.38 0.01 0.00 0.52 0.00 0.00 34.95 31.99 3ier s ARG 387 CO 0.03 0.30 0.09 0.41 0.02 0.00 0.00 175.30 176.15 3ier n GLY 388 N 2.88 1.60 3.69 -3.53 0.00 -0.66 -4.83 105.19 104.33 3ier n GLY 388 Ca -0.09 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 3ier n GLY 388 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ier s GLU 389 N -2.01 4.39 0.11 1.61 2.12 -0.14 -0.84 118.70 123.94 3ier s GLU 389 Ca 0.02 1.50 -0.31 0.00 0.36 0.00 0.00 54.97 56.54 3ier s GLU 389 Cb -0.00 -3.55 -0.08 0.00 0.26 0.00 0.00 34.13 30.75 3ier s GLU 389 CO 0.01 -0.38 1.44 -1.17 -0.54 0.00 0.00 175.26 174.61 3ier s LEU 390 N 2.16 4.36 0.01 2.70 2.96 0.37 -1.28 118.68 129.96 3ier s LEU 390 Ca 0.51 2.36 0.04 0.00 -0.22 0.00 0.00 54.13 56.82 3ier s LEU 390 Cb -0.21 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.89 3ier s LEU 390 CO 0.19 -0.70 -0.12 0.00 -1.32 0.00 0.00 176.35 174.40 3ier s VAL 392 N -0.53 0.42 -0.01 0.00 -7.23 -0.69 -1.19 120.40 111.17 3ier s VAL 392 Ca 0.02 -0.93 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 3ier s VAL 392 Cb -0.06 -0.49 0.02 0.00 0.56 0.00 0.00 36.38 36.41 3ier s VAL 392 CO 0.00 -0.35 0.01 -0.60 -0.31 0.00 0.00 175.10 173.85 3ier s ARG 393 N -1.37 0.06 0.00 4.82 3.52 0.05 -0.79 118.95 125.24 3ier s ARG 393 Ca -0.10 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.58 3ier s ARG 393 Cb -0.09 -0.22 0.00 0.00 -1.56 0.00 0.00 34.95 33.08 3ier s ARG 393 CO 0.00 -0.09 0.00 0.41 -0.81 0.00 0.00 175.30 174.81 3ier n GLY 394 N 3.73 1.03 0.07 8.12 0.00 -1.26 -0.68 105.19 116.19 3ier n GLY 394 Ca -0.22 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.74 3ier n GLY 394 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3ier n PRO 395 N -0.71 0.92 0.00 1.61 -0.04 -1.26 -2.38 135.00 133.14 3ier n PRO 395 Ca 0.00 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 3ier n PRO 395 Cb 0.00 -1.07 0.02 0.00 -0.04 0.00 0.00 33.50 32.41 3ier n PRO 395 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3ier n MET 396 N -0.42 1.56 -1.81 0.54 2.81 -1.26 -4.12 117.12 114.42 3ier n MET 396 Ca 0.00 -1.13 -0.40 0.00 -1.81 0.00 0.00 57.70 54.36 3ier n MET 396 Cb 0.03 -1.38 0.01 0.00 -0.71 0.00 0.00 33.22 31.18 3ier n MET 396 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3ier s ILE 397 N -2.04 2.08 0.88 2.02 -1.09 -1.00 -3.37 121.20 118.68 3ier s ILE 397 Ca 0.18 0.07 -0.11 0.00 -2.23 0.00 0.00 60.65 58.56 3ier s ILE 397 Cb 0.16 -3.04 0.13 0.00 -1.58 0.00 0.00 42.46 38.12 3ier s ILE 397 CO 0.42 0.01 1.17 0.00 -1.23 0.00 0.00 174.94 175.31 3ier s MET 398 N -2.35 1.20 0.36 2.79 0.23 0.33 -4.89 119.30 116.98 3ier s MET 398 Ca 0.59 1.63 0.18 0.00 -1.03 0.00 0.00 55.69 57.05 3ier s MET 398 Cb -0.44 -1.74 0.65 0.00 -1.53 0.00 0.00 34.83 31.77 3ier s MET 398 CO 0.58 -2.52 1.73 0.77 -2.03 0.00 0.00 175.02 173.55 3ier h SER 399 N -1.56 0.00 -1.17 -1.18 0.02 -1.61 -3.49 113.55 104.56 3ier h SER 399 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 3ier h SER 399 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 3ier h SER 399 CO 0.43 0.40 0.00 0.61 -1.14 0.00 0.00 176.83 177.13 3ier n GLY 400 N 0.20 2.10 3.75 -3.77 0.00 -1.25 -5.03 105.19 101.19 3ier n GLY 400 Ca -0.00 -1.31 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 3ier n GLY 400 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ier s TYR 401 N -1.97 3.72 0.06 1.61 2.02 -1.26 -1.65 117.35 119.89 3ier s TYR 401 Ca 0.00 1.74 -0.30 0.00 -0.37 0.00 0.00 57.07 58.13 3ier s TYR 401 Cb 0.00 -3.17 -0.09 0.00 -0.40 0.00 0.00 41.96 38.30 3ier s TYR 401 CO 0.00 -0.21 1.78 0.08 -1.57 0.00 0.00 175.55 175.63 3ier s VAL 402 N -0.72 2.93 -1.50 0.71 1.01 0.30 -2.44 120.40 120.69 3ier s VAL 402 Ca 0.45 0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.66 3ier s VAL 402 Cb -0.29 -3.17 0.02 0.00 0.00 0.00 0.00 36.38 32.94 3ier s VAL 402 CO 0.35 -0.01 0.38 0.59 0.00 0.00 0.00 175.10 176.42 3ier n ASN 403 N 6.25 -5.38 -2.92 3.32 5.03 -1.26 -4.78 115.26 115.53 3ier n ASN 403 Ca 0.18 -0.19 -0.13 0.00 0.87 0.00 0.00 54.58 55.31 3ier n ASN 403 Cb 0.40 -4.41 0.03 0.00 -1.02 0.00 0.00 39.78 34.78 3ier n ASN 403 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3ier n ASN 404 N -2.29 -1.27 0.28 6.41 2.85 -1.02 -4.99 115.26 115.23 3ier n ASN 404 Ca -0.13 -3.30 0.12 0.00 -0.11 0.00 0.00 54.58 51.17 3ier n ASN 404 Cb 0.62 0.88 0.79 0.00 1.24 0.00 0.00 39.78 43.31 3ier n ASN 404 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3ier h PRO 405 N 3.35 0.00 -0.05 1.20 0.13 -1.90 -1.98 132.00 132.75 3ier h PRO 405 Ca -0.03 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.08 3ier h PRO 405 Cb 1.02 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 3ier h PRO 405 CO 0.32 0.04 -0.04 0.93 -0.23 0.00 0.00 178.00 179.02 3ier h GLU 406 N 0.00 0.11 -0.33 0.86 5.08 -1.96 0.05 114.58 118.40 3ier h GLU 406 Ca -0.00 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3ier h GLU 406 Cb 0.09 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3ier h GLU 406 CO 0.01 0.53 0.20 0.00 -1.00 0.00 0.00 179.01 178.75 3ier h ALA 407 N 0.57 1.74 -0.19 3.43 0.00 -1.93 -1.05 119.26 121.84 3ier h ALA 407 Ca 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3ier h ALA 407 Cb 0.51 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3ier h ALA 407 CO 0.01 0.23 0.08 1.15 0.00 0.00 0.00 179.25 180.72 3ier h THR 408 N 0.44 1.15 0.00 0.00 2.02 -0.93 -2.79 112.91 112.81 3ier h THR 408 Ca 0.12 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 3ier h THR 408 Cb -0.03 1.11 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3ier h THR 408 CO -0.02 0.15 -0.09 0.78 0.37 0.00 0.00 175.52 176.71 3ier h ASN 409 N 0.15 0.00 0.91 4.18 2.35 -0.84 -0.67 115.58 121.66 3ier h ASN 409 Ca 0.06 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.74 3ier h ASN 409 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3ier h ASN 409 CO -0.01 0.09 -0.34 0.00 -1.65 0.00 0.00 177.43 175.52 3ier h ALA 410 N 1.91 0.98 0.03 -0.83 0.00 -1.00 -3.33 119.26 117.02 3ier h ALA 410 Ca -0.00 -0.31 -0.37 0.00 0.00 0.00 0.00 54.91 54.23 3ier h ALA 410 Cb 0.77 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.45 3ier h ALA 410 CO 0.01 0.43 -2.27 -0.11 0.00 0.00 0.00 179.25 177.31 3ier n LEU 411 N -3.48 1.91 -4.15 0.00 7.94 -0.55 -4.89 117.00 113.78 3ier n LEU 411 Ca -0.00 0.03 -0.33 0.00 -1.11 0.00 0.00 56.01 54.60 3ier n LEU 411 Cb 0.50 -0.47 -0.15 0.00 0.53 0.00 0.00 43.42 43.82 3ier n LEU 411 CO 0.36 0.75 -0.49 -0.63 -1.11 0.00 0.00 177.39 176.27 3ier s ILE 412 N -2.53 2.35 0.85 1.96 1.01 -0.37 -1.07 121.20 123.41 3ier s ILE 412 Ca -0.23 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 59.40 3ier s ILE 412 Cb 0.08 -2.05 0.19 0.00 0.01 0.00 0.00 42.46 40.68 3ier s ILE 412 CO 0.72 0.45 1.16 -0.90 0.00 0.00 0.00 174.94 176.37 3ier n ASP 413 N 4.64 0.53 0.26 3.58 5.68 -0.57 -4.52 116.55 126.15 3ier n ASP 413 Ca -0.20 -1.69 0.14 0.00 -0.50 0.00 0.00 54.79 52.54 3ier n ASP 413 Cb 0.49 -0.85 0.65 0.00 -1.14 0.00 0.00 41.12 40.28 3ier n ASP 413 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 3ier h LYS 414 N 0.00 0.00 -0.51 0.11 -0.00 -1.92 -0.85 116.57 113.40 3ier h LYS 414 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.27 3ier h LYS 414 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.38 3ier h LYS 414 CO 0.31 0.11 0.00 -0.25 -0.00 0.00 0.00 179.45 179.62 3ier n ASP 415 N -3.32 2.76 0.00 7.07 8.00 -1.26 -4.92 116.55 124.88 3ier n ASP 415 Ca -0.00 -2.05 0.00 0.00 0.71 0.00 0.00 54.79 53.45 3ier n ASP 415 Cb 0.32 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 3ier n ASP 415 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ier n GLY 416 N 1.21 0.76 3.70 0.44 0.00 -0.32 -5.04 105.19 105.94 3ier n GLY 416 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3ier n GLY 416 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ier s TRP 417 N -2.75 3.57 -0.04 1.61 0.52 -1.26 -4.63 118.94 115.96 3ier s TRP 417 Ca 0.00 1.59 -0.26 0.00 0.02 0.00 0.00 56.10 57.45 3ier s TRP 417 Cb 0.00 -3.13 -0.03 0.00 -1.15 0.00 0.00 33.47 29.16 3ier s TRP 417 CO 0.00 -0.13 0.81 -1.17 0.02 0.00 0.00 176.95 176.49 3ier s LEU 418 N 1.58 4.34 -0.42 2.99 0.20 0.03 -1.52 118.68 125.87 3ier s LEU 418 Ca 0.48 1.38 -0.16 0.00 0.69 0.00 0.00 54.13 56.52 3ier s LEU 418 Cb -0.19 -3.28 0.02 0.00 -0.43 0.00 0.00 46.19 42.31 3ier s LEU 418 CO 0.21 -0.17 0.37 -1.00 -0.29 0.00 0.00 176.35 175.47 3ier s HIS 419 N 0.88 3.20 -0.25 5.38 3.76 -0.23 -1.70 115.29 126.33 3ier s HIS 419 Ca 0.43 -0.51 0.26 0.00 -0.15 0.00 0.00 55.06 55.09 3ier s HIS 419 Cb -0.19 -2.77 0.63 0.00 1.11 0.00 0.00 32.58 31.36 3ier s HIS 419 CO 0.22 -0.66 1.71 0.66 -0.85 0.00 0.00 174.74 175.83 3ier h SER 420 N 8.69 0.00 0.00 1.40 4.64 -1.53 -3.47 113.55 123.27 3ier h SER 420 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3ier h SER 420 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 3ier h SER 420 CO 0.77 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 177.38 3ier n GLY 421 N 0.78 2.64 3.88 -0.77 0.00 -1.26 -5.02 105.19 105.45 3ier n GLY 421 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 3ier n GLY 421 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ier s ASP 422 N -1.94 6.54 -0.08 1.61 1.01 -1.26 -4.97 116.67 117.58 3ier s ASP 422 Ca 0.00 0.65 -0.17 0.00 0.71 0.00 0.00 52.55 53.74 3ier s ASP 422 Cb 0.00 -2.12 -0.05 0.00 1.01 0.00 0.00 42.92 41.76 3ier s ASP 422 CO 0.00 0.14 0.45 -0.63 0.21 0.00 0.00 175.17 175.34 3ier s ILE 423 N -1.49 5.13 0.28 0.77 1.01 -1.26 -0.48 121.20 125.16 3ier s ILE 423 Ca 0.35 0.92 -0.06 0.00 0.00 0.00 0.00 60.65 61.86 3ier s ILE 423 Cb -0.13 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 3ier s ILE 423 CO 0.21 0.40 0.41 0.00 0.00 0.00 0.00 174.94 175.96 3ier s ALA 424 N 0.11 0.49 0.10 9.38 0.00 -0.02 -0.89 121.76 130.93 3ier s ALA 424 Ca 0.25 -1.32 -0.15 0.00 0.00 0.00 0.00 51.96 50.74 3ier s ALA 424 Cb -0.16 1.17 0.03 0.00 0.00 0.00 0.00 23.12 24.16 3ier s ALA 424 CO 0.11 -0.78 0.35 1.52 0.00 0.00 0.00 175.76 176.97 3ier s TYR 425 N -3.62 -0.14 0.18 0.00 -0.85 -0.66 -1.66 117.35 110.60 3ier s TYR 425 Ca 0.29 -0.14 0.11 0.00 -0.52 0.00 0.00 57.07 56.81 3ier s TYR 425 Cb 0.01 0.18 -0.04 0.00 0.38 0.00 0.00 41.96 42.49 3ier s TYR 425 CO 0.15 -0.64 -0.24 1.67 -1.52 0.00 0.00 175.55 174.97 3ier s TRP 426 N -3.51 2.27 0.36 -3.49 1.48 -1.26 -1.07 118.94 113.72 3ier s TRP 426 Ca 0.01 -0.37 0.04 0.00 -1.06 0.00 0.00 56.10 54.72 3ier s TRP 426 Cb 0.02 -1.15 0.04 0.00 -1.16 0.00 0.00 33.47 31.21 3ier s TRP 426 CO -0.10 0.45 0.30 -0.40 -4.06 0.00 0.00 176.95 173.15 3ier n ASP 427 N 0.43 2.02 0.25 -2.66 5.68 -0.28 -0.39 116.55 121.60 3ier n ASP 427 Ca -0.14 -2.20 0.11 0.00 -0.50 0.00 0.00 54.79 52.06 3ier n ASP 427 Cb 0.55 -0.06 0.67 0.00 -1.14 0.00 0.00 41.12 41.14 3ier n ASP 427 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3ier h GLU 428 N 0.00 0.00 -0.11 0.11 3.07 -1.98 -0.20 114.58 115.47 3ier h GLU 428 Ca -0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 3ier h GLU 428 Cb 0.82 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.73 3ier h GLU 428 CO 0.34 0.14 0.00 -0.25 -1.40 0.00 0.00 179.01 177.84 3ier n ASP 429 N -3.83 1.48 -0.92 1.42 8.00 -1.26 -4.94 116.55 116.51 3ier n ASP 429 Ca -0.02 -1.61 -0.10 0.00 0.71 0.00 0.00 54.79 53.77 3ier n ASP 429 Cb 0.24 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 3ier n ASP 429 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3ier n GLU 430 N 0.18 -0.76 -2.93 -1.24 1.02 -0.09 -5.03 120.64 111.79 3ier n GLU 430 Ca 0.17 0.76 -0.39 0.00 -0.02 0.00 0.00 57.16 57.68 3ier n GLU 430 Cb 0.32 -4.74 -0.06 0.00 -0.02 0.00 0.00 31.44 26.93 3ier n GLU 430 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3ier s HIS 431 N -2.43 3.86 0.07 -0.32 3.76 -1.26 -4.58 115.29 114.40 3ier s HIS 431 Ca 0.00 1.67 0.02 0.00 -0.15 0.00 0.00 55.06 56.60 3ier s HIS 431 Cb 0.00 -2.80 -0.04 0.00 1.11 0.00 0.00 32.58 30.85 3ier s HIS 431 CO 0.00 0.45 0.13 -0.06 -0.85 0.00 0.00 174.74 174.41 3ier s PHE 432 N -1.26 3.33 -0.05 1.40 0.40 0.81 -1.12 117.98 121.49 3ier s PHE 432 Ca 0.39 0.15 0.01 0.00 -0.60 0.00 0.00 56.93 56.88 3ier s PHE 432 Cb -0.22 -1.68 0.02 0.00 0.51 0.00 0.00 43.02 41.65 3ier s PHE 432 CO 0.26 0.55 -0.06 -0.06 0.70 0.00 0.00 175.22 176.62 3ier s PHE 433 N -1.44 0.84 -0.19 0.36 0.40 -0.23 0.02 117.98 117.73 3ier s PHE 433 Ca 0.32 -0.25 -0.12 0.00 -0.60 0.00 0.00 56.93 56.28 3ier s PHE 433 Cb -0.12 -0.71 -0.05 0.00 0.51 0.00 0.00 43.02 42.65 3ier s PHE 433 CO 0.25 -0.19 0.21 0.42 0.70 0.00 0.00 175.22 176.60 3ier s ILE 434 N 0.84 5.35 0.00 0.64 -1.09 -1.26 -1.65 121.20 124.03 3ier s ILE 434 Ca -0.12 0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.64 3ier s ILE 434 Cb -0.15 -3.54 0.00 0.00 -1.58 0.00 0.00 42.46 37.19 3ier s ILE 434 CO 0.01 0.40 0.48 1.33 -1.23 0.00 0.00 174.94 175.92