#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hay s ILE 12 N 0.00 0.80 0.35 0.55 -4.36 -1.26 -5.13 121.20 112.16 3hay s ILE 12 Ca 0.00 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.47 3hay s ILE 12 Cb 0.00 -2.66 -0.07 0.00 1.25 0.00 0.00 42.46 40.98 3hay s ILE 12 CO 0.00 0.00 -0.05 -0.76 0.24 0.00 0.00 174.94 174.37 3hay s LEU 13 N -3.42 2.69 0.64 0.37 1.02 -1.26 -4.88 118.68 113.84 3hay s LEU 13 Ca 0.36 -1.26 0.41 0.00 0.02 0.00 0.00 54.13 53.66 3hay s LEU 13 Cb 0.07 -0.87 2.18 0.00 0.02 0.00 0.00 46.19 47.60 3hay s LEU 13 CO 0.15 -0.33 2.30 -0.65 0.02 0.00 0.00 176.35 177.84 3hay h PRO 14 N 2.00 0.00 0.00 1.29 0.11 -1.99 -1.50 132.00 131.91 3hay h PRO 14 Ca -0.42 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.56 3hay h PRO 14 Cb 1.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 3hay h PRO 14 CO 0.73 0.01 -0.62 0.00 -0.21 0.00 0.00 178.00 177.91 3hay h ALA 15 N 1.99 0.66 -0.30 -0.75 0.00 -1.91 -3.30 119.26 115.65 3hay h ALA 15 Ca -0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 54.91 54.19 3hay h ALA 15 Cb 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hay h ALA 15 CO 0.00 0.77 -0.44 -0.44 0.00 0.00 0.00 179.25 179.15 3hay h ASP 16 N 0.00 0.83 -1.31 0.00 3.32 -1.62 -3.43 116.42 114.21 3hay h ASP 16 Ca -0.01 -0.40 -0.58 0.00 0.02 0.00 0.00 57.03 56.07 3hay h ASP 16 Cb 1.39 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 3hay h ASP 16 CO 0.08 1.15 1.53 -0.38 -1.72 0.00 0.00 179.24 179.90 3hay n ILE 17 N -4.03 0.13 -2.81 0.35 5.41 -1.15 -4.91 119.36 112.35 3hay n ILE 17 Ca -0.02 -0.43 -0.41 0.00 1.00 0.00 0.00 62.75 62.88 3hay n ILE 17 Cb 0.56 -2.05 -0.03 0.00 -0.71 0.00 0.00 39.64 37.40 3hay n ILE 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 3hay s LYS 18 N 7.12 4.51 0.00 0.38 1.02 -1.26 -5.06 119.74 126.45 3hay s LYS 18 Ca 1.07 1.25 0.00 0.00 0.02 0.00 0.00 55.97 58.31 3hay s LYS 18 Cb -0.60 -3.46 0.00 0.00 -0.52 0.00 0.00 37.83 33.25 3hay s LYS 18 CO 0.40 -0.03 0.00 0.54 -0.92 0.00 0.00 175.35 175.33 3hay n ARG 19 N 3.93 3.33 -3.64 1.68 5.12 -1.26 -5.13 116.66 120.70 3hay n ARG 19 Ca 0.04 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.83 3hay n ARG 19 Cb 0.51 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.74 3hay n ARG 19 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 3hay s GLU 20 N 0.00 0.78 -0.07 5.56 2.12 -1.26 -4.97 118.70 120.85 3hay s GLU 20 Ca 0.00 0.97 -0.30 0.00 0.36 0.00 0.00 54.97 56.01 3hay s GLU 20 Cb 0.00 0.35 -0.03 0.00 0.26 0.00 0.00 34.13 34.71 3hay s GLU 20 CO 0.00 -0.10 1.21 0.08 -0.54 0.00 0.00 175.26 175.91 3hay s VAL 21 N 0.52 4.25 0.01 3.70 1.01 -1.26 -2.18 120.40 126.44 3hay s VAL 21 Ca -0.01 1.57 0.01 0.00 0.00 0.00 0.00 61.98 63.55 3hay s VAL 21 Cb -0.05 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 3hay s VAL 21 CO -0.02 -0.02 0.02 -0.76 0.00 0.00 0.00 175.10 174.32 3hay s LEU 22 N 2.41 3.57 -0.38 3.92 1.43 -0.03 -4.96 118.68 124.64 3hay s LEU 22 Ca 0.56 0.00 -0.07 0.00 -1.03 0.00 0.00 54.13 53.59 3hay s LEU 22 Cb -0.24 -2.08 0.07 0.00 0.03 0.00 0.00 46.19 43.97 3hay s LEU 22 CO 0.21 0.27 0.18 -0.63 0.23 0.00 0.00 176.35 176.61 3hay s ILE 23 N -1.13 3.83 -0.14 -0.59 -1.09 -1.26 -2.35 121.20 118.48 3hay s ILE 23 Ca 0.21 -1.43 0.17 0.00 -2.23 0.00 0.00 60.65 57.37 3hay s ILE 23 Cb -0.12 -3.32 -0.08 0.00 -1.58 0.00 0.00 42.46 37.36 3hay s ILE 23 CO 0.12 -0.40 0.98 0.50 -1.23 0.00 0.00 174.94 174.90 3hay h LYS 24 N 8.25 0.00 -2.86 2.79 3.64 -1.83 -3.46 116.57 123.11 3hay h LYS 24 Ca -0.21 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 58.98 3hay h LYS 24 Cb 1.07 0.00 -0.31 0.00 -0.41 0.00 0.00 32.23 32.59 3hay h LYS 24 CO 0.68 0.32 -0.49 0.34 -2.27 0.00 0.00 179.45 178.03 3hay s ASP 25 N -5.90 0.08 -0.03 4.20 2.15 -0.94 -5.05 116.67 111.18 3hay s ASP 25 Ca -0.01 0.63 0.18 0.00 0.43 0.00 0.00 52.55 53.78 3hay s ASP 25 Cb 0.08 0.69 -0.21 0.00 -0.30 0.00 0.00 42.92 43.18 3hay s ASP 25 CO 0.80 -0.22 0.55 -0.62 -0.17 0.00 0.00 175.17 175.51 3hay n GLU 26 N 4.99 0.65 0.00 4.34 4.71 -1.26 -4.47 120.64 129.59 3hay n GLU 26 Ca -0.13 0.09 0.12 0.00 -0.01 0.00 0.00 57.16 57.23 3hay n GLU 26 Cb 0.51 -1.68 0.15 0.00 -1.01 0.00 0.00 31.44 29.41 3hay n GLU 26 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hay n ASN 27 N -2.75 0.85 -4.60 1.62 3.02 -1.26 -4.84 115.26 107.31 3hay n ASN 27 Ca -0.16 -0.67 -0.43 0.00 -0.03 0.00 0.00 54.58 53.30 3hay n ASN 27 Cb 0.89 0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 40.49 3hay n ASN 27 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hay s ALA 28 N -2.87 2.88 0.25 5.41 0.00 -1.26 -4.98 121.76 121.18 3hay s ALA 28 Ca 0.13 0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.26 3hay s ALA 28 Cb 0.17 -4.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.25 3hay s ALA 28 CO 0.70 -2.63 0.24 -1.83 0.00 0.00 0.00 175.76 172.24 3hay s GLU 29 N 5.54 3.06 -0.07 0.00 -1.05 -1.26 -5.06 118.70 119.86 3hay s GLU 29 Ca 0.74 -0.97 -0.05 0.00 -0.15 0.00 0.00 54.97 54.54 3hay s GLU 29 Cb -0.20 -2.65 -0.04 0.00 -0.44 0.00 0.00 34.13 30.80 3hay s GLU 29 CO 0.33 0.41 0.16 -0.08 0.95 0.00 0.00 175.26 177.03 3hay s THR 30 N -2.09 5.47 -0.30 1.83 -1.32 -1.26 -4.69 115.64 113.29 3hay s THR 30 Ca 0.33 0.04 -0.11 0.00 -1.21 0.00 0.00 61.69 60.74 3hay s THR 30 Cb -0.08 -3.46 -0.04 0.00 -1.51 0.00 0.00 72.50 67.41 3hay s THR 30 CO 0.26 0.49 0.20 0.21 -2.21 0.00 0.00 174.62 173.56 3hay s ASN 31 N -1.44 5.99 0.10 8.08 3.84 -1.26 -4.99 114.94 125.26 3hay s ASN 31 Ca 0.21 -0.14 0.20 0.00 0.21 0.00 0.00 52.86 53.33 3hay s ASN 31 Cb -0.12 -2.12 0.81 0.00 -0.55 0.00 0.00 41.25 39.27 3hay s ASN 31 CO 0.11 -0.10 1.61 -0.81 -2.79 0.00 0.00 177.10 175.11 3hay n PRO 32 N 5.07 0.08 0.07 0.43 -0.04 -1.26 -3.49 135.00 135.87 3hay n PRO 32 Ca -0.14 0.28 0.01 0.00 -0.04 0.00 0.00 63.50 63.62 3hay n PRO 32 Cb 0.51 -1.65 -0.04 0.00 -0.04 0.00 0.00 33.50 32.29 3hay n PRO 32 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3hay h ASP 33 N 0.00 0.00 -3.15 3.54 3.45 -2.02 -3.46 116.42 114.79 3hay h ASP 33 Ca 0.00 0.00 -0.66 0.00 0.43 0.00 0.00 57.03 56.80 3hay h ASP 33 Cb 0.34 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.00 3hay h ASP 33 CO 0.00 0.52 -0.59 0.26 -1.57 0.00 0.00 179.24 177.86 3hay s TRP 34 N -2.96 3.25 0.00 4.55 0.51 -1.23 -5.02 118.94 118.04 3hay s TRP 34 Ca -0.00 0.22 0.00 0.00 -2.12 0.00 0.00 56.10 54.19 3hay s TRP 34 Cb 0.08 -1.76 0.00 0.00 -0.81 0.00 0.00 33.47 30.98 3hay s TRP 34 CO 0.79 0.54 0.00 0.41 -0.51 0.00 0.00 176.95 178.17 3hay n GLY 35 N 1.53 -1.96 2.92 0.98 0.00 -1.08 -4.92 105.19 102.66 3hay n GLY 35 Ca -0.15 -1.46 -0.28 0.00 0.00 0.00 0.00 46.02 44.12 3hay n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hay s PHE 36 N -3.26 1.80 0.67 1.61 0.40 -1.26 -5.07 117.98 112.87 3hay s PHE 36 Ca 0.00 -1.10 -0.11 0.00 -0.60 0.00 0.00 56.93 55.12 3hay s PHE 36 Cb 0.00 -1.37 -0.00 0.00 0.51 0.00 0.00 43.02 42.16 3hay s PHE 36 CO 0.00 -0.62 1.05 -2.14 0.70 0.00 0.00 175.22 174.21 3hay s PRO 37 N 1.60 3.10 0.52 0.24 0.02 -1.26 -4.84 135.00 134.38 3hay s PRO 37 Ca 0.02 0.51 0.35 0.00 0.02 0.00 0.00 61.00 61.89 3hay s PRO 37 Cb -0.15 -2.07 1.50 0.00 0.02 0.00 0.00 34.50 33.81 3hay s PRO 37 CO -0.08 -0.85 1.78 -1.35 -0.33 0.00 0.00 177.00 176.17 3hay h PRO 38 N -0.49 0.06 -0.09 5.54 0.11 -1.87 -1.03 132.00 134.22 3hay h PRO 38 Ca -0.45 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.51 3hay h PRO 38 Cb 1.23 -0.01 0.01 0.00 0.11 0.00 0.00 31.00 32.34 3hay h PRO 38 CO 0.63 0.04 -0.52 0.93 -0.21 0.00 0.00 178.00 178.86 3hay h GLU 39 N 0.06 0.51 -0.95 1.05 3.07 -1.97 -3.34 114.58 113.01 3hay h GLU 39 Ca 0.61 -0.43 -0.64 0.00 -0.50 0.00 0.00 59.36 58.39 3hay h GLU 39 Cb 2.29 0.09 -0.31 0.00 -0.84 0.00 0.00 28.75 29.98 3hay h GLU 39 CO -0.07 1.06 0.59 1.63 -1.40 0.00 0.00 179.01 180.82 3hay n LYS 40 N -4.22 2.80 -3.48 2.33 4.01 -0.43 -4.94 118.16 114.23 3hay n LYS 40 Ca -0.08 -3.41 -0.37 0.00 -0.51 0.00 0.00 58.31 53.94 3hay n LYS 40 Cb 0.61 -2.27 -0.07 0.00 -0.51 0.00 0.00 35.03 32.79 3hay n LYS 40 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 3hay s ARG 41 N -3.76 4.26 0.54 1.97 0.52 -0.99 -4.54 118.95 116.95 3hay s ARG 41 Ca 0.62 0.16 -0.22 0.00 -0.52 0.00 0.00 55.73 55.78 3hay s ARG 41 Cb 0.49 -3.45 -0.05 0.00 0.52 0.00 0.00 34.95 32.46 3hay s ARG 41 CO 0.00 0.18 1.29 -2.30 0.02 0.00 0.00 175.30 174.50 3hay n PRO 42 N 3.74 1.61 0.16 3.54 -0.02 -1.26 -4.73 135.00 138.03 3hay n PRO 42 Ca -0.11 0.59 0.18 0.00 -2.02 0.00 0.00 63.50 62.14 3hay n PRO 42 Cb 0.52 -2.49 0.78 0.00 -0.02 0.00 0.00 33.50 32.29 3hay n PRO 42 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3hay h ILE 43 N 1.39 0.53 -0.08 4.25 6.09 -1.99 0.10 117.51 127.80 3hay h ILE 43 Ca -0.50 0.00 -0.15 0.00 -1.37 0.00 0.00 64.86 62.84 3hay h ILE 43 Cb 1.31 0.80 0.01 0.00 0.47 0.00 0.00 36.82 39.41 3hay h ILE 43 CO 0.57 0.00 -0.54 -0.33 -3.07 0.00 0.00 178.15 174.78 3hay h GLU 44 N 0.00 0.51 -0.50 2.19 3.07 -2.02 -3.30 114.58 114.53 3hay h GLU 44 Ca 0.12 -0.44 -0.05 0.00 -0.50 0.00 0.00 59.36 58.49 3hay h GLU 44 Cb 0.63 0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.61 3hay h GLU 44 CO -0.00 1.07 0.09 1.98 -1.40 0.00 0.00 179.01 180.75 3hay h MET 45 N 0.10 0.77 0.00 2.33 4.05 -1.19 -2.80 114.93 118.19 3hay h MET 45 Ca -0.04 -0.17 -0.02 0.00 -0.28 0.00 0.00 59.70 59.19 3hay h MET 45 Cb 1.20 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.88 3hay h MET 45 CO 0.11 0.72 -0.08 1.25 0.23 0.00 0.00 176.91 179.14 3hay h HIS 46 N 0.74 0.00 0.15 1.39 6.17 -1.33 -2.13 115.15 120.14 3hay h HIS 46 Ca 0.16 0.00 -0.29 0.00 0.71 0.00 0.00 60.37 60.95 3hay h HIS 46 Cb 0.32 0.00 0.03 0.00 2.52 0.00 0.00 27.41 30.28 3hay h HIS 46 CO 0.02 0.08 -1.22 0.82 0.71 0.00 0.00 177.93 178.33 3hay h ILE 47 N 0.00 1.31 -0.21 6.26 2.04 -1.59 -2.79 117.51 122.53 3hay h ILE 47 Ca -0.00 -2.50 -0.00 0.00 1.00 0.00 0.00 64.86 63.36 3hay h ILE 47 Cb 0.20 2.83 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 3hay h ILE 47 CO 0.01 0.75 0.13 1.56 0.00 0.00 0.00 178.15 180.60 3hay h GLN 48 N 0.16 0.29 -2.46 2.37 1.08 -1.44 -3.18 115.11 111.93 3hay h GLN 48 Ca -0.20 -0.03 -0.71 0.00 -1.45 0.00 0.00 58.65 56.27 3hay h GLN 48 Cb 1.92 -0.06 -0.34 0.00 -0.05 0.00 0.00 27.48 28.94 3hay h GLN 48 CO 0.23 0.24 0.20 1.19 -0.95 0.00 0.00 178.83 179.74 3hay n PHE 49 N -4.91 3.06 -3.87 2.96 3.72 -0.84 -1.76 117.46 115.82 3hay n PHE 49 Ca -0.03 -3.26 -0.11 0.00 -0.05 0.00 0.00 57.45 54.00 3hay n PHE 49 Cb 0.05 -0.91 -0.10 0.00 -0.94 0.00 0.00 39.48 37.57 3hay n PHE 49 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3hay s GLY 50 N -2.20 0.03 -0.06 1.37 0.00 -1.05 -3.53 107.32 101.88 3hay s GLY 50 Ca 0.38 -0.07 0.03 0.00 0.00 0.00 0.00 44.72 45.07 3hay s GLY 50 CO -0.02 -0.19 -0.16 0.14 0.00 0.00 0.00 173.10 172.87 3hay s VAL 51 N -1.12 1.42 -0.23 1.40 1.01 0.12 -2.42 120.40 120.58 3hay s VAL 51 Ca -0.12 -0.67 -0.17 0.00 0.00 0.00 0.00 61.98 61.02 3hay s VAL 51 Cb -0.07 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 3hay s VAL 51 CO 0.01 0.41 0.46 -0.63 0.00 0.00 0.00 175.10 175.36 3hay s ILE 52 N 0.35 5.13 -0.85 2.22 1.01 0.11 0.38 121.20 129.55 3hay s ILE 52 Ca -0.11 0.81 -0.24 0.00 0.00 0.00 0.00 60.65 61.11 3hay s ILE 52 Cb -0.14 -3.79 0.05 0.00 0.01 0.00 0.00 42.46 38.59 3hay s ILE 52 CO 0.04 0.17 1.29 0.21 0.00 0.00 0.00 174.94 176.65 3hay s ASN 53 N 1.30 6.33 -0.13 3.58 3.04 -1.26 -0.29 114.94 127.51 3hay s ASN 53 Ca 0.21 -1.03 -0.07 0.00 0.04 0.00 0.00 52.86 52.00 3hay s ASN 53 Cb -0.15 -2.53 -0.04 0.00 -1.54 0.00 0.00 41.25 36.98 3hay s ASN 53 CO 0.09 -1.60 0.14 -0.22 -3.04 0.00 0.00 177.10 172.47 3hay s LEU 54 N 4.98 4.37 -0.55 3.21 2.96 -0.14 -1.02 118.68 132.49 3hay s LEU 54 Ca 0.37 0.44 -0.19 0.00 -0.22 0.00 0.00 54.13 54.53 3hay s LEU 54 Cb -0.06 -2.07 0.08 0.00 0.50 0.00 0.00 46.19 44.63 3hay s LEU 54 CO 0.03 0.38 0.67 -0.62 -1.32 0.00 0.00 176.35 175.49 3hay s ASP 55 N -0.84 6.21 -0.22 3.68 2.15 0.30 -0.41 116.67 127.54 3hay s ASP 55 Ca 0.14 -1.10 -0.28 0.00 0.43 0.00 0.00 52.55 51.74 3hay s ASP 55 Cb -0.12 -2.30 0.01 0.00 -0.30 0.00 0.00 42.92 40.21 3hay s ASP 55 CO 0.03 -1.00 1.01 -0.75 -0.17 0.00 0.00 175.17 174.29 3hay s LYS 56 N 2.73 4.26 0.51 4.34 2.20 0.15 -4.15 119.74 129.78 3hay s LYS 56 Ca 0.14 1.30 -0.18 0.00 -0.36 0.00 0.00 55.97 56.87 3hay s LYS 56 Cb -0.21 -3.63 -0.08 0.00 -1.51 0.00 0.00 37.83 32.40 3hay s LYS 56 CO 0.10 -0.59 1.01 -1.25 -0.36 0.00 0.00 175.35 174.25 3hay s PRO 57 N 3.07 3.82 0.68 4.03 0.04 -1.26 -1.72 135.00 143.66 3hay s PRO 57 Ca 0.43 1.16 -0.12 0.00 0.04 0.00 0.00 61.00 62.51 3hay s PRO 57 Cb -0.15 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.28 3hay s PRO 57 CO 0.07 -0.39 1.06 -2.14 0.04 0.00 0.00 177.00 175.64 3hay s PRO 58 N -3.64 2.94 0.00 0.56 0.02 -1.26 -4.61 135.00 129.02 3hay s PRO 58 Ca 0.63 1.06 0.00 0.00 0.02 0.00 0.00 61.00 62.71 3hay s PRO 58 Cb -0.13 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.40 3hay s PRO 58 CO 0.25 -1.10 0.00 0.41 -0.33 0.00 0.00 177.00 176.23 3hay n GLY 59 N -1.60 1.85 3.90 0.52 0.00 0.25 -4.99 105.19 105.11 3hay n GLY 59 Ca 0.08 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 3hay n GLY 59 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hay s PRO 60 N 0.00 3.08 0.57 1.61 0.04 -1.26 -4.61 135.00 134.43 3hay s PRO 60 Ca 0.00 0.27 -0.17 0.00 0.04 0.00 0.00 61.00 61.14 3hay s PRO 60 Cb 0.00 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3hay s PRO 60 CO 0.00 -0.71 1.06 0.95 0.04 0.00 0.00 177.00 178.33 3hay s THR 61 N -3.09 3.77 0.51 1.26 -4.23 -1.26 -3.89 115.64 108.70 3hay s THR 61 Ca 0.54 0.90 0.21 0.00 -1.18 0.00 0.00 61.69 62.16 3hay s THR 61 Cb -0.11 -3.39 0.36 0.00 1.34 0.00 0.00 72.50 70.70 3hay s THR 61 CO 0.48 -0.43 2.02 0.28 -0.54 0.00 0.00 174.62 176.44 3hay h SER 62 N 0.70 0.08 -0.44 3.99 0.02 -1.90 -1.70 113.55 114.30 3hay h SER 62 Ca -0.48 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.38 3hay h SER 62 Cb 1.22 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 3hay h SER 62 CO 0.58 0.05 -0.08 0.45 -1.14 0.00 0.00 176.83 176.69 3hay h HIS 63 N 0.09 0.98 -0.09 3.45 3.86 -1.92 -2.59 115.15 118.93 3hay h HIS 63 Ca 0.21 -0.18 -0.11 0.00 -1.16 0.00 0.00 60.37 59.13 3hay h HIS 63 Cb 0.70 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 3hay h HIS 63 CO -0.00 0.92 -0.44 0.93 0.86 0.00 0.00 177.93 180.20 3hay h GLU 64 N 0.81 0.20 -0.26 2.45 5.08 -1.70 -3.07 114.58 118.09 3hay h GLU 64 Ca 0.14 -0.10 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 3hay h GLU 64 Cb 0.59 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 3hay h GLU 64 CO 0.04 0.61 0.11 0.28 -1.00 0.00 0.00 179.01 179.04 3hay h VAL 65 N 0.17 0.96 -0.31 3.13 2.07 -1.20 -2.79 116.25 118.29 3hay h VAL 65 Ca 0.01 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.51 3hay h VAL 65 Cb 0.84 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.23 3hay h VAL 65 CO 0.07 0.04 -0.41 0.58 0.02 0.00 0.00 177.57 177.87 3hay h VAL 66 N 0.24 0.14 -0.39 2.57 2.07 -1.41 -2.73 116.25 116.75 3hay h VAL 66 Ca 0.11 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.66 3hay h VAL 66 Cb 0.06 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.95 3hay h VAL 66 CO -0.10 0.00 0.26 0.00 0.02 0.00 0.00 177.57 177.76 3hay h ALA 67 N 0.37 1.83 -0.15 1.67 0.00 -1.49 0.10 119.26 121.58 3hay h ALA 67 Ca 0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3hay h ALA 67 Cb 0.59 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 3hay h ALA 67 CO -0.51 0.13 -0.16 -1.49 0.00 0.00 0.00 179.25 177.23 3hay h TRP 68 N 0.44 0.45 -0.75 0.00 6.55 -1.28 -2.07 115.95 119.29 3hay h TRP 68 Ca 0.16 -0.14 0.01 0.00 0.95 0.00 0.00 58.89 59.87 3hay h TRP 68 Cb 0.09 -0.09 -0.04 0.00 -0.86 0.00 0.00 29.16 28.26 3hay h TRP 68 CO -0.00 0.76 0.50 0.82 -1.05 0.00 0.00 178.44 179.47 3hay h ILE 69 N 0.00 1.19 -0.64 1.49 2.04 -1.18 0.13 117.51 120.54 3hay h ILE 69 Ca 0.02 -0.35 0.12 0.00 1.00 0.00 0.00 64.86 65.66 3hay h ILE 69 Cb 0.69 0.08 -0.09 0.00 -0.74 0.00 0.00 36.82 36.76 3hay h ILE 69 CO 0.04 0.19 0.15 0.11 0.00 0.00 0.00 178.15 178.63 3hay h LYS 70 N 1.01 0.27 0.02 2.37 1.57 -0.86 -2.42 116.57 118.53 3hay h LYS 70 Ca 0.28 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.02 3hay h LYS 70 Cb -0.11 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.15 3hay h LYS 70 CO -0.06 0.18 -0.10 -0.22 -0.57 0.00 0.00 179.45 178.67 3hay h LYS 71 N 0.28 0.04 -0.75 3.15 3.64 -0.86 0.16 116.57 122.23 3hay h LYS 71 Ca 0.34 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 3hay h LYS 71 Cb 0.52 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 3hay h LYS 71 CO -0.42 1.03 0.38 0.82 -2.27 0.00 0.00 179.45 178.99 3hay h ILE 72 N -0.91 1.23 -0.01 2.00 2.04 -0.97 -2.34 117.51 118.55 3hay h ILE 72 Ca -0.02 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.22 3hay h ILE 72 Cb 1.08 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3hay h ILE 72 CO 0.02 0.27 -0.25 0.18 0.00 0.00 0.00 178.15 178.37 3hay n LEU 73 N -4.42 1.68 -3.34 1.44 4.77 -0.92 -4.99 117.00 111.23 3hay n LEU 73 Ca 0.07 -0.55 -0.16 0.00 -0.03 0.00 0.00 56.01 55.33 3hay n LEU 73 Cb 0.11 -0.05 0.07 0.00 -2.33 0.00 0.00 43.42 41.23 3hay n LEU 73 CO 0.38 0.30 0.05 -3.20 -1.33 0.00 0.00 177.39 173.60 3hay n ASN 74 N -0.06 -4.95 -4.70 -1.43 4.05 -0.88 -5.04 115.26 102.26 3hay n ASN 74 Ca 0.13 -0.69 -0.30 0.00 0.45 0.00 0.00 54.58 54.17 3hay n ASN 74 Cb 0.42 -5.09 -0.08 0.00 1.23 0.00 0.00 39.78 36.26 3hay n ASN 74 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3hay s LEU 75 N -5.78 3.50 -0.00 1.20 1.43 0.52 -5.02 118.68 114.52 3hay s LEU 75 Ca 0.30 -0.18 0.21 0.00 -1.03 0.00 0.00 54.13 53.42 3hay s LEU 75 Cb -0.04 -2.21 -0.24 0.00 0.03 0.00 0.00 46.19 43.72 3hay s LEU 75 CO 0.74 0.16 0.83 -1.84 0.23 0.00 0.00 176.35 176.47 3hay n GLU 76 N 0.43 0.15 -3.73 1.70 0.28 -1.26 -4.60 120.64 113.61 3hay n GLU 76 Ca -0.10 -0.03 -0.12 0.00 -0.16 0.00 0.00 57.16 56.75 3hay n GLU 76 Cb 0.52 -1.49 -0.12 0.00 1.43 0.00 0.00 31.44 31.78 3hay n GLU 76 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3hay s LYS 77 N -3.06 0.30 0.06 3.44 2.20 -1.26 -5.09 119.74 116.33 3hay s LYS 77 Ca 0.06 0.56 -0.15 0.00 -0.36 0.00 0.00 55.97 56.08 3hay s LYS 77 Cb 0.16 -0.00 0.02 0.00 -1.51 0.00 0.00 37.83 36.50 3hay s LYS 77 CO 0.87 -0.12 0.34 0.00 -0.36 0.00 0.00 175.35 176.07 3hay s ALA 78 N 0.93 -0.76 0.31 3.13 0.00 -1.26 -1.91 121.76 122.21 3hay s ALA 78 Ca -0.06 0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.91 3hay s ALA 78 Cb -0.07 0.41 0.00 0.00 0.00 0.00 0.00 23.12 23.46 3hay s ALA 78 CO -0.07 -0.47 0.40 0.41 0.00 0.00 0.00 175.76 176.03 3hay n GLY 79 N 0.36 2.38 3.25 0.00 0.00 -0.61 -4.99 105.19 105.58 3hay n GLY 79 Ca -0.18 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.08 3hay n GLY 79 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3hay s HIS 80 N -3.14 -0.08 -1.19 1.61 -3.43 -1.26 -1.38 115.29 106.41 3hay s HIS 80 Ca 0.28 -0.09 -0.04 0.00 -0.80 0.00 0.00 55.06 54.41 3hay s HIS 80 Cb -0.00 0.09 0.21 0.00 -1.43 0.00 0.00 32.58 31.45 3hay s HIS 80 CO 0.20 -0.51 2.05 0.41 -2.00 0.00 0.00 174.74 174.89 3hay n GLY 81 N 0.50 5.50 0.00 -1.38 0.00 -1.03 -4.91 105.19 103.86 3hay n GLY 81 Ca -0.18 -2.30 0.00 0.00 0.00 0.00 0.00 46.02 43.54 3hay n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hay n GLY 82 N 1.17 2.03 3.56 -0.02 0.00 -1.26 -4.79 105.19 105.87 3hay n GLY 82 Ca 0.51 -1.99 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 3hay n GLY 82 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hay s THR 83 N -2.42 5.29 -0.08 2.61 2.01 -1.26 -5.01 115.64 116.79 3hay s THR 83 Ca 0.00 -0.02 -0.04 0.00 0.31 0.00 0.00 61.69 61.95 3hay s THR 83 Cb 0.00 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 3hay s THR 83 CO 0.00 0.13 0.09 -0.76 -0.69 0.00 0.00 174.62 173.38 3hay s LEU 84 N 1.74 4.03 0.58 4.42 1.43 -1.26 -5.04 118.68 124.58 3hay s LEU 84 Ca 0.07 0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 53.30 3hay s LEU 84 Cb -0.17 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 3hay s LEU 84 CO 0.11 0.36 1.04 -1.81 0.23 0.00 0.00 176.35 176.28 3hay s ASP 85 N -1.18 5.97 0.20 2.29 -0.00 -1.26 -3.35 116.67 119.34 3hay s ASP 85 Ca 0.17 1.74 -0.17 0.00 -0.00 0.00 0.00 52.55 54.30 3hay s ASP 85 Cb -0.12 -2.52 0.19 0.00 -0.00 0.00 0.00 42.92 40.46 3hay s ASP 85 CO 0.06 -1.04 1.61 -0.65 -0.00 0.00 0.00 175.17 175.16 3hay h PRO 86 N 0.49 -0.08 0.00 8.23 0.11 -1.82 -0.31 132.00 138.63 3hay h PRO 86 Ca -0.47 0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 3hay h PRO 86 Cb 1.21 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3hay h PRO 86 CO 0.58 -0.05 -0.34 0.87 -0.21 0.00 0.00 178.00 178.85 3hay h LYS 87 N -0.08 0.00 -7.25 1.05 1.57 -1.87 0.71 116.57 110.69 3hay h LYS 87 Ca 0.27 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.55 3hay h LYS 87 Cb 0.51 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.90 3hay h LYS 87 CO -0.65 0.34 0.37 0.08 -0.57 0.00 0.00 179.45 179.02 3hay s VAL 88 N -4.11 3.81 0.23 0.50 1.01 -0.13 -4.59 120.40 117.13 3hay s VAL 88 Ca -0.02 0.74 0.05 0.00 0.00 0.00 0.00 61.98 62.75 3hay s VAL 88 Cb 0.14 -3.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.16 3hay s VAL 88 CO 0.70 -0.62 0.20 -1.54 0.00 0.00 0.00 175.10 173.84 3hay n SER 89 N -2.55 -0.51 0.00 3.32 3.41 -1.08 -4.03 113.62 112.18 3hay n SER 89 Ca 0.08 -2.52 0.00 0.00 -0.26 0.00 0.00 58.87 56.17 3hay n SER 89 Cb 0.53 1.18 0.00 0.00 -0.26 0.00 0.00 64.21 65.66 3hay n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hay n GLY 90 N -0.44 0.20 3.74 5.00 0.00 -0.70 0.37 105.19 113.35 3hay n GLY 90 Ca 0.05 -1.91 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 3hay n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hay s VAL 91 N 0.00 3.52 -0.12 1.61 1.01 -1.20 0.33 120.40 125.54 3hay s VAL 91 Ca 0.00 1.25 -0.04 0.00 0.00 0.00 0.00 61.98 63.19 3hay s VAL 91 Cb 0.00 -3.80 0.06 0.00 0.00 0.00 0.00 36.38 32.64 3hay s VAL 91 CO 0.00 0.19 0.23 -0.22 0.00 0.00 0.00 175.10 175.30 3hay s LEU 92 N -0.08 -0.22 0.14 3.92 2.96 0.45 -4.87 118.68 120.98 3hay s LEU 92 Ca 0.54 0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 54.60 3hay s LEU 92 Cb -0.33 0.55 -0.07 0.00 0.50 0.00 0.00 46.19 46.84 3hay s LEU 92 CO 0.36 -0.25 1.14 -2.84 -1.32 0.00 0.00 176.35 173.44 3hay s PRO 93 N 2.38 4.53 -0.29 0.98 0.02 -1.26 -0.97 135.00 140.39 3hay s PRO 93 Ca 0.02 1.75 0.02 0.00 0.02 0.00 0.00 61.00 62.82 3hay s PRO 93 Cb -0.12 -3.30 0.08 0.00 0.02 0.00 0.00 34.50 31.18 3hay s PRO 93 CO -0.08 -0.05 -0.01 0.08 -0.33 0.00 0.00 177.00 176.61 3hay s VAL 94 N 0.19 1.88 0.32 3.83 1.01 0.61 -2.48 120.40 125.77 3hay s VAL 94 Ca 0.53 -1.75 -0.27 0.00 0.00 0.00 0.00 61.98 60.48 3hay s VAL 94 Cb -0.30 -2.23 -0.09 0.00 0.00 0.00 0.00 36.38 33.76 3hay s VAL 94 CO 0.33 -0.33 1.01 0.00 0.00 0.00 0.00 175.10 176.11 3hay s ALA 95 N 1.17 3.24 -0.00 5.51 0.00 -0.48 0.10 121.76 131.29 3hay s ALA 95 Ca 0.01 0.67 0.04 0.00 0.00 0.00 0.00 51.96 52.68 3hay s ALA 95 Cb -0.19 -3.24 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 3hay s ALA 95 CO -0.09 -0.00 -0.12 -0.51 0.00 0.00 0.00 175.76 175.04 3hay s LEU 96 N -1.96 2.04 0.00 0.00 1.43 -1.02 -1.57 118.68 117.61 3hay s LEU 96 Ca 0.50 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 3hay s LEU 96 Cb -0.23 -0.60 0.00 0.00 0.03 0.00 0.00 46.19 45.38 3hay s LEU 96 CO 0.30 0.13 0.00 -0.62 0.23 0.00 0.00 176.35 176.38 3hay n GLU 97 N 2.67 0.00 0.07 1.70 -0.58 -0.80 -0.42 120.64 123.27 3hay n GLU 97 Ca -0.14 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.46 3hay n GLU 97 Cb 0.56 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.37 3hay n GLU 97 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3hay h LYS 98 N 0.00 0.41 -0.99 3.49 1.79 -1.67 -3.19 116.57 116.40 3hay h LYS 98 Ca 0.00 -0.46 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 3hay h LYS 98 Cb 0.00 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 3hay h LYS 98 CO 0.00 1.13 0.00 0.00 -1.08 0.00 0.00 179.45 179.50 3hay n ALA 99 N -2.54 2.49 -0.12 3.86 0.00 0.44 -4.07 120.51 120.56 3hay n ALA 99 Ca -0.07 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.24 3hay n ALA 99 Cb 0.86 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.28 3hay n ALA 99 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hay h THR 100 N 0.00 1.28 0.00 0.00 2.02 -1.53 -3.22 112.91 111.46 3hay h THR 100 Ca 0.00 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.71 3hay h THR 100 Cb 0.52 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 3hay h THR 100 CO 0.00 0.49 0.00 0.54 0.37 0.00 0.00 175.52 176.92 3hay n ARG 101 N -4.17 0.12 0.00 6.66 1.74 -1.26 -3.31 116.66 116.45 3hay n ARG 101 Ca -0.02 0.26 0.01 0.00 -0.77 0.00 0.00 57.85 57.33 3hay n ARG 101 Cb 0.49 -1.70 0.06 0.00 -1.02 0.00 0.00 32.46 30.29 3hay n ARG 101 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 3hay n VAL 102 N -1.92 1.29 0.23 1.55 0.24 -1.22 -2.33 118.33 116.17 3hay n VAL 102 Ca 0.04 0.32 0.08 0.00 -2.04 0.00 0.00 64.34 62.74 3hay n VAL 102 Cb 0.27 -1.28 0.56 0.00 -1.47 0.00 0.00 33.84 31.92 3hay n VAL 102 CO 0.00 0.00 0.00 -0.37 -2.14 0.00 0.00 176.83 174.32 3hay h VAL 103 N 0.00 0.90 0.00 3.34 -1.51 -1.81 -2.99 116.25 114.19 3hay h VAL 103 Ca 0.00 -0.78 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 3hay h VAL 103 Cb 0.03 1.45 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 3hay h VAL 103 CO 0.00 0.20 0.00 0.06 -1.23 0.00 0.00 177.57 176.60 3hay h GLN 104 N 0.00 0.00 0.00 5.19 3.07 -1.78 0.89 115.11 122.48 3hay h GLN 104 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3hay h GLN 104 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.00 3hay h GLN 104 CO 0.03 0.00 -1.18 0.00 0.09 0.00 0.00 178.83 177.76 3hay n ALA 105 N -1.91 2.67 0.50 0.06 0.00 -1.13 -4.22 120.51 116.49 3hay n ALA 105 Ca -0.02 -0.30 0.09 0.00 0.00 0.00 0.00 53.44 53.21 3hay n ALA 105 Cb 0.07 -1.03 -0.12 0.00 0.00 0.00 0.00 19.45 18.37 3hay n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3hay n LEU 106 N -2.51 0.51 -0.01 0.00 4.32 0.12 -3.97 117.00 115.46 3hay n LEU 106 Ca -0.00 -0.29 -0.08 0.00 -0.02 0.00 0.00 56.01 55.61 3hay n LEU 106 Cb 0.54 0.00 0.08 0.00 -1.62 0.00 0.00 43.42 42.42 3hay n LEU 106 CO 0.41 0.13 0.55 -0.07 -1.22 0.00 0.00 177.39 177.18 3hay h LEU 107 N 0.00 0.62 -0.17 2.23 3.38 -1.23 -3.25 115.31 116.90 3hay h LEU 107 Ca 0.00 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3hay h LEU 107 Cb 0.62 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hay h LEU 107 CO 0.00 0.99 -0.66 -0.81 0.09 0.00 0.00 178.44 178.05 3hay n PRO 108 N -4.00 0.23 -1.38 1.13 -0.04 -1.26 -4.74 135.00 124.93 3hay n PRO 108 Ca -0.02 -0.17 -0.33 0.00 -0.04 0.00 0.00 63.50 62.94 3hay n PRO 108 Cb 0.55 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.60 3hay n PRO 108 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hay s ALA 109 N -2.88 2.16 0.51 0.55 0.00 -1.23 -4.15 121.76 116.72 3hay s ALA 109 Ca 0.12 0.59 -0.23 0.00 0.00 0.00 0.00 51.96 52.44 3hay s ALA 109 Cb 0.17 -3.37 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 3hay s ALA 109 CO 0.73 -1.79 1.35 0.20 0.00 0.00 0.00 175.76 176.24 3hay s GLY 110 N -2.62 2.88 0.31 0.00 0.00 -1.26 -3.82 107.32 102.81 3hay s GLY 110 Ca 0.68 1.31 0.08 0.00 0.00 0.00 0.00 44.72 46.79 3hay s GLY 110 CO 0.48 1.85 -0.07 0.54 0.00 0.00 0.00 173.10 175.90 3hay s LYS 111 N -2.74 1.67 -0.16 2.90 -0.14 0.47 -0.02 119.74 121.72 3hay s LYS 111 Ca 0.67 -1.86 -0.10 0.00 -1.36 0.00 0.00 55.97 53.32 3hay s LYS 111 Cb -0.40 -1.40 0.05 0.00 -1.68 0.00 0.00 37.83 34.41 3hay s LYS 111 CO 0.48 0.08 0.40 -2.00 -0.76 0.00 0.00 175.35 173.56 3hay s GLU 112 N -3.68 0.41 0.17 1.68 2.12 0.64 -0.67 118.70 119.37 3hay s GLU 112 Ca 0.31 0.72 0.07 0.00 0.36 0.00 0.00 54.97 56.43 3hay s GLU 112 Cb 0.03 0.04 -0.04 0.00 0.26 0.00 0.00 34.13 34.42 3hay s GLU 112 CO 0.14 -0.13 -0.15 0.71 -0.54 0.00 0.00 175.26 175.29 3hay s TYR 113 N 1.07 1.66 -0.23 5.30 1.51 0.90 -0.09 117.35 127.46 3hay s TYR 113 Ca -0.07 -0.55 -0.06 0.00 -1.01 0.00 0.00 57.07 55.38 3hay s TYR 113 Cb -0.07 -0.81 -0.03 0.00 -0.11 0.00 0.00 41.96 40.95 3hay s TYR 113 CO -0.09 0.29 0.04 0.08 -1.11 0.00 0.00 175.55 174.76 3hay s VAL 114 N -2.53 4.14 -0.04 0.71 1.01 0.14 -1.45 120.40 122.38 3hay s VAL 114 Ca 0.17 -0.24 0.06 0.00 0.00 0.00 0.00 61.98 61.98 3hay s VAL 114 Cb -0.03 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 3hay s VAL 114 CO 0.06 0.38 -0.23 0.00 0.00 0.00 0.00 175.10 175.31 3hay s ALA 115 N 1.35 1.95 -0.13 5.51 0.00 -0.72 -2.08 121.76 127.64 3hay s ALA 115 Ca 0.05 -0.97 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 3hay s ALA 115 Cb -0.15 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 3hay s ALA 115 CO 0.02 0.42 0.01 -1.17 0.00 0.00 0.00 175.76 175.04 3hay s LEU 116 N -0.31 3.57 -0.15 0.00 2.96 -1.12 -2.35 118.68 121.29 3hay s LEU 116 Ca 0.02 0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 3hay s LEU 116 Cb -0.11 -1.85 0.05 0.00 0.50 0.00 0.00 46.19 44.77 3hay s LEU 116 CO 0.01 0.26 0.01 -0.32 -1.32 0.00 0.00 176.35 175.00 3hay s MET 117 N -0.20 0.79 0.09 1.98 -2.45 -0.52 -3.95 119.30 115.04 3hay s MET 117 Ca 0.05 -0.28 -0.24 0.00 -1.25 0.00 0.00 55.69 53.97 3hay s MET 117 Cb -0.12 -1.75 -0.06 0.00 1.25 0.00 0.00 34.83 34.14 3hay s MET 117 CO 0.02 -0.50 0.75 -1.58 1.05 0.00 0.00 175.02 174.76 3hay s HIS 118 N 1.85 3.80 -0.06 4.11 2.46 -1.22 -1.32 115.29 124.91 3hay s HIS 118 Ca 0.01 1.50 0.03 0.00 0.47 0.00 0.00 55.06 57.08 3hay s HIS 118 Cb -0.15 -2.77 -0.02 0.00 -0.13 0.00 0.00 32.58 29.51 3hay s HIS 118 CO -0.07 0.39 -0.14 -0.51 -2.47 0.00 0.00 174.74 171.94 3hay s LEU 119 N -0.54 2.76 0.00 8.88 1.43 0.12 -3.59 118.68 127.73 3hay s LEU 119 Ca 0.36 -0.20 0.30 0.00 -1.03 0.00 0.00 54.13 53.56 3hay s LEU 119 Cb -0.21 -1.57 1.38 0.00 0.03 0.00 0.00 46.19 45.82 3hay s LEU 119 CO 0.24 0.32 1.97 1.41 0.23 0.00 0.00 176.35 180.52 3hay n HIS 120 N 2.45 0.00 -2.63 0.29 8.25 -1.24 -4.83 115.22 117.50 3hay n HIS 120 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 3hay n HIS 120 Cb 0.52 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.38 3hay n HIS 120 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hay n GLY 121 N 1.29 5.88 2.96 -1.41 0.00 -1.26 -5.08 105.19 107.56 3hay n GLY 121 Ca 0.14 -1.56 -0.29 0.00 0.00 0.00 0.00 46.02 44.31 3hay n GLY 121 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hay s ASP 122 N 1.00 2.57 -0.07 1.61 1.01 -1.26 -4.77 116.67 116.76 3hay s ASP 122 Ca 0.00 -0.47 0.00 0.00 0.71 0.00 0.00 52.55 52.79 3hay s ASP 122 Cb 0.00 -1.02 0.02 0.00 1.01 0.00 0.00 42.92 42.93 3hay s ASP 122 CO 0.00 -0.10 -0.05 -0.69 0.21 0.00 0.00 175.17 174.54 3hay s VAL 123 N 1.58 0.68 0.50 -1.27 1.01 -1.26 -5.12 120.40 116.52 3hay s VAL 123 Ca 0.04 -0.14 -0.20 0.00 0.00 0.00 0.00 61.98 61.68 3hay s VAL 123 Cb -0.13 -0.72 -0.10 0.00 0.00 0.00 0.00 36.38 35.43 3hay s VAL 123 CO -0.09 0.28 0.64 -0.81 0.00 0.00 0.00 175.10 175.12 3hay n PRO 124 N 4.50 0.70 -0.08 2.72 -0.04 -1.26 -4.90 135.00 136.63 3hay n PRO 124 Ca -0.17 0.26 -0.09 0.00 -0.04 0.00 0.00 63.50 63.46 3hay n PRO 124 Cb 0.51 -1.73 -0.01 0.00 -0.04 0.00 0.00 33.50 32.22 3hay n PRO 124 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3hay h GLU 125 N 0.65 0.34 0.00 0.54 5.08 -2.01 -3.16 114.58 116.02 3hay h GLU 125 Ca -0.44 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.86 3hay h GLU 125 Cb 1.39 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 3hay h GLU 125 CO 0.50 0.22 -0.20 0.38 -1.00 0.00 0.00 179.01 178.92 3hay h ASP 126 N 0.35 0.00 0.56 1.42 2.03 -2.03 -2.57 116.42 116.18 3hay h ASP 126 Ca 0.12 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.33 3hay h ASP 126 Cb 0.00 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 3hay h ASP 126 CO -0.06 0.20 -0.41 0.50 -1.03 0.00 0.00 179.24 178.44 3hay h LYS 127 N 0.00 0.00 -0.06 4.15 3.11 -1.92 -3.10 116.57 118.75 3hay h LYS 127 Ca -0.00 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 3hay h LYS 127 Cb 0.43 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.66 3hay h LYS 127 CO 0.03 0.41 0.00 0.82 -2.81 0.00 0.00 179.45 177.90 3hay h ILE 128 N 0.00 1.24 -0.86 2.00 2.04 -1.60 -2.02 117.51 118.31 3hay h ILE 128 Ca -0.00 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 3hay h ILE 128 Cb 0.80 1.61 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 3hay h ILE 128 CO 0.05 0.20 0.51 0.40 0.00 0.00 0.00 178.15 179.32 3hay h ILE 129 N -0.17 1.24 -0.97 -0.67 2.04 -1.67 0.56 117.51 117.88 3hay h ILE 129 Ca 0.02 -0.52 0.07 0.00 1.00 0.00 0.00 64.86 65.42 3hay h ILE 129 Cb 0.32 0.03 -0.06 0.00 -0.74 0.00 0.00 36.82 36.36 3hay h ILE 129 CO 0.00 0.25 0.62 -0.61 0.00 0.00 0.00 178.15 178.42 3hay h GLN 130 N 1.18 1.08 0.02 2.37 4.15 -1.44 0.64 115.11 123.11 3hay h GLN 130 Ca 0.31 -0.06 -0.21 0.00 0.77 0.00 0.00 58.65 59.45 3hay h GLN 130 Cb -0.05 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.38 3hay h GLN 130 CO -0.06 0.71 -0.98 0.28 -1.93 0.00 0.00 178.83 176.86 3hay h VAL 131 N 1.11 1.62 0.00 2.39 2.07 -0.63 -3.11 116.25 119.69 3hay h VAL 131 Ca 0.42 -3.10 -0.12 0.00 0.82 0.00 0.00 66.70 64.72 3hay h VAL 131 Cb 0.20 2.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.68 3hay h VAL 131 CO -0.17 0.89 -0.55 -0.03 0.02 0.00 0.00 177.57 177.74 3hay h MET 132 N 0.03 0.00 -0.47 1.57 4.05 0.16 -2.38 114.93 117.88 3hay h MET 132 Ca -0.04 0.00 -0.13 0.00 -0.28 0.00 0.00 59.70 59.25 3hay h MET 132 Cb 1.69 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.48 3hay h MET 132 CO 0.14 0.55 -0.22 -0.22 0.23 0.00 0.00 176.91 177.39 3hay h LYS 133 N 0.00 0.97 0.00 0.39 3.64 0.15 -3.30 116.57 118.42 3hay h LYS 133 Ca -0.01 -0.41 -0.03 0.00 -1.27 0.00 0.00 60.65 58.93 3hay h LYS 133 Cb 0.98 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 3hay h LYS 133 CO 0.07 1.09 -0.16 1.49 -2.27 0.00 0.00 179.45 179.66 3hay h GLU 134 N 0.84 0.00 -1.88 1.90 4.81 -1.36 -3.10 114.58 115.80 3hay h GLU 134 Ca 0.11 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 59.01 3hay h GLU 134 Cb 0.79 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.05 3hay h GLU 134 CO 0.07 0.16 0.17 1.19 -0.73 0.00 0.00 179.01 179.87 3hay n PHE 135 N -3.57 1.04 -3.95 0.92 3.72 -1.15 -4.78 117.46 109.68 3hay n PHE 135 Ca -0.01 -1.74 -0.31 0.00 -0.05 0.00 0.00 57.45 55.34 3hay n PHE 135 Cb 0.30 -1.23 -0.15 0.00 -0.94 0.00 0.00 39.48 37.46 3hay n PHE 135 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3hay s GLU 136 N -0.93 1.47 0.00 -1.08 2.02 -1.17 -4.81 118.70 114.20 3hay s GLU 136 Ca 0.47 -1.44 0.00 0.00 0.02 0.00 0.00 54.97 54.03 3hay s GLU 136 Cb 0.29 -2.78 0.00 0.00 0.10 0.00 0.00 34.13 31.74 3hay s GLU 136 CO -0.09 -0.81 0.00 0.41 0.02 0.00 0.00 175.26 174.78 3hay n GLY 137 N 4.49 0.16 3.82 -1.39 0.00 -1.13 -5.05 105.19 106.11 3hay n GLY 137 Ca -0.04 -1.27 -0.34 0.00 0.00 0.00 0.00 46.02 44.38 3hay n GLY 137 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hay s GLU 138 N -2.00 4.19 0.09 1.61 0.41 -1.26 -1.55 118.70 120.19 3hay s GLU 138 Ca 0.00 0.92 0.01 0.00 -0.41 0.00 0.00 54.97 55.49 3hay s GLU 138 Cb 0.00 -2.51 -0.04 0.00 -1.78 0.00 0.00 34.13 29.80 3hay s GLU 138 CO 0.00 0.18 -0.05 0.96 -0.49 0.00 0.00 175.26 175.86 3hay s ILE 139 N -1.89 0.52 -0.18 -1.63 -5.25 -0.81 -4.97 121.20 106.99 3hay s ILE 139 Ca 0.53 -1.90 -0.02 0.00 -0.99 0.00 0.00 60.65 58.27 3hay s ILE 139 Cb -0.12 -1.67 -0.01 0.00 2.95 0.00 0.00 42.46 43.60 3hay s ILE 139 CO 0.18 -0.87 -0.08 -0.63 -1.79 0.00 0.00 174.94 171.75 3hay s ILE 140 N -3.74 3.27 0.04 8.37 1.01 -1.26 -2.80 121.20 126.09 3hay s ILE 140 Ca 0.12 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3hay s ILE 140 Cb 0.06 -2.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 3hay s ILE 140 CO -0.06 0.47 -0.04 -1.10 0.00 0.00 0.00 174.94 174.21 3hay s GLN 141 N 0.95 0.48 -0.20 2.79 -0.21 -1.25 -5.06 119.66 117.15 3hay s GLN 141 Ca -0.01 -0.85 0.01 0.00 0.02 0.00 0.00 55.36 54.53 3hay s GLN 141 Cb -0.15 0.01 0.03 0.00 1.00 0.00 0.00 33.01 33.91 3hay s GLN 141 CO 0.00 -0.04 -0.16 0.50 -2.12 0.00 0.00 175.29 173.48 3hay s ARG 142 N -2.27 2.59 0.14 2.91 3.52 -1.26 -3.55 118.95 121.03 3hay s ARG 142 Ca -0.07 -0.94 -0.34 0.00 -0.13 0.00 0.00 55.73 54.25 3hay s ARG 142 Cb -0.05 -2.59 -0.16 0.00 -1.56 0.00 0.00 34.95 30.60 3hay s ARG 142 CO -0.03 -0.34 1.27 -2.30 -0.81 0.00 0.00 175.30 173.09 3hay n PRO 143 N 4.59 1.25 -0.71 5.12 -0.02 -1.26 -4.95 135.00 139.03 3hay n PRO 143 Ca -0.18 0.45 -0.30 0.00 -2.02 0.00 0.00 63.50 61.45 3hay n PRO 143 Cb 0.47 -2.03 0.25 0.00 -0.02 0.00 0.00 33.50 32.18 3hay n PRO 143 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3hay s PRO 144 N 0.04 -1.60 0.45 0.52 0.04 -1.26 -4.87 135.00 128.32 3hay s PRO 144 Ca 0.78 0.29 0.18 0.00 0.04 0.00 0.00 61.00 62.29 3hay s PRO 144 Cb -0.88 -1.52 1.13 0.00 0.04 0.00 0.00 34.50 33.28 3hay s PRO 144 CO 0.49 -4.04 1.92 -0.07 0.04 0.00 0.00 177.00 175.35 3hay h LEU 145 N -2.82 0.31 -7.68 -3.56 3.38 -2.01 -3.25 115.31 99.67 3hay h LEU 145 Ca -0.50 0.02 -0.76 0.00 0.09 0.00 0.00 57.88 56.73 3hay h LEU 145 Cb 1.33 -0.04 -0.22 0.00 0.09 0.00 0.00 40.66 41.81 3hay h LEU 145 CO 0.39 0.15 0.90 -0.60 0.09 0.00 0.00 178.44 179.38 3hay s ARG 146 N -5.32 4.08 0.07 1.13 6.06 -1.26 -4.97 118.95 118.74 3hay s ARG 146 Ca -0.07 -2.78 -0.08 0.00 -2.50 0.00 0.00 55.73 50.29 3hay s ARG 146 Cb 0.21 -4.82 -0.00 0.00 0.06 0.00 0.00 34.95 30.40 3hay s ARG 146 CO 0.76 -1.53 0.18 -1.54 -2.50 0.00 0.00 175.30 170.67 3hay s SER 147 N 2.24 0.12 0.00 -2.12 1.04 -1.23 -5.06 113.70 108.70 3hay s SER 147 Ca 0.36 -0.60 0.21 0.00 0.48 0.00 0.00 55.95 56.41 3hay s SER 147 Cb -0.06 0.32 -0.17 0.00 0.10 0.00 0.00 66.02 66.20 3hay s SER 147 CO -0.04 -0.67 0.94 0.00 0.98 0.00 0.00 173.24 174.45 3hay n ALA 148 N 0.15 4.56 -2.42 5.32 0.00 -1.26 -4.97 120.51 121.89 3hay n ALA 148 Ca -0.16 -0.60 -0.22 0.00 0.00 0.00 0.00 53.44 52.46 3hay n ALA 148 Cb 0.61 -0.79 -0.05 0.00 0.00 0.00 0.00 19.45 19.23 3hay n ALA 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3hay s VAL 149 N -2.93 2.98 0.47 0.00 -7.23 -1.26 -5.10 120.40 107.33 3hay s VAL 149 Ca 0.10 -1.50 -0.24 0.00 -1.81 0.00 0.00 61.98 58.53 3hay s VAL 149 Cb 0.16 -3.05 -0.07 0.00 0.56 0.00 0.00 36.38 33.98 3hay s VAL 149 CO 0.82 -0.11 1.33 -0.75 -0.31 0.00 0.00 175.10 176.08 3hay s LYS 150 N -3.98 3.60 -1.19 4.82 2.20 -1.26 -4.92 119.74 119.01 3hay s LYS 150 Ca 0.42 2.18 -0.17 0.00 -0.36 0.00 0.00 55.97 58.04 3hay s LYS 150 Cb -0.03 -2.51 0.12 0.00 -1.51 0.00 0.00 37.83 33.89 3hay s LYS 150 CO 0.25 -0.80 1.51 1.03 -0.36 0.00 0.00 175.35 176.98 3hay s ARG 151 N -2.58 3.95 0.08 4.03 0.52 -1.26 -4.84 118.95 118.84 3hay s ARG 151 Ca 0.64 -2.13 0.03 0.00 -0.52 0.00 0.00 55.73 53.75 3hay s ARG 151 Cb -0.38 -5.25 -0.03 0.00 0.52 0.00 0.00 34.95 29.80 3hay s ARG 151 CO 0.48 -1.99 -0.09 -0.98 0.02 0.00 0.00 175.30 172.73 3hay s ARG 152 N 3.01 0.74 -1.03 3.54 1.70 -1.26 -5.01 118.95 120.64 3hay s ARG 152 Ca 0.46 -1.03 -0.22 0.00 -0.47 0.00 0.00 55.73 54.47 3hay s ARG 152 Cb -0.00 -0.46 0.07 0.00 -0.57 0.00 0.00 34.95 33.99 3hay s ARG 152 CO 0.01 0.07 1.41 -0.51 -1.08 0.00 0.00 175.30 175.20 3hay s LEU 153 N -2.17 3.86 0.00 -1.89 1.43 -1.26 -4.56 118.68 114.10 3hay s LEU 153 Ca 0.01 -1.68 -0.04 0.00 -1.03 0.00 0.00 54.13 51.39 3hay s LEU 153 Cb -0.05 -2.53 0.10 0.00 0.03 0.00 0.00 46.19 43.73 3hay s LEU 153 CO -0.00 -1.38 0.63 -2.11 0.23 0.00 0.00 176.35 173.72 3hay n ARG 154 N 8.32 -0.15 -3.75 1.70 0.00 -1.23 -4.97 116.66 116.57 3hay n ARG 154 Ca 0.33 -1.37 -0.29 0.00 -0.00 0.00 0.00 57.85 56.52 3hay n ARG 154 Cb 0.50 -0.52 -0.16 0.00 -0.00 0.00 0.00 32.46 32.28 3hay n ARG 154 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 3hay s THR 155 N -2.01 0.76 0.18 8.89 -4.23 -1.26 -3.85 115.64 114.12 3hay s THR 155 Ca 0.39 -0.96 0.05 0.00 -1.18 0.00 0.00 61.69 59.98 3hay s THR 155 Cb -0.02 -1.36 -0.04 0.00 1.34 0.00 0.00 72.50 72.42 3hay s THR 155 CO 0.26 -0.38 0.20 -0.13 -0.54 0.00 0.00 174.62 174.03 3hay s ARG 156 N 1.72 3.10 -0.11 3.99 1.81 -1.12 -4.94 118.95 123.40 3hay s ARG 156 Ca 0.03 -0.81 -0.04 0.00 -1.72 0.00 0.00 55.73 53.18 3hay s ARG 156 Cb -0.17 -2.74 -0.04 0.00 -0.45 0.00 0.00 34.95 31.55 3hay s ARG 156 CO -0.15 0.48 0.06 0.21 -0.68 0.00 0.00 175.30 175.22 3hay s LYS 157 N -3.31 3.24 -0.15 3.54 2.36 -1.26 -1.93 119.74 122.23 3hay s LYS 157 Ca 0.32 -0.30 0.02 0.00 -2.55 0.00 0.00 55.97 53.47 3hay s LYS 157 Cb -0.10 -2.98 0.01 0.00 -1.05 0.00 0.00 37.83 33.71 3hay s LYS 157 CO 0.25 0.70 -0.21 0.08 1.55 0.00 0.00 175.35 177.72 3hay s VAL 158 N -0.84 2.06 -0.13 4.02 1.01 -0.59 -1.75 120.40 124.17 3hay s VAL 158 Ca 0.13 -0.97 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 3hay s VAL 158 Cb -0.12 -1.83 -0.09 0.00 0.00 0.00 0.00 36.38 34.34 3hay s VAL 158 CO 0.03 0.55 0.16 1.88 0.00 0.00 0.00 175.10 177.72 3hay h TYR 159 N 7.49 0.00 -2.19 5.22 -1.99 -1.80 -2.98 116.97 120.72 3hay h TYR 159 Ca -0.36 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.30 3hay h TYR 159 Cb 1.18 0.00 -0.20 0.00 2.00 0.00 0.00 36.73 39.70 3hay h TYR 159 CO 0.47 0.43 0.08 1.52 -0.00 0.00 0.00 178.16 180.66 3hay s TYR 160 N -1.97 -0.63 -0.37 4.88 1.13 -1.22 -4.79 117.35 114.38 3hay s TYR 160 Ca -0.12 1.31 0.01 0.00 -1.41 0.00 0.00 57.07 56.87 3hay s TYR 160 Cb 0.01 0.30 0.11 0.00 -1.10 0.00 0.00 41.96 41.28 3hay s TYR 160 CO 0.29 -0.47 0.14 0.42 -2.51 0.00 0.00 175.55 173.42 3hay s ILE 161 N -0.52 1.46 -0.08 -3.49 1.01 -1.26 -2.55 121.20 115.77 3hay s ILE 161 Ca -0.06 -2.06 -0.22 0.00 0.00 0.00 0.00 60.65 58.31 3hay s ILE 161 Cb -0.03 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 3hay s ILE 161 CO 0.05 -0.73 0.62 -0.70 0.00 0.00 0.00 174.94 174.19 3hay s GLU 162 N 0.98 4.40 -0.23 2.79 2.12 -0.80 -4.80 118.70 123.16 3hay s GLU 162 Ca 0.13 0.73 -0.28 0.00 0.36 0.00 0.00 54.97 55.90 3hay s GLU 162 Cb -0.20 -3.44 0.01 0.00 0.26 0.00 0.00 34.13 30.76 3hay s GLU 162 CO -0.13 0.11 1.01 0.08 -0.54 0.00 0.00 175.26 175.80 3hay s VAL 163 N 0.70 4.70 0.00 3.70 1.01 -1.26 -1.58 120.40 127.67 3hay s VAL 163 Ca 0.33 1.98 0.00 0.00 0.00 0.00 0.00 61.98 64.29 3hay s VAL 163 Cb -0.17 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 31.92 3hay s VAL 163 CO 0.15 -0.16 0.00 0.18 0.00 0.00 0.00 175.10 175.27 3hay n LEU 164 N 6.24 0.00 -4.17 3.92 4.77 -0.88 -4.92 117.00 121.96 3hay n LEU 164 Ca 0.11 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.99 3hay n LEU 164 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 3hay n LEU 164 CO 0.51 0.00 -0.38 -1.83 -1.33 0.00 0.00 177.39 174.36 3hay s GLU 165 N 0.00 0.84 0.05 3.23 -1.05 -0.64 -4.99 118.70 116.14 3hay s GLU 165 Ca 0.00 -1.34 0.06 0.00 -0.15 0.00 0.00 54.97 53.54 3hay s GLU 165 Cb 0.00 -0.19 -0.03 0.00 -0.44 0.00 0.00 34.13 33.47 3hay s GLU 165 CO 0.00 -0.03 -0.16 0.42 0.95 0.00 0.00 175.26 176.44 3hay s ILE 166 N -3.64 1.29 -0.38 1.83 1.01 -1.26 0.16 121.20 120.21 3hay s ILE 166 Ca 0.12 -1.16 0.13 0.00 0.00 0.00 0.00 60.65 59.74 3hay s ILE 166 Cb 0.05 -1.17 0.40 0.00 0.01 0.00 0.00 42.46 41.75 3hay s ILE 166 CO -0.04 -0.01 0.88 -0.62 0.00 0.00 0.00 174.94 175.15 3hay n GLU 167 N 1.67 1.58 0.00 2.79 1.02 -0.36 -5.02 120.64 122.32 3hay n GLU 167 Ca -0.19 -3.63 0.00 0.00 -0.02 0.00 0.00 57.16 53.32 3hay n GLU 167 Cb 0.54 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 3hay n GLU 167 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hay n GLY 168 N 0.00 2.25 0.00 0.62 0.00 -1.26 -3.89 105.19 102.92 3hay n GLY 168 Ca 0.21 -0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.14 3hay n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hay n ARG 169 N 0.00 1.07 -4.83 1.61 1.74 -1.26 -4.74 116.66 110.24 3hay n ARG 169 Ca 0.00 -0.06 -0.33 0.00 -0.77 0.00 0.00 57.85 56.69 3hay n ARG 169 Cb 0.00 -1.34 -0.13 0.00 -1.02 0.00 0.00 32.46 29.96 3hay n ARG 169 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hay s ASP 170 N -3.12 4.06 -0.15 0.55 1.11 -1.25 0.12 116.67 117.99 3hay s ASP 170 Ca 0.02 -0.24 0.02 0.00 0.18 0.00 0.00 52.55 52.53 3hay s ASP 170 Cb 0.12 -1.15 0.01 0.00 1.07 0.00 0.00 42.92 42.98 3hay s ASP 170 CO 0.71 0.28 -0.21 -0.69 1.18 0.00 0.00 175.17 176.44 3hay s VAL 171 N -0.33 2.00 -0.19 -1.27 1.01 -0.44 -1.22 120.40 119.96 3hay s VAL 171 Ca 0.03 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 3hay s VAL 171 Cb -0.13 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 3hay s VAL 171 CO 0.02 0.53 0.12 -0.22 0.00 0.00 0.00 175.10 175.56 3hay s LEU 172 N 1.00 4.18 -0.16 3.92 2.96 0.12 -1.44 118.68 129.28 3hay s LEU 172 Ca -0.03 0.24 -0.23 0.00 -0.22 0.00 0.00 54.13 53.90 3hay s LEU 172 Cb -0.15 -2.07 0.06 0.00 0.50 0.00 0.00 46.19 44.53 3hay s LEU 172 CO -0.06 0.21 0.59 0.72 -1.32 0.00 0.00 176.35 176.48 3hay s PHE 173 N 0.20 -0.60 -0.01 5.38 -0.12 -0.99 -1.63 117.98 120.21 3hay s PHE 173 Ca 0.08 1.34 -0.17 0.00 -0.05 0.00 0.00 56.93 58.13 3hay s PHE 173 Cb -0.11 0.25 -0.06 0.00 -0.63 0.00 0.00 43.02 42.48 3hay s PHE 173 CO -0.01 -0.40 0.49 0.50 -0.05 0.00 0.00 175.22 175.75 3hay s ARG 174 N -0.23 4.13 -0.14 1.99 3.52 -0.61 -1.75 118.95 125.85 3hay s ARG 174 Ca -0.04 0.54 -0.08 0.00 -0.13 0.00 0.00 55.73 56.02 3hay s ARG 174 Cb -0.03 -3.29 0.05 0.00 -1.56 0.00 0.00 34.95 30.12 3hay s ARG 174 CO 0.03 0.53 0.34 0.54 -0.81 0.00 0.00 175.30 175.93 3hay s VAL 175 N -0.62 -0.03 -0.06 7.11 0.11 -0.53 -1.90 120.40 124.48 3hay s VAL 175 Ca 0.26 0.10 0.05 0.00 -2.93 0.00 0.00 61.98 59.46 3hay s VAL 175 Cb -0.17 -0.51 -0.01 0.00 -1.53 0.00 0.00 36.38 34.16 3hay s VAL 175 CO 0.15 0.04 -0.22 -0.83 -3.33 0.00 0.00 175.10 170.90 3hay s GLY 176 N 1.15 1.19 0.30 6.54 0.00 -1.06 -0.07 107.32 115.37 3hay s GLY 176 Ca -0.08 -0.91 0.03 0.00 0.00 0.00 0.00 44.72 43.76 3hay s GLY 176 CO -0.09 -0.46 0.17 -1.34 0.00 0.00 0.00 173.10 171.37 3hay s VAL 177 N 0.05 0.28 0.76 1.40 -7.23 0.15 -2.66 120.40 113.15 3hay s VAL 177 Ca -0.08 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 57.98 3hay s VAL 177 Cb -0.14 -2.51 0.05 0.00 0.56 0.00 0.00 36.38 34.33 3hay s VAL 177 CO 0.05 0.00 1.08 -0.70 -0.31 0.00 0.00 175.10 175.21 3hay s GLU 178 N -3.82 2.42 0.22 4.82 2.12 -0.72 -0.39 118.70 123.35 3hay s GLU 178 Ca 0.36 0.96 -0.30 0.00 0.36 0.00 0.00 54.97 56.35 3hay s GLU 178 Cb 0.05 -1.93 -0.09 0.00 0.26 0.00 0.00 34.13 32.42 3hay s GLU 178 CO 0.18 -1.47 1.36 0.00 -0.54 0.00 0.00 175.26 174.79 3hay s ALA 179 N -3.01 3.56 0.00 6.30 0.00 -1.25 -3.08 121.76 124.29 3hay s ALA 179 Ca 0.60 1.19 0.00 0.00 0.00 0.00 0.00 51.96 53.75 3hay s ALA 179 Cb -0.15 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.46 3hay s ALA 179 CO 0.55 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.11 3hay n GLY 180 N 2.29 0.59 3.72 0.00 0.00 -1.26 -5.01 105.19 105.53 3hay n GLY 180 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3hay n GLY 180 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hay s THR 181 N -2.31 4.12 -0.31 2.61 2.01 -1.18 -5.00 115.64 115.59 3hay s THR 181 Ca 0.00 1.64 -0.19 0.00 0.31 0.00 0.00 61.69 63.45 3hay s THR 181 Cb 0.00 -4.05 -0.01 0.00 0.01 0.00 0.00 72.50 68.45 3hay s THR 181 CO 0.00 0.19 0.58 -0.31 -0.69 0.00 0.00 174.62 174.39 3hay s TYR 182 N 0.51 3.21 0.05 4.92 2.02 -1.26 -4.96 117.35 121.83 3hay s TYR 182 Ca 0.54 0.47 -0.22 0.00 -0.37 0.00 0.00 57.07 57.48 3hay s TYR 182 Cb -0.28 -2.94 -0.14 0.00 -0.40 0.00 0.00 41.96 38.20 3hay s TYR 182 CO 0.31 -0.47 1.51 0.82 -1.57 0.00 0.00 175.55 176.15 3hay h ILE 183 N 5.55 1.22 -0.86 2.71 1.08 -1.99 -2.24 117.51 122.98 3hay h ILE 183 Ca -0.27 -0.67 0.00 0.00 -0.39 0.00 0.00 64.86 63.53 3hay h ILE 183 Cb 1.12 1.49 -0.04 0.00 -3.07 0.00 0.00 36.82 36.32 3hay h ILE 183 CO 0.78 0.19 0.55 -0.09 -0.69 0.00 0.00 178.15 178.89 3hay h ARG 184 N -0.09 1.14 -0.51 2.37 2.43 -1.98 0.35 114.38 118.09 3hay h ARG 184 Ca 0.03 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3hay h ARG 184 Cb 0.29 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 3hay h ARG 184 CO 0.00 0.77 0.29 1.03 -1.51 0.00 0.00 179.97 180.55 3hay h SER 185 N 1.16 0.63 0.43 -3.80 0.87 -1.96 -1.36 113.55 109.52 3hay h SER 185 Ca 0.31 -0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.77 3hay h SER 185 Cb -0.11 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.69 3hay h SER 185 CO -0.06 0.53 -0.21 0.25 -0.53 0.00 0.00 176.83 176.81 3hay h LEU 186 N 0.68 -0.49 -0.78 2.23 5.85 -0.75 -2.17 115.31 119.89 3hay h LEU 186 Ca 0.18 -0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.95 3hay h LEU 186 Cb 0.03 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.09 3hay h LEU 186 CO -0.03 -0.17 0.34 0.40 -0.34 0.00 0.00 178.44 178.63 3hay h ILE 187 N -0.82 0.67 -0.87 4.05 2.04 -0.32 0.18 117.51 122.45 3hay h ILE 187 Ca -0.06 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 3hay h ILE 187 Cb 0.55 0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 3hay h ILE 187 CO 0.10 0.09 0.51 -0.74 0.00 0.00 0.00 178.15 178.11 3hay h HIS 188 N 0.49 1.15 0.00 1.37 2.76 -1.24 -2.16 115.15 117.52 3hay h HIS 188 Ca 0.43 -0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 58.44 3hay h HIS 188 Cb 0.64 -0.38 -0.02 0.00 1.55 0.00 0.00 27.41 29.20 3hay h HIS 188 CO -0.15 0.77 -0.72 0.45 -1.30 0.00 0.00 177.93 176.98 3hay h HIS 189 N 1.19 0.00 -0.16 5.26 3.86 -0.16 -2.48 115.15 122.67 3hay h HIS 189 Ca 0.31 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.38 3hay h HIS 189 Cb -0.03 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 3hay h HIS 189 CO 0.00 0.72 -0.50 0.82 0.86 0.00 0.00 177.93 179.83 3hay h ILE 190 N 0.00 1.33 -0.29 2.45 2.04 -0.65 -1.47 117.51 120.92 3hay h ILE 190 Ca -0.01 -1.74 -0.06 0.00 1.00 0.00 0.00 64.86 64.06 3hay h ILE 190 Cb 1.29 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 39.11 3hay h ILE 190 CO 0.09 0.53 -0.08 1.23 0.00 0.00 0.00 178.15 179.93 3hay h GLY 191 N 1.19 0.50 2.00 5.37 0.00 -1.16 -1.87 103.07 109.10 3hay h GLY 191 Ca 0.01 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 3hay h GLY 191 CO 0.09 0.30 -0.01 1.41 0.00 0.00 0.00 176.54 178.33 3hay h LEU 192 N 0.44 0.00 -0.26 3.11 3.38 -1.30 0.10 115.31 120.79 3hay h LEU 192 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3hay h LEU 192 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3hay h LEU 192 CO 0.02 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.56 3hay h ALA 193 N 1.99 1.00 0.00 1.53 0.00 -0.51 -3.22 119.26 120.05 3hay h ALA 193 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3hay h ALA 193 Cb 0.97 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 3hay h ALA 193 CO 0.00 0.00 -2.01 1.28 0.00 0.00 0.00 179.25 178.52 3hay n LEU 194 N -2.92 0.00 0.00 0.00 4.77 -0.78 -5.06 117.00 113.00 3hay n LEU 194 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3hay n LEU 194 Cb 0.47 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 3hay n LEU 194 CO 0.32 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3hay n GLY 195 N 1.63 3.05 0.00 -0.72 0.00 0.14 -4.91 105.19 104.38 3hay n GLY 195 Ca -0.14 -0.85 0.06 0.00 0.00 0.00 0.00 46.02 45.09 3hay n GLY 195 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hay n VAL 196 N 0.00 1.06 0.00 1.61 0.24 -1.19 -4.68 118.33 115.37 3hay n VAL 196 Ca 0.00 0.27 0.00 0.00 -2.04 0.00 0.00 64.34 62.57 3hay n VAL 196 Cb 0.00 -1.04 0.00 0.00 -1.47 0.00 0.00 33.84 31.33 3hay n VAL 196 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hay n GLY 197 N -0.13 -1.16 3.38 7.63 0.00 0.03 -4.52 105.19 110.41 3hay n GLY 197 Ca 0.03 -1.61 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 3hay n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hay s ALA 198 N -2.41 -1.24 0.39 4.61 0.00 -1.26 -3.72 121.76 118.12 3hay s ALA 198 Ca 0.00 0.92 0.04 0.00 0.00 0.00 0.00 51.96 52.91 3hay s ALA 198 Cb 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 3hay s ALA 198 CO 0.00 -0.30 0.08 -3.38 0.00 0.00 0.00 175.76 172.16 3hay s HIS 199 N -0.95 1.91 -0.21 0.00 -3.43 -1.24 -3.92 115.29 107.45 3hay s HIS 199 Ca -0.10 -1.07 -0.04 0.00 -0.80 0.00 0.00 55.06 53.05 3hay s HIS 199 Cb -0.03 -1.31 -0.01 0.00 -1.43 0.00 0.00 32.58 29.80 3hay s HIS 199 CO 0.06 -0.06 -0.05 1.41 -2.00 0.00 0.00 174.74 174.10 3hay s MET 200 N -3.81 3.39 0.09 -0.38 1.75 -1.26 -3.39 119.30 115.70 3hay s MET 200 Ca 0.27 -0.62 0.22 0.00 -1.25 0.00 0.00 55.69 54.31 3hay s MET 200 Cb 0.05 -2.98 -0.13 0.00 2.84 0.00 0.00 34.83 34.61 3hay s MET 200 CO 0.14 -0.15 0.82 -1.13 -0.65 0.00 0.00 175.02 174.05 3hay n SER 201 N 4.66 0.49 -3.57 1.11 3.41 -1.25 -4.99 113.62 113.47 3hay n SER 201 Ca -0.18 0.14 -0.13 0.00 -0.26 0.00 0.00 58.87 58.43 3hay n SER 201 Cb 0.51 1.09 -0.06 0.00 -0.26 0.00 0.00 64.21 65.49 3hay n SER 201 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3hay s GLU 202 N -3.41 0.78 0.05 4.33 2.12 -1.26 -5.11 118.70 116.20 3hay s GLU 202 Ca -0.03 0.35 -0.14 0.00 0.36 0.00 0.00 54.97 55.51 3hay s GLU 202 Cb 0.12 0.37 0.02 0.00 0.26 0.00 0.00 34.13 34.90 3hay s GLU 202 CO 0.84 -0.21 0.31 -1.17 -0.54 0.00 0.00 175.26 174.49 3hay s LEU 203 N -0.77 0.84 -0.16 2.70 2.96 -1.26 -2.77 118.68 120.21 3hay s LEU 203 Ca -0.04 -0.19 -0.13 0.00 -0.22 0.00 0.00 54.13 53.55 3hay s LEU 203 Cb -0.01 1.40 0.04 0.00 0.50 0.00 0.00 46.19 48.12 3hay s LEU 203 CO 0.03 -0.63 0.41 -0.60 -1.32 0.00 0.00 176.35 174.25 3hay s ARG 204 N -2.62 0.46 0.45 1.98 3.52 -0.88 -2.64 118.95 119.21 3hay s ARG 204 Ca -0.04 0.63 -0.18 0.00 -0.13 0.00 0.00 55.73 56.00 3hay s ARG 204 Cb -0.01 0.17 -0.09 0.00 -1.56 0.00 0.00 34.95 33.46 3hay s ARG 204 CO -0.04 -0.08 0.93 0.50 -0.81 0.00 0.00 175.30 175.80 3hay s ARG 205 N 0.51 4.09 0.00 5.12 3.52 0.16 0.24 118.95 132.58 3hay s ARG 205 Ca -0.02 0.99 0.00 0.00 -0.13 0.00 0.00 55.73 56.57 3hay s ARG 205 Cb -0.04 -2.20 0.00 0.00 -1.56 0.00 0.00 34.95 31.15 3hay s ARG 205 CO -0.03 -0.10 0.00 0.25 -0.81 0.00 0.00 175.30 174.62 3hay n THR 206 N -0.98 0.00 -3.80 4.11 -2.24 0.87 -3.26 114.28 108.97 3hay n THR 206 Ca 0.06 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.72 3hay n THR 206 Cb 0.54 -0.40 -0.11 0.00 -2.10 0.00 0.00 70.33 68.26 3hay n THR 206 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3hay s ARG 207 N -1.46 0.36 -0.31 -0.78 3.52 -0.37 -3.32 118.95 116.59 3hay s ARG 207 Ca 0.00 0.14 0.01 0.00 -0.13 0.00 0.00 55.73 55.75 3hay s ARG 207 Cb 0.00 0.16 0.15 0.00 -1.56 0.00 0.00 34.95 33.70 3hay s ARG 207 CO 0.00 -0.06 0.35 0.45 -0.81 0.00 0.00 175.30 175.22 3hay s SER 208 N -0.31 1.17 1.70 -2.12 0.15 0.26 -0.26 113.70 114.28 3hay s SER 208 Ca -0.04 -0.83 0.00 0.00 0.70 0.00 0.00 55.95 55.77 3hay s SER 208 Cb -0.03 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 64.98 3hay s SER 208 CO 0.01 -0.35 0.00 0.61 1.20 0.00 0.00 173.24 174.71 3hay n GLY 209 N 5.08 3.46 1.67 9.45 0.00 0.97 -1.70 105.19 124.11 3hay n GLY 209 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 3hay n GLY 209 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hay n PRO 210 N 11.63 3.73 -3.84 1.61 -0.04 -1.26 -4.89 135.00 141.94 3hay n PRO 210 Ca 0.00 -2.47 -0.36 0.00 -0.04 0.00 0.00 63.50 60.63 3hay n PRO 210 Cb 0.00 -2.08 -0.13 0.00 -0.04 0.00 0.00 33.50 31.25 3hay n PRO 210 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3hay s PHE 211 N -2.43 3.06 0.26 0.54 0.08 -0.69 -5.01 117.98 113.79 3hay s PHE 211 Ca 0.43 -0.96 0.01 0.00 0.12 0.00 0.00 56.93 56.53 3hay s PHE 211 Cb 0.34 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.57 3hay s PHE 211 CO 0.12 -0.56 0.12 -1.59 -0.10 0.00 0.00 175.22 173.22 3hay s LYS 212 N 1.48 1.41 -0.87 0.44 -2.85 -1.26 -0.58 119.74 117.51 3hay s LYS 212 Ca 0.04 -1.77 -0.25 0.00 -1.00 0.00 0.00 55.97 52.99 3hay s LYS 212 Cb -0.16 -0.06 -0.08 0.00 -2.06 0.00 0.00 37.83 35.46 3hay s LYS 212 CO -0.00 -0.37 2.12 -1.21 0.10 0.00 0.00 175.35 175.99 3hay s GLU 213 N -4.00 2.18 0.00 1.78 2.02 -1.21 -4.74 118.70 114.72 3hay s GLU 213 Ca 0.38 -0.04 0.00 0.00 0.02 0.00 0.00 54.97 55.33 3hay s GLU 213 Cb 0.07 -4.97 0.00 0.00 0.10 0.00 0.00 34.13 29.33 3hay s GLU 213 CO 0.14 -3.83 0.00 -0.40 0.02 0.00 0.00 175.26 171.20 3hay n ASP 214 N 15.81 1.43 0.08 -0.19 5.68 -1.26 -5.02 116.55 133.08 3hay n ASP 214 Ca 0.43 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.85 3hay n ASP 214 Cb 0.46 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 40.84 3hay n ASP 214 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3hay n GLU 215 N 0.00 0.21 0.16 0.11 4.71 -1.26 -2.95 120.64 121.62 3hay n GLU 215 Ca 0.00 0.15 0.12 0.00 -0.01 0.00 0.00 57.16 57.42 3hay n GLU 215 Cb 0.00 -1.72 0.19 0.00 -1.01 0.00 0.00 31.44 28.90 3hay n GLU 215 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 177.13 179.01 3hay h THR 216 N 0.00 0.00 -3.63 2.62 1.35 -1.92 -3.45 112.91 107.87 3hay h THR 216 Ca 0.00 -0.83 -0.52 0.00 -0.55 0.00 0.00 66.41 64.50 3hay h THR 216 Cb 0.69 1.70 0.06 0.00 -1.73 0.00 0.00 68.15 68.87 3hay h THR 216 CO 0.00 0.00 0.68 -0.22 -0.25 0.00 0.00 175.52 175.73 3hay s LEU 217 N -5.49 4.41 -0.10 3.87 2.96 -1.15 -4.37 118.68 118.80 3hay s LEU 217 Ca 0.06 2.64 -0.08 0.00 -0.22 0.00 0.00 54.13 56.53 3hay s LEU 217 Cb 0.08 -3.63 0.03 0.00 0.50 0.00 0.00 46.19 43.17 3hay s LEU 217 CO 0.68 -0.60 0.27 -0.51 -1.32 0.00 0.00 176.35 174.87 3hay s ILE 218 N -0.55 -0.01 0.82 6.68 2.07 -0.19 -4.87 121.20 125.15 3hay s ILE 218 Ca 0.54 0.03 -0.12 0.00 -1.41 0.00 0.00 60.65 59.69 3hay s ILE 218 Cb -0.40 -0.38 0.08 0.00 0.13 0.00 0.00 42.46 41.89 3hay s ILE 218 CO 0.47 0.01 1.11 0.42 -1.91 0.00 0.00 174.94 175.04 3hay s THR 219 N 0.40 2.83 0.29 4.00 -4.23 -1.26 0.11 115.64 117.78 3hay s THR 219 Ca -0.02 0.27 0.03 0.00 -1.18 0.00 0.00 61.69 60.79 3hay s THR 219 Cb -0.04 -3.03 0.07 0.00 1.34 0.00 0.00 72.50 70.84 3hay s THR 219 CO -0.02 -0.35 1.74 -0.07 -0.54 0.00 0.00 174.62 175.38 3hay h LEU 220 N -1.16 0.46 0.41 4.79 3.38 -2.00 -1.80 115.31 119.40 3hay h LEU 220 Ca -0.48 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.33 3hay h LEU 220 Cb 1.28 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 3hay h LEU 220 CO 0.60 0.70 -0.37 0.45 0.09 0.00 0.00 178.44 179.92 3hay h HIS 221 N 0.41 -1.02 -0.76 1.13 3.86 -1.95 -2.40 115.15 114.43 3hay h HIS 221 Ca 0.06 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 3hay h HIS 221 Cb 0.64 0.39 -0.04 0.00 1.06 0.00 0.00 27.41 29.46 3hay h HIS 221 CO 0.02 -0.50 0.50 -0.44 0.86 0.00 0.00 177.93 178.37 3hay h ASP 222 N -0.77 0.82 0.05 2.45 3.32 -1.95 -1.61 116.42 118.74 3hay h ASP 222 Ca -0.05 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.00 3hay h ASP 222 Cb 0.65 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.96 3hay h ASP 222 CO -0.02 0.58 -0.48 0.25 -1.72 0.00 0.00 179.24 177.85 3hay h LEU 223 N 0.96 -1.45 -0.98 1.55 5.85 -1.17 0.01 115.31 120.07 3hay h LEU 223 Ca 0.29 0.16 -0.10 0.00 0.84 0.00 0.00 57.88 59.07 3hay h LEU 223 Cb -0.01 0.54 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 3hay h LEU 223 CO -0.08 -0.48 -0.33 -0.37 -0.34 0.00 0.00 178.44 176.84 3hay h VAL 224 N -0.63 1.28 0.37 1.05 -1.51 -1.21 -2.29 116.25 113.30 3hay h VAL 224 Ca 0.00 -1.36 -0.01 0.00 -1.23 0.00 0.00 66.70 64.11 3hay h VAL 224 Cb 0.66 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 31.33 3hay h VAL 224 CO -0.29 0.42 -0.26 0.44 -1.23 0.00 0.00 177.57 176.64 3hay h ASP 225 N 0.28 -0.67 -0.13 4.19 3.32 -0.94 -2.30 116.42 120.18 3hay h ASP 225 Ca 0.04 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 3hay h ASP 225 Cb 0.72 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.47 3hay h ASP 225 CO 0.06 -0.40 0.01 1.88 -1.72 0.00 0.00 179.24 179.06 3hay h TYR 226 N -0.62 0.32 -0.51 4.55 0.05 -0.87 -2.20 116.97 117.68 3hay h TYR 226 Ca -0.03 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.70 3hay h TYR 226 Cb 0.53 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 3hay h TYR 226 CO -0.12 0.32 0.21 -0.92 -1.05 0.00 0.00 178.16 176.60 3hay h TYR 227 N 0.32 0.78 0.00 4.88 3.20 -1.11 -2.68 116.97 122.35 3hay h TYR 227 Ca 0.07 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3hay h TYR 227 Cb 0.20 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.23 3hay h TYR 227 CO 0.00 0.64 0.00 1.88 -1.64 0.00 0.00 178.16 179.05 3hay h TYR 228 N 0.69 0.00 0.00 -3.82 -1.99 -1.11 -1.28 116.97 109.46 3hay h TYR 228 Ca 0.17 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.81 3hay h TYR 228 Cb 0.19 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.91 3hay h TYR 228 CO 0.00 0.00 -0.43 0.74 -0.00 0.00 0.00 178.16 178.47 3hay h PHE 229 N 0.00 0.00 0.02 4.88 0.05 -1.08 0.21 116.94 121.03 3hay h PHE 229 Ca 0.00 0.00 -0.30 0.00 3.82 0.00 0.00 57.97 61.49 3hay h PHE 229 Cb 0.84 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.74 3hay h PHE 229 CO 0.00 0.43 -1.73 2.35 -0.18 0.00 0.00 178.31 179.18 3hay h TRP 230 N 0.00 0.09 -0.00 -0.55 7.01 -1.38 0.21 115.95 121.33 3hay h TRP 230 Ca -0.00 -0.07 -0.01 0.00 2.11 0.00 0.00 58.89 60.93 3hay h TRP 230 Cb 0.83 -0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.89 3hay h TRP 230 CO 0.00 1.14 -0.02 -0.22 -2.79 0.00 0.00 178.44 176.55 3hay h LYS 231 N 0.01 0.02 0.00 2.65 1.63 -1.11 -2.80 116.57 116.97 3hay h LYS 231 Ca -0.30 -0.01 -0.13 0.00 -0.85 0.00 0.00 60.65 59.35 3hay h LYS 231 Cb 2.01 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.62 3hay h LYS 231 CO 0.08 0.76 -0.73 0.93 -3.45 0.00 0.00 179.45 177.04 3hay h GLU 232 N -0.73 0.00 0.09 1.90 5.08 -0.79 -3.42 114.58 116.71 3hay h GLU 232 Ca -0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 3hay h GLU 232 Cb 0.77 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.99 3hay h GLU 232 CO 0.00 0.99 -1.96 -0.25 -1.00 0.00 0.00 179.01 176.79 3hay n ASP 233 N -4.51 1.81 -0.92 1.42 10.43 -1.14 -5.05 116.55 118.60 3hay n ASP 233 Ca -0.23 0.24 0.00 0.00 2.57 0.00 0.00 54.79 57.37 3hay n ASP 233 Cb 0.59 -0.64 0.00 0.00 1.84 0.00 0.00 41.12 42.91 3hay n ASP 233 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hay n GLY 234 N 1.91 0.65 3.11 0.44 0.00 0.72 -4.95 105.19 107.07 3hay n GLY 234 Ca -0.29 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.05 3hay n GLY 234 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hay s ILE 235 N -2.62 1.64 -0.07 -0.61 -1.09 -1.18 -4.96 121.20 112.29 3hay s ILE 235 Ca 0.00 -0.75 0.14 0.00 -2.23 0.00 0.00 60.65 57.81 3hay s ILE 235 Cb 0.00 -1.46 -0.11 0.00 -1.58 0.00 0.00 42.46 39.31 3hay s ILE 235 CO 0.00 0.47 1.06 -0.33 -1.23 0.00 0.00 174.94 174.90 3hay h GLU 236 N 7.11 0.00 -0.87 2.79 5.08 -1.93 -3.38 114.58 123.38 3hay h GLU 236 Ca -0.28 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.19 3hay h GLU 236 Cb 1.20 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.37 3hay h GLU 236 CO 0.49 0.52 0.50 1.05 -1.00 0.00 0.00 179.01 180.57 3hay h GLU 237 N 0.00 0.78 -0.04 2.33 4.11 -2.00 -2.26 114.58 117.51 3hay h GLU 237 Ca -0.11 -0.05 -0.05 0.00 0.07 0.00 0.00 59.36 59.22 3hay h GLU 237 Cb 1.64 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.71 3hay h GLU 237 CO 0.07 0.52 -0.19 1.88 0.07 0.00 0.00 179.01 181.36 3hay h TYR 238 N 0.81 0.26 0.00 2.06 -1.99 -1.95 -3.21 116.97 112.95 3hay h TYR 238 Ca 0.43 -0.11 -0.03 0.00 2.00 0.00 0.00 58.73 61.02 3hay h TYR 238 Cb 0.44 -0.04 -0.00 0.00 2.00 0.00 0.00 36.73 39.13 3hay h TYR 238 CO -0.05 0.83 -0.15 0.35 -0.00 0.00 0.00 178.16 179.14 3hay h PHE 239 N -0.39 0.00 0.23 4.88 3.57 -1.77 -3.06 116.94 120.40 3hay h PHE 239 Ca -0.01 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 3hay h PHE 239 Cb 0.85 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.60 3hay h PHE 239 CO 0.15 0.15 -0.11 -0.09 -2.23 0.00 0.00 178.31 176.17 3hay h ARG 240 N 0.00 -0.30 0.00 1.11 2.43 -1.40 -2.79 114.38 113.43 3hay h ARG 240 Ca -0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3hay h ARG 240 Cb 0.43 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3hay h ARG 240 CO 0.02 -0.16 0.00 0.36 -1.51 0.00 0.00 179.97 178.68 3hay n LYS 241 N -5.20 0.34 -0.10 0.20 2.85 -1.16 -3.08 118.16 112.01 3hay n LYS 241 Ca -0.09 0.04 -0.13 0.00 -1.05 0.00 0.00 58.31 57.07 3hay n LYS 241 Cb 0.16 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.00 3hay n LYS 241 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hay h ALA 242 N 3.22 0.43 -2.32 0.58 0.00 -1.42 -3.45 119.26 116.30 3hay h ALA 242 Ca 0.00 -0.39 -0.51 0.00 0.00 0.00 0.00 54.91 54.01 3hay h ALA 242 Cb 0.27 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3hay h ALA 242 CO 0.00 0.42 -0.51 0.42 0.00 0.00 0.00 179.25 179.58 3hay s ILE 243 N -4.40 4.66 0.09 0.00 1.01 -1.18 -4.33 121.20 117.06 3hay s ILE 243 Ca -0.12 -1.22 0.10 0.00 0.00 0.00 0.00 60.65 59.40 3hay s ILE 243 Cb 0.09 -3.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 3hay s ILE 243 CO 0.83 -0.28 -0.24 -1.10 0.00 0.00 0.00 174.94 174.15 3hay s GLN 244 N -3.68 1.69 0.32 2.79 -1.52 0.16 -4.89 119.66 114.54 3hay s GLN 244 Ca 0.33 -1.19 -0.29 0.00 -1.95 0.00 0.00 55.36 52.25 3hay s GLN 244 Cb -0.09 -2.01 -0.12 0.00 -0.22 0.00 0.00 33.01 30.58 3hay s GLN 244 CO 0.26 0.49 1.52 -0.35 -0.25 0.00 0.00 175.29 176.95 3hay n PRO 245 N 1.25 2.59 0.00 2.91 -0.04 -1.26 0.13 135.00 140.58 3hay n PRO 245 Ca -0.17 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.21 3hay n PRO 245 Cb 0.52 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 3hay n PRO 245 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hay n MET 246 N 1.46 0.00 0.14 0.54 0.00 -1.23 -0.96 117.12 117.07 3hay n MET 246 Ca 0.06 0.43 0.12 0.00 0.00 0.00 0.00 57.70 58.32 3hay n MET 246 Cb 0.37 -1.54 0.49 0.00 0.00 0.00 0.00 33.22 32.54 3hay n MET 246 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 3hay n GLU 247 N -1.43 0.21 -0.11 3.17 4.71 -1.26 -2.68 120.64 123.24 3hay n GLU 247 Ca 0.00 0.41 -0.06 0.00 -0.01 0.00 0.00 57.16 57.50 3hay n GLU 247 Cb 0.04 -1.89 0.12 0.00 -1.01 0.00 0.00 31.44 28.70 3hay n GLU 247 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 3hay h LYS 248 N 0.00 0.82 -0.99 3.49 1.63 -1.41 -2.97 116.57 117.14 3hay h LYS 248 Ca 0.00 -0.26 -0.03 0.00 -0.85 0.00 0.00 60.65 59.51 3hay h LYS 248 Cb 0.41 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.94 3hay h LYS 248 CO 0.00 0.87 0.04 0.00 -3.45 0.00 0.00 179.45 176.91 3hay n ALA 249 N -2.48 2.72 0.00 5.00 0.00 -1.09 -3.39 120.51 121.27 3hay n ALA 249 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3hay n ALA 249 Cb 0.35 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3hay n ALA 249 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hay n VAL 250 N 0.24 0.00 -0.32 0.00 0.31 -1.12 -4.84 118.33 112.59 3hay n VAL 250 Ca 0.04 0.00 0.19 0.00 -0.01 0.00 0.00 64.34 64.57 3hay n VAL 250 Cb 0.50 0.09 0.40 0.00 -0.91 0.00 0.00 33.84 33.92 3hay n VAL 250 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3hay h GLU 251 N 0.00 0.26 0.00 5.55 5.08 -1.62 0.21 114.58 124.06 3hay h GLU 251 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3hay h GLU 251 Cb 0.10 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3hay h GLU 251 CO 0.00 0.17 0.00 -2.39 -1.00 0.00 0.00 179.01 175.79 3hay n HIS 252 N -5.13 0.00 -4.16 4.33 1.44 -1.26 -4.80 115.22 105.64 3hay n HIS 252 Ca 0.28 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.68 3hay n HIS 252 Cb 0.86 -0.03 -0.08 0.00 0.12 0.00 0.00 29.99 30.86 3hay n HIS 252 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3hay s LEU 253 N -2.07 3.52 0.22 2.39 1.43 0.72 -4.84 118.68 120.06 3hay s LEU 253 Ca 0.42 -0.11 -0.31 0.00 -1.03 0.00 0.00 54.13 53.10 3hay s LEU 253 Cb 0.20 -2.18 -0.12 0.00 0.03 0.00 0.00 46.19 44.12 3hay s LEU 253 CO 0.35 0.20 1.67 -2.16 0.23 0.00 0.00 176.35 176.64 3hay s PRO 254 N -2.12 4.14 0.08 1.29 0.04 -1.26 -4.84 135.00 132.33 3hay s PRO 254 Ca 0.25 2.56 0.06 0.00 0.04 0.00 0.00 61.00 63.91 3hay s PRO 254 Cb -0.12 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 3hay s PRO 254 CO 0.17 -0.70 -0.10 0.15 0.04 0.00 0.00 177.00 176.56 3hay s LYS 255 N 0.76 2.20 -0.14 4.56 1.02 -1.26 -0.25 119.74 126.64 3hay s LYS 255 Ca 0.71 -0.97 0.00 0.00 0.02 0.00 0.00 55.97 55.74 3hay s LYS 255 Cb -0.48 -2.34 0.02 0.00 -0.52 0.00 0.00 37.83 34.51 3hay s LYS 255 CO 0.36 0.53 -0.14 0.14 -0.92 0.00 0.00 175.35 175.32 3hay s VAL 256 N -1.16 1.52 -0.32 3.17 -7.23 0.13 -0.96 120.40 115.54 3hay s VAL 256 Ca 0.20 -0.61 -0.22 0.00 -1.81 0.00 0.00 61.98 59.55 3hay s VAL 256 Cb -0.11 -1.43 -0.00 0.00 0.56 0.00 0.00 36.38 35.40 3hay s VAL 256 CO 0.12 0.45 0.72 0.26 -0.31 0.00 0.00 175.10 176.34 3hay s TRP 257 N 1.43 3.18 0.10 2.82 0.51 0.34 0.00 118.94 127.32 3hay s TRP 257 Ca 0.03 0.64 0.05 0.00 -2.12 0.00 0.00 56.10 54.71 3hay s TRP 257 Cb -0.13 -3.17 -0.04 0.00 -0.81 0.00 0.00 33.47 29.32 3hay s TRP 257 CO -0.09 -0.57 -0.01 0.96 -0.51 0.00 0.00 176.95 176.72 3hay s ILE 258 N 2.84 3.91 0.98 2.03 -4.36 0.22 -1.65 121.20 125.17 3hay s ILE 258 Ca 0.29 -1.04 -0.12 0.00 -0.26 0.00 0.00 60.65 59.52 3hay s ILE 258 Cb -0.14 -2.86 0.18 0.00 1.25 0.00 0.00 42.46 40.88 3hay s ILE 258 CO 0.13 0.11 1.08 -0.54 0.24 0.00 0.00 174.94 175.97 3hay s LYS 259 N -2.32 0.59 0.48 0.37 1.02 -1.17 -3.85 119.74 114.87 3hay s LYS 259 Ca 0.25 0.74 0.13 0.00 0.02 0.00 0.00 55.97 57.12 3hay s LYS 259 Cb -0.12 -1.74 1.12 0.00 -0.52 0.00 0.00 37.83 36.58 3hay s LYS 259 CO 0.18 -2.68 2.10 -0.44 -0.92 0.00 0.00 175.35 173.59 3hay h ASP 260 N -1.86 0.18 1.50 2.83 5.19 -1.94 -2.02 116.42 120.30 3hay h ASP 260 Ca -0.53 -0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 55.80 3hay h ASP 260 Cb 1.31 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.76 3hay h ASP 260 CO 0.54 0.13 -0.37 0.77 -3.12 0.00 0.00 179.24 177.19 3hay h SER 261 N 0.22 0.00 0.45 6.45 4.64 -1.94 -3.26 113.55 120.12 3hay h SER 261 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3hay h SER 261 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3hay h SER 261 CO -0.02 0.37 -0.19 0.00 -0.87 0.00 0.00 176.83 176.12 3hay n ALA 262 N -2.20 2.90 0.01 5.18 0.00 -0.77 -4.34 120.51 121.30 3hay n ALA 262 Ca 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 53.44 53.16 3hay n ALA 262 Cb 0.65 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.82 3hay n ALA 262 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hay h VAL 263 N 0.49 0.00 -0.80 0.00 2.07 -1.57 -3.30 116.25 113.13 3hay h VAL 263 Ca 0.00 -0.50 0.11 0.00 0.82 0.00 0.00 66.70 67.13 3hay h VAL 263 Cb 0.43 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.12 3hay h VAL 263 CO 0.00 0.00 0.43 0.00 0.02 0.00 0.00 177.57 178.02 3hay h ALA 264 N -1.45 1.15 -0.00 1.67 0.00 -1.75 -1.93 119.26 116.94 3hay h ALA 264 Ca -0.01 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.96 3hay h ALA 264 Cb 0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3hay h ALA 264 CO 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 179.25 179.26 3hay h ALA 265 N 1.47 -0.02 -0.97 0.00 0.00 -1.76 -2.86 119.26 115.12 3hay h ALA 265 Ca 0.40 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.33 3hay h ALA 265 Cb 0.43 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3hay h ALA 265 CO -0.28 -0.52 0.64 0.28 0.00 0.00 0.00 179.25 179.37 3hay h VAL 266 N -0.05 1.24 0.00 0.00 2.07 -1.51 -2.37 116.25 115.64 3hay h VAL 266 Ca 0.01 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 3hay h VAL 266 Cb 0.07 -0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 29.66 3hay h VAL 266 CO -0.03 0.24 -0.01 0.71 0.02 0.00 0.00 177.57 178.50 3hay h THR 267 N 1.31 0.72 -0.12 2.57 1.35 -1.15 0.97 112.91 118.57 3hay h THR 267 Ca 0.36 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 66.19 3hay h THR 267 Cb -0.14 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 3hay h THR 267 CO -0.08 0.01 0.00 1.41 -0.25 0.00 0.00 175.52 176.61 3hay n HIS 268 N -4.12 0.33 -0.01 4.73 8.25 -0.90 -4.83 115.22 118.67 3hay n HIS 268 Ca -0.03 -0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 3hay n HIS 268 Cb 0.09 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.08 3hay n HIS 268 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hay n GLY 269 N 0.30 0.19 3.76 -1.41 0.00 0.31 -5.06 105.19 103.28 3hay n GLY 269 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 3hay n GLY 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hay s ALA 270 N -2.05 2.73 0.17 4.61 0.00 -1.03 -4.89 121.76 121.29 3hay s ALA 270 Ca 0.00 0.98 -0.24 0.00 0.00 0.00 0.00 51.96 52.70 3hay s ALA 270 Cb 0.00 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 3hay s ALA 270 CO 0.00 -0.95 0.75 -0.51 0.00 0.00 0.00 175.76 175.05 3hay s ASP 271 N -1.50 7.29 0.00 0.00 1.01 -1.26 -4.37 116.67 117.84 3hay s ASP 271 Ca 0.72 1.57 -0.30 0.00 0.71 0.00 0.00 52.55 55.24 3hay s ASP 271 Cb -0.29 -2.47 -0.06 0.00 1.01 0.00 0.00 42.92 41.11 3hay s ASP 271 CO 0.34 0.17 1.40 -0.22 0.21 0.00 0.00 175.17 177.07 3hay s LEU 272 N -1.34 4.32 0.52 1.23 2.96 -0.84 -4.94 118.68 120.58 3hay s LEU 272 Ca 0.37 2.12 0.00 0.00 -0.22 0.00 0.00 54.13 56.41 3hay s LEU 272 Cb -0.21 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 42.93 3hay s LEU 272 CO 0.24 -0.72 0.74 0.00 -1.32 0.00 0.00 176.35 175.30 3hay s ALA 273 N 2.35 3.80 0.13 5.97 0.00 -1.26 -1.73 121.76 131.02 3hay s ALA 273 Ca 0.64 -1.18 -0.14 0.00 0.00 0.00 0.00 51.96 51.28 3hay s ALA 273 Cb -0.32 -2.14 -0.02 0.00 0.00 0.00 0.00 23.12 20.65 3hay s ALA 273 CO 0.27 -0.62 1.56 0.28 0.00 0.00 0.00 175.76 177.25 3hay h VAL 274 N 0.17 1.27 0.00 0.00 2.07 -1.65 -2.93 116.25 115.18 3hay h VAL 274 Ca -0.44 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.00 3hay h VAL 274 Cb 1.28 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 3hay h VAL 274 CO 0.55 0.37 0.00 -0.81 0.02 0.00 0.00 177.57 177.69 3hay n PRO 275 N -4.39 0.15 0.00 1.57 -0.04 -1.26 -1.69 135.00 129.35 3hay n PRO 275 Ca -0.01 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.51 3hay n PRO 275 Cb 0.31 -1.24 -0.04 0.00 -0.04 0.00 0.00 33.50 32.49 3hay n PRO 275 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hay n GLY 276 N -0.51 -0.14 3.77 0.55 0.00 -1.11 -5.00 105.19 102.76 3hay n GLY 276 Ca 0.02 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 3hay n GLY 276 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hay s ILE 277 N -1.96 4.67 -0.13 -0.61 1.01 -0.68 -3.03 121.20 120.48 3hay s ILE 277 Ca 0.07 1.48 -0.09 0.00 0.00 0.00 0.00 60.65 62.11 3hay s ILE 277 Cb 0.10 -4.03 -0.06 0.00 0.01 0.00 0.00 42.46 38.48 3hay s ILE 277 CO 0.44 0.46 -0.20 0.00 0.00 0.00 0.00 174.94 175.64 3hay n ALA 278 N 2.21 1.91 -2.44 9.38 0.00 -0.85 -4.75 120.51 125.98 3hay n ALA 278 Ca -0.06 -0.58 -0.14 0.00 0.00 0.00 0.00 53.44 52.66 3hay n ALA 278 Cb 0.50 0.24 -0.11 0.00 0.00 0.00 0.00 19.45 20.08 3hay n ALA 278 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3hay s LYS 279 N -2.37 0.86 -0.06 0.00 1.02 -0.66 -2.21 119.74 116.33 3hay s LYS 279 Ca -0.20 -1.20 -0.24 0.00 0.02 0.00 0.00 55.97 54.35 3hay s LYS 279 Cb 0.06 -0.51 0.05 0.00 -0.52 0.00 0.00 37.83 36.92 3hay s LYS 279 CO 0.27 0.07 0.53 -0.48 -0.92 0.00 0.00 175.35 174.82 3hay s LEU 280 N -2.56 -0.05 0.75 3.17 2.34 -0.99 -0.51 118.68 120.84 3hay s LEU 280 Ca 0.07 0.55 -0.12 0.00 0.06 0.00 0.00 54.13 54.68 3hay s LEU 280 Cb -0.02 2.00 0.05 0.00 -0.56 0.00 0.00 46.19 47.66 3hay s LEU 280 CO -0.00 -0.50 1.12 -1.00 -1.06 0.00 0.00 176.35 174.91 3hay s HIS 281 N -1.04 2.36 -0.14 3.48 3.76 -0.13 -0.85 115.29 122.73 3hay s HIS 281 Ca -0.10 1.60 -0.08 0.00 -0.15 0.00 0.00 55.06 56.33 3hay s HIS 281 Cb -0.02 -3.19 -0.04 0.00 1.11 0.00 0.00 32.58 30.43 3hay s HIS 281 CO 0.07 -2.04 0.13 0.00 -0.85 0.00 0.00 174.74 172.05 3hay s ALA 282 N -2.55 3.82 0.00 -1.40 0.00 -0.93 -4.59 121.76 116.11 3hay s ALA 282 Ca 0.66 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.96 3hay s ALA 282 Cb -0.21 -2.01 0.00 0.00 0.00 0.00 0.00 23.12 20.91 3hay s ALA 282 CO 0.50 0.51 0.00 0.41 0.00 0.00 0.00 175.76 177.18 3hay n GLY 283 N 2.36 1.64 3.73 0.00 0.00 -1.26 -4.59 105.19 107.07 3hay n GLY 283 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 3hay n GLY 283 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hay s ILE 284 N -2.00 4.39 0.44 -0.61 1.01 -1.26 -4.99 121.20 118.18 3hay s ILE 284 Ca 0.00 1.99 0.06 0.00 0.00 0.00 0.00 60.65 62.69 3hay s ILE 284 Cb 0.00 -4.27 -0.06 0.00 0.01 0.00 0.00 42.46 38.14 3hay s ILE 284 CO 0.00 0.31 0.01 -0.54 0.00 0.00 0.00 174.94 174.72 3hay s LYS 285 N -0.04 2.03 -0.38 2.79 1.02 -1.26 -3.09 119.74 120.79 3hay s LYS 285 Ca 0.48 -2.18 -0.28 0.00 0.02 0.00 0.00 55.97 54.01 3hay s LYS 285 Cb -0.24 -1.62 0.02 0.00 -0.52 0.00 0.00 37.83 35.46 3hay s LYS 285 CO 0.31 -0.13 1.03 1.03 -0.92 0.00 0.00 175.35 176.66 3hay s ARG 286 N -3.76 3.87 0.00 1.68 0.52 -1.26 -3.46 118.95 116.54 3hay s ARG 286 Ca 0.28 0.71 0.00 0.00 -0.52 0.00 0.00 55.73 56.20 3hay s ARG 286 Cb 0.08 -3.81 0.00 0.00 0.52 0.00 0.00 34.95 31.73 3hay s ARG 286 CO 0.14 -1.05 0.00 0.41 0.02 0.00 0.00 175.30 174.82 3hay n GLY 287 N 4.36 1.59 3.77 -3.53 0.00 -1.17 -5.00 105.19 105.22 3hay n GLY 287 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 3hay n GLY 287 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hay s ASP 288 N -1.48 6.20 -0.09 1.61 1.11 -1.22 -4.74 116.67 118.05 3hay s ASP 288 Ca 0.00 2.24 -0.26 0.00 0.18 0.00 0.00 52.55 54.71 3hay s ASP 288 Cb 0.00 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.37 3hay s ASP 288 CO 0.00 -0.89 0.84 -0.22 1.18 0.00 0.00 175.17 176.07 3hay s LEU 289 N -3.09 4.27 -0.07 1.23 2.96 -1.26 -1.79 118.68 120.93 3hay s LEU 289 Ca 0.64 1.32 0.05 0.00 -0.22 0.00 0.00 54.13 55.93 3hay s LEU 289 Cb -0.27 -3.29 -0.01 0.00 0.50 0.00 0.00 46.19 43.13 3hay s LEU 289 CO 0.32 -0.28 -0.25 0.68 -1.32 0.00 0.00 176.35 175.51 3hay s VAL 290 N 1.42 2.06 0.15 1.68 -7.23 0.55 -4.47 120.40 114.56 3hay s VAL 290 Ca 0.42 -1.05 -0.29 0.00 -1.81 0.00 0.00 61.98 59.25 3hay s VAL 290 Cb -0.18 -1.76 -0.07 0.00 0.56 0.00 0.00 36.38 34.93 3hay s VAL 290 CO 0.18 0.57 0.93 0.00 -0.31 0.00 0.00 175.10 176.47 3hay s ALA 291 N 0.01 3.30 -0.25 1.32 0.00 0.66 -2.90 121.76 123.90 3hay s ALA 291 Ca -0.09 0.56 -0.08 0.00 0.00 0.00 0.00 51.96 52.35 3hay s ALA 291 Cb -0.15 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 3hay s ALA 291 CO 0.06 0.08 0.08 0.42 0.00 0.00 0.00 175.76 176.39 3hay s ILE 292 N -0.46 4.43 0.10 0.00 1.01 -0.37 0.19 121.20 126.09 3hay s ILE 292 Ca 0.44 -0.13 0.10 0.00 0.00 0.00 0.00 60.65 61.05 3hay s ILE 292 Cb -0.24 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.12 3hay s ILE 292 CO 0.30 0.33 -0.25 -0.04 0.00 0.00 0.00 174.94 175.28 3hay s MET 293 N 1.60 1.43 0.88 2.79 -1.94 0.10 -0.43 119.30 123.73 3hay s MET 293 Ca 0.06 -1.21 -0.14 0.00 -1.71 0.00 0.00 55.69 52.69 3hay s MET 293 Cb -0.15 -1.77 0.13 0.00 2.01 0.00 0.00 34.83 35.06 3hay s MET 293 CO 0.04 0.43 1.23 0.95 -0.01 0.00 0.00 175.02 177.66 3hay s THR 294 N -1.00 1.99 0.05 2.05 -4.23 -0.72 -0.61 115.64 113.17 3hay s THR 294 Ca 0.11 0.00 0.32 0.00 -1.18 0.00 0.00 61.69 60.94 3hay s THR 294 Cb -0.10 -2.97 0.38 0.00 1.34 0.00 0.00 72.50 71.15 3hay s THR 294 CO 0.04 0.00 1.94 -0.07 -0.54 0.00 0.00 174.62 175.99 3hay h LEU 295 N -1.34 0.00 -1.48 4.79 3.38 -1.92 -2.55 115.31 116.19 3hay h LEU 295 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3hay h LEU 295 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3hay h LEU 295 CO 0.54 0.01 0.00 0.29 0.09 0.00 0.00 178.44 179.38 3hay n LYS 296 N -3.11 1.98 -3.01 1.13 5.02 -1.26 -4.95 118.16 113.96 3hay n LYS 296 Ca 0.01 -1.38 -0.12 0.00 -2.02 0.00 0.00 58.31 54.80 3hay n LYS 296 Cb 0.34 -1.35 0.06 0.00 -0.02 0.00 0.00 35.03 34.05 3hay n LYS 296 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3hay n ASP 297 N 0.58 -6.13 -4.20 4.39 8.00 -0.96 -4.81 116.55 113.42 3hay n ASP 297 Ca 0.13 -0.57 -0.30 0.00 0.71 0.00 0.00 54.79 54.75 3hay n ASP 297 Cb 0.36 -4.61 -0.17 0.00 -0.02 0.00 0.00 41.12 36.68 3hay n ASP 297 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3hay s GLU 298 N -4.12 2.62 -0.04 -1.24 2.02 -1.26 -4.71 118.70 111.97 3hay s GLU 298 Ca 0.37 -0.80 -0.30 0.00 0.02 0.00 0.00 54.97 54.26 3hay s GLU 298 Cb -0.05 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.06 3hay s GLU 298 CO 0.64 0.22 1.37 -1.17 0.02 0.00 0.00 175.26 176.34 3hay s LEU 299 N 0.22 4.29 -0.16 1.80 2.96 -1.26 -1.75 118.68 124.77 3hay s LEU 299 Ca -0.13 2.00 -0.14 0.00 -0.22 0.00 0.00 54.13 55.64 3hay s LEU 299 Cb -0.16 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 42.93 3hay s LEU 299 CO 0.06 -0.73 -0.28 0.52 -1.32 0.00 0.00 176.35 174.61 3hay n VAL 300 N 4.87 1.43 -3.93 1.68 0.31 0.43 -4.28 118.33 118.84 3hay n VAL 300 Ca 0.13 0.18 -0.09 0.00 -0.01 0.00 0.00 64.34 64.55 3hay n VAL 300 Cb 0.44 -2.34 -0.03 0.00 -0.91 0.00 0.00 33.84 31.00 3hay n VAL 300 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hay s ALA 301 N -2.85 -0.61 0.10 3.52 0.00 -1.21 -2.04 121.76 118.67 3hay s ALA 301 Ca -0.23 -0.68 0.09 0.00 0.00 0.00 0.00 51.96 51.13 3hay s ALA 301 Cb 0.03 0.95 -0.03 0.00 0.00 0.00 0.00 23.12 24.07 3hay s ALA 301 CO 0.35 -0.94 -0.23 -0.51 0.00 0.00 0.00 175.76 174.43 3hay s LEU 302 N -3.00 2.28 -0.07 0.00 1.43 -0.25 -1.24 118.68 117.83 3hay s LEU 302 Ca 0.18 -0.68 -0.32 0.00 -1.03 0.00 0.00 54.13 52.28 3hay s LEU 302 Cb -0.03 -1.00 0.12 0.00 0.03 0.00 0.00 46.19 45.31 3hay s LEU 302 CO 0.09 0.11 1.24 -0.83 0.23 0.00 0.00 176.35 177.19 3hay s GLY 303 N -1.83 -0.36 0.25 -3.19 0.00 -1.14 -0.59 107.32 100.45 3hay s GLY 303 Ca 0.09 1.00 -0.22 0.00 0.00 0.00 0.00 44.72 45.59 3hay s GLY 303 CO 0.04 0.27 0.80 0.54 0.00 0.00 0.00 173.10 174.75 3hay s LYS 304 N -2.47 4.39 0.30 2.90 1.02 -1.10 -0.33 119.74 124.45 3hay s LYS 304 Ca 0.12 1.04 -0.28 0.00 0.02 0.00 0.00 55.97 56.88 3hay s LYS 304 Cb 0.02 -2.90 -0.09 0.00 -0.52 0.00 0.00 37.83 34.34 3hay s LYS 304 CO -0.04 0.38 0.98 0.00 -0.92 0.00 0.00 175.35 175.75 3hay s ALA 305 N -1.51 3.27 -0.91 5.17 0.00 -0.74 -0.79 121.76 126.25 3hay s ALA 305 Ca 0.44 0.63 0.19 0.00 0.00 0.00 0.00 51.96 53.22 3hay s ALA 305 Cb -0.18 -3.22 -0.20 0.00 0.00 0.00 0.00 23.12 19.52 3hay s ALA 305 CO 0.22 0.09 0.80 -1.33 0.00 0.00 0.00 175.76 175.55 3hay n MET 306 N 0.89 0.80 -4.28 0.00 0.00 0.14 -3.02 117.12 111.65 3hay n MET 306 Ca 0.01 -0.02 -0.18 0.00 0.00 0.00 0.00 57.70 57.50 3hay n MET 306 Cb 0.48 -1.39 -0.09 0.00 0.00 0.00 0.00 33.22 32.23 3hay n MET 306 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 3hay s MET 307 N -2.76 1.62 0.54 0.03 -1.94 -1.23 -4.94 119.30 110.61 3hay s MET 307 Ca 0.07 -1.92 0.06 0.00 -1.71 0.00 0.00 55.69 52.19 3hay s MET 307 Cb 0.14 0.23 0.06 0.00 2.01 0.00 0.00 34.83 37.27 3hay s MET 307 CO 0.77 -0.56 0.75 0.95 -0.01 0.00 0.00 175.02 176.91 3hay s THR 308 N -3.62 2.52 0.39 2.05 -4.23 -1.26 -4.09 115.64 107.40 3hay s THR 308 Ca 0.39 -0.87 0.38 0.00 -1.18 0.00 0.00 61.69 60.41 3hay s THR 308 Cb 0.04 -2.65 0.39 0.00 1.34 0.00 0.00 72.50 71.61 3hay s THR 308 CO 0.22 0.00 2.16 0.28 -0.54 0.00 0.00 174.62 176.75 3hay h SER 309 N 0.20 0.00 0.08 3.99 0.02 -1.90 -2.43 113.55 113.50 3hay h SER 309 Ca -0.37 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.39 3hay h SER 309 Cb 1.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 3hay h SER 309 CO 0.44 0.00 -0.99 1.56 -1.14 0.00 0.00 176.83 176.70 3hay h GLN 310 N 0.00 0.16 0.00 3.45 1.08 -1.94 -3.31 115.11 114.55 3hay h GLN 310 Ca 0.00 -0.28 -0.10 0.00 -1.45 0.00 0.00 58.65 56.82 3hay h GLN 310 Cb 0.07 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 3hay h GLN 310 CO 0.00 1.13 -0.46 0.93 -0.95 0.00 0.00 178.83 179.48 3hay h GLU 311 N -0.57 0.00 0.00 1.46 5.08 -1.83 -0.60 114.58 118.12 3hay h GLU 311 Ca -0.22 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.08 3hay h GLU 311 Cb 1.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 3hay h GLU 311 CO 0.02 0.46 -0.30 0.52 -1.00 0.00 0.00 179.01 178.71 3hay h MET 312 N 0.00 0.00 0.14 2.33 2.86 -1.66 -3.28 114.93 115.32 3hay h MET 312 Ca -0.00 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.30 3hay h MET 312 Cb 0.84 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.49 3hay h MET 312 CO 0.06 0.30 -1.73 1.25 1.06 0.00 0.00 176.91 177.85 3hay h LEU 313 N 0.00 0.46 0.12 1.22 5.85 -1.45 -3.42 115.31 118.09 3hay h LEU 313 Ca -0.00 -0.90 -0.01 0.00 0.84 0.00 0.00 57.88 57.81 3hay h LEU 313 Cb 1.10 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.99 3hay h LEU 313 CO 0.04 1.76 -0.06 -0.33 -0.34 0.00 0.00 178.44 179.51 3hay h GLU 314 N -0.06 -0.15 -7.50 1.25 5.08 -1.28 -3.48 114.58 108.44 3hay h GLU 314 Ca -0.36 0.01 -0.46 0.00 -1.00 0.00 0.00 59.36 57.55 3hay h GLU 314 Cb 1.95 0.03 0.13 0.00 0.50 0.00 0.00 28.75 31.37 3hay h GLU 314 CO 0.10 -0.10 0.30 0.15 -1.00 0.00 0.00 179.01 178.46 3hay s LYS 315 N -2.06 1.12 0.00 2.33 1.02 -1.24 -5.02 119.74 115.89 3hay s LYS 315 Ca -0.02 0.27 0.00 0.00 0.02 0.00 0.00 55.97 56.24 3hay s LYS 315 Cb 0.00 -1.84 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 3hay s LYS 315 CO 0.07 -2.21 0.19 0.25 -0.92 0.00 0.00 175.35 172.73 3hay n THR 316 N -3.77 0.00 -4.82 2.17 -2.24 -1.26 -4.91 114.28 99.44 3hay n THR 316 Ca 0.07 -0.48 -0.26 0.00 -2.27 0.00 0.00 64.05 61.10 3hay n THR 316 Cb 0.59 1.01 -0.16 0.00 -2.10 0.00 0.00 70.33 69.67 3hay n THR 316 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3hay s LYS 317 N -0.59 1.86 0.00 -0.78 -0.14 -1.26 -4.12 119.74 114.71 3hay s LYS 317 Ca 0.00 -0.59 0.00 0.00 -1.36 0.00 0.00 55.97 54.02 3hay s LYS 317 Cb 0.00 -1.58 0.00 0.00 -1.68 0.00 0.00 37.83 34.57 3hay s LYS 317 CO 0.00 0.20 0.00 0.41 -0.76 0.00 0.00 175.35 175.20 3hay n GLY 318 N 3.28 2.79 3.66 -3.33 0.00 -1.26 -4.94 105.19 105.40 3hay n GLY 318 Ca -0.19 -1.91 -0.39 0.00 0.00 0.00 0.00 46.02 43.52 3hay n GLY 318 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hay s ILE 319 N -1.92 5.11 -0.25 -0.61 -1.09 -1.26 -1.70 121.20 119.48 3hay s ILE 319 Ca 0.00 0.94 -0.09 0.00 -2.23 0.00 0.00 60.65 59.27 3hay s ILE 319 Cb 0.00 -3.84 -0.16 0.00 -1.58 0.00 0.00 42.46 36.89 3hay s ILE 319 CO 0.00 0.18 -0.20 0.00 -1.23 0.00 0.00 174.94 173.69 3hay n ALA 320 N 4.77 1.22 -3.74 9.38 0.00 -0.70 -4.61 120.51 126.82 3hay n ALA 320 Ca -0.05 -1.01 -0.25 0.00 0.00 0.00 0.00 53.44 52.13 3hay n ALA 320 Cb 0.50 -0.08 -0.17 0.00 0.00 0.00 0.00 19.45 19.71 3hay n ALA 320 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3hay s VAL 321 N -2.50 0.90 -0.73 0.00 1.01 -0.99 0.27 120.40 118.36 3hay s VAL 321 Ca -0.35 -0.26 -0.27 0.00 0.00 0.00 0.00 61.98 61.10 3hay s VAL 321 Cb 0.11 -0.91 0.02 0.00 0.00 0.00 0.00 36.38 35.61 3hay s VAL 321 CO 0.56 0.33 1.35 -0.62 0.00 0.00 0.00 175.10 176.72 3hay s ASP 322 N 1.37 6.07 -0.13 3.32 3.68 0.03 -1.98 116.67 129.04 3hay s ASP 322 Ca -0.02 -0.39 -0.29 0.00 2.13 0.00 0.00 52.55 53.98 3hay s ASP 322 Cb -0.14 -2.56 -0.04 0.00 -1.45 0.00 0.00 42.92 38.74 3hay s ASP 322 CO -0.04 -1.89 1.62 -0.69 0.13 0.00 0.00 175.17 174.30 3hay s VAL 323 N 6.10 3.67 -0.14 1.11 1.01 -1.26 -2.69 120.40 128.20 3hay s VAL 323 Ca 0.39 0.79 -0.07 0.00 0.00 0.00 0.00 61.98 63.08 3hay s VAL 323 Cb -0.08 -3.58 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 3hay s VAL 323 CO 0.15 -0.15 -0.18 -0.62 0.00 0.00 0.00 175.10 174.30 3hay n GLU 324 N 7.31 0.30 -4.01 2.72 1.02 0.24 -4.87 120.64 123.35 3hay n GLU 324 Ca 0.18 0.13 -0.31 0.00 -0.02 0.00 0.00 57.16 57.14 3hay n GLU 324 Cb 0.44 -1.01 -0.15 0.00 -0.02 0.00 0.00 31.44 30.70 3hay n GLU 324 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3hay s LYS 325 N -2.26 2.05 -0.07 3.49 3.01 -0.30 -4.98 119.74 120.68 3hay s LYS 325 Ca -0.20 -1.06 -0.17 0.00 -1.01 0.00 0.00 55.97 53.53 3hay s LYS 325 Cb 0.08 -2.64 -0.05 0.00 -1.01 0.00 0.00 37.83 34.21 3hay s LYS 325 CO 0.25 -0.51 0.46 0.08 0.51 0.00 0.00 175.35 176.14 3hay s VAL 326 N 1.29 5.11 0.00 3.17 1.01 -1.26 -1.10 120.40 128.61 3hay s VAL 326 Ca -0.05 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.86 3hay s VAL 326 Cb -0.18 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.41 3hay s VAL 326 CO -0.07 0.42 0.00 0.49 0.00 0.00 0.00 175.10 175.94 3hay n PHE 327 N 2.96 0.00 -2.30 5.22 3.01 -0.87 -5.02 117.46 120.46 3hay n PHE 327 Ca -0.10 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.95 3hay n PHE 327 Cb 0.52 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.96 3hay n PHE 327 CO 0.00 0.00 0.00 1.41 1.01 0.00 0.00 176.76 179.18 3hay s MET 328 N -1.83 4.42 0.97 -1.08 1.75 -0.94 -5.02 119.30 117.56 3hay s MET 328 Ca 0.00 1.94 -0.11 0.00 -1.25 0.00 0.00 55.69 56.27 3hay s MET 328 Cb 0.00 -3.25 0.17 0.00 2.84 0.00 0.00 34.83 34.59 3hay s MET 328 CO 0.00 -0.23 1.09 -2.14 -0.65 0.00 0.00 175.02 173.09 3hay s PRO 329 N 0.31 0.66 0.07 4.11 0.02 -1.26 -4.95 135.00 133.97 3hay s PRO 329 Ca 0.57 1.09 0.14 0.00 0.02 0.00 0.00 61.00 62.82 3hay s PRO 329 Cb -0.34 -1.72 -0.14 0.00 0.02 0.00 0.00 34.50 32.32 3hay s PRO 329 CO 0.34 -2.73 0.94 0.00 -0.33 0.00 0.00 177.00 175.22 3hay h ARG 330 N -1.92 0.00 -0.21 5.54 3.08 -1.93 -3.32 114.38 115.62 3hay h ARG 330 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 3hay h ARG 330 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3hay h ARG 330 CO 0.49 0.48 0.00 -0.40 -1.07 0.00 0.00 179.97 179.46 3hay n ASP 331 N -3.05 1.23 0.03 7.04 5.68 -1.26 -4.05 116.55 122.17 3hay n ASP 331 Ca -0.09 -1.91 -0.06 0.00 -0.50 0.00 0.00 54.79 52.24 3hay n ASP 331 Cb 0.90 -0.14 -0.04 0.00 -1.14 0.00 0.00 41.12 40.70 3hay n ASP 331 CO 0.00 0.00 0.00 -0.50 -1.33 0.00 0.00 177.20 175.37 3hay h TRP 332 N 1.40 -0.17 -3.30 2.11 4.06 -1.98 -3.45 115.95 114.62 3hay h TRP 332 Ca 0.00 -0.00 -0.66 0.00 2.06 0.00 0.00 58.89 60.28 3hay h TRP 332 Cb 0.32 0.06 -0.29 0.00 -1.00 0.00 0.00 29.16 28.24 3hay h TRP 332 CO 0.14 0.09 -0.80 0.71 -3.56 0.00 0.00 178.44 175.02 3hay s TYR 333 N -2.48 2.78 0.83 0.49 1.51 -1.26 -2.62 117.35 116.60 3hay s TYR 333 Ca -0.07 -0.93 -0.12 0.00 -1.01 0.00 0.00 57.07 54.95 3hay s TYR 333 Cb -0.00 -1.87 0.09 0.00 -0.11 0.00 0.00 41.96 40.07 3hay s TYR 333 CO 0.24 -0.40 1.10 -1.25 -1.11 0.00 0.00 175.55 174.13 3hay s PRO 334 N 0.68 1.80 0.08 -1.71 0.04 -1.26 -4.46 135.00 130.18 3hay s PRO 334 Ca -0.07 0.65 -0.31 0.00 0.04 0.00 0.00 61.00 61.31 3hay s PRO 334 Cb -0.16 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 3hay s PRO 334 CO 0.02 -1.82 1.43 0.15 0.04 0.00 0.00 177.00 176.82 3hay s LYS 335 N -5.11 4.29 -0.01 4.56 1.02 -1.26 -4.57 119.74 118.67 3hay s LYS 335 Ca 0.62 2.08 0.01 0.00 0.02 0.00 0.00 55.97 58.70 3hay s LYS 335 Cb -0.15 -3.37 0.02 0.00 -0.52 0.00 0.00 37.83 33.81 3hay s LYS 335 CO 0.55 -0.51 0.73 1.28 -0.92 0.00 0.00 175.35 176.48 3hay n LEU 336 N 4.49 0.58 0.00 3.17 4.32 -1.26 -5.09 117.00 123.22 3hay n LEU 336 Ca 0.12 -0.80 0.08 0.00 -0.02 0.00 0.00 56.01 55.40 3hay n LEU 336 Cb 0.42 -0.03 0.49 0.00 -1.62 0.00 0.00 43.42 42.69 3hay n LEU 336 CO 0.59 0.20 0.70 -2.67 -1.22 0.00 0.00 177.39 174.98