#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hsy s SER 5 N 0.00 6.13 -0.20 0.53 1.04 -1.26 -0.53 113.70 119.41 3hsy s SER 5 Ca 0.00 0.33 -0.00 0.00 0.48 0.00 0.00 55.95 56.76 3hsy s SER 5 Cb 0.00 -1.90 0.02 0.00 0.10 0.00 0.00 66.02 64.24 3hsy s SER 5 CO 0.00 0.33 -0.15 -0.63 0.98 0.00 0.00 173.24 173.77 3hsy s ILE 6 N -1.15 2.44 0.04 -1.02 1.01 0.15 -4.81 121.20 117.85 3hsy s ILE 6 Ca 0.21 -0.87 -0.30 0.00 0.00 0.00 0.00 60.65 59.69 3hsy s ILE 6 Cb -0.12 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.22 3hsy s ILE 6 CO 0.11 0.46 1.12 -1.10 0.00 0.00 0.00 174.94 175.54 3hsy s GLN 7 N 1.33 4.47 0.11 2.79 -1.52 -1.26 -0.28 119.66 125.30 3hsy s GLN 7 Ca 0.04 1.65 0.03 0.00 -1.95 0.00 0.00 55.36 55.13 3hsy s GLN 7 Cb -0.14 -3.39 -0.04 0.00 -0.22 0.00 0.00 33.01 29.22 3hsy s GLN 7 CO -0.10 -0.19 -0.09 0.96 -0.25 0.00 0.00 175.29 175.62 3hsy s ILE 8 N 1.09 0.89 0.21 1.08 -4.36 -0.57 -0.77 121.20 118.76 3hsy s ILE 8 Ca 0.56 -1.83 0.05 0.00 -0.26 0.00 0.00 60.65 59.17 3hsy s ILE 8 Cb -0.26 -1.57 -0.03 0.00 1.25 0.00 0.00 42.46 41.84 3hsy s ILE 8 CO 0.28 -0.72 0.24 -0.83 0.24 0.00 0.00 174.94 174.15 3hsy s GLY 9 N -2.82 1.47 -0.13 6.27 0.00 0.06 -0.63 107.32 111.56 3hsy s GLY 9 Ca 0.10 -1.27 -0.02 0.00 0.00 0.00 0.00 44.72 43.53 3hsy s GLY 9 CO -0.02 -1.29 0.03 -0.32 0.00 0.00 0.00 173.10 171.50 3hsy s GLY 10 N -3.61 0.53 -0.44 0.20 0.00 -0.09 -0.73 107.32 103.18 3hsy s GLY 10 Ca 0.33 -0.35 -0.04 0.00 0.00 0.00 0.00 44.72 44.66 3hsy s GLY 10 CO 0.26 1.33 0.26 1.08 0.00 0.00 0.00 173.10 176.03 3hsy s LEU 11 N 1.96 5.34 -0.05 0.66 1.02 0.54 -0.27 118.68 127.87 3hsy s LEU 11 Ca 0.02 -2.11 0.01 0.00 0.02 0.00 0.00 54.13 52.07 3hsy s LEU 11 Cb -0.15 -1.86 -0.03 0.00 0.02 0.00 0.00 46.19 44.17 3hsy s LEU 11 CO -0.07 -0.55 -0.04 -0.36 0.02 0.00 0.00 176.35 175.35 3hsy s PHE 12 N 1.04 3.01 0.43 0.29 0.08 -0.26 -2.17 117.98 120.40 3hsy s PHE 12 Ca 0.09 0.07 -0.24 0.00 0.12 0.00 0.00 56.93 56.96 3hsy s PHE 12 Cb -0.23 -1.71 -0.08 0.00 -0.57 0.00 0.00 43.02 40.43 3hsy s PHE 12 CO -0.04 0.39 1.19 -2.14 -0.10 0.00 0.00 175.22 174.53 3hsy s PRO 13 N -1.04 3.89 0.22 0.24 0.02 -1.26 -1.53 135.00 135.55 3hsy s PRO 13 Ca 0.14 1.87 -0.32 0.00 0.02 0.00 0.00 61.00 62.71 3hsy s PRO 13 Cb -0.11 -2.57 -0.12 0.00 0.02 0.00 0.00 34.50 31.72 3hsy s PRO 13 CO 0.04 -0.46 1.69 0.54 -0.33 0.00 0.00 177.00 178.48 3hsy n ARG 14 N -0.18 2.73 -0.34 5.54 1.74 -1.04 -1.92 116.66 123.19 3hsy n ARG 14 Ca 0.06 0.98 0.00 0.00 -0.77 0.00 0.00 57.85 58.12 3hsy n ARG 14 Cb 0.47 -2.81 0.00 0.00 -1.02 0.00 0.00 32.46 29.09 3hsy n ARG 14 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hsy n GLY 15 N 3.59 0.94 2.27 -0.13 0.00 -1.26 -4.95 105.19 105.65 3hsy n GLY 15 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3hsy n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hsy n ALA 16 N -0.70 7.39 -0.01 4.61 0.00 -0.81 -4.67 120.51 126.33 3hsy n ALA 16 Ca 0.00 -3.28 -0.12 0.00 0.00 0.00 0.00 53.44 50.04 3hsy n ALA 16 Cb 0.00 -3.21 -0.07 0.00 0.00 0.00 0.00 19.45 16.17 3hsy n ALA 16 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3hsy h ASP 17 N 4.69 0.10 -0.73 0.00 3.32 -1.90 -2.11 116.42 119.78 3hsy h ASP 17 Ca 0.77 -0.27 -0.03 0.00 0.02 0.00 0.00 57.03 57.52 3hsy h ASP 17 Cb 0.47 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 3hsy h ASP 17 CO 1.55 0.35 0.34 -0.61 -1.72 0.00 0.00 179.24 179.15 3hsy h GLN 18 N -0.15 1.08 -0.65 3.56 4.15 -1.83 -1.11 115.11 120.16 3hsy h GLN 18 Ca 0.02 -0.16 -0.06 0.00 0.77 0.00 0.00 58.65 59.21 3hsy h GLN 18 Cb 0.29 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 27.76 3hsy h GLN 18 CO 0.00 0.85 0.16 0.93 -1.93 0.00 0.00 178.83 178.84 3hsy h GLU 19 N 1.07 1.03 -0.49 1.69 3.07 -1.85 -0.16 114.58 118.94 3hsy h GLU 19 Ca 0.26 -0.25 -0.10 0.00 -0.50 0.00 0.00 59.36 58.77 3hsy h GLU 19 Cb 0.14 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 3hsy h GLU 19 CO -0.03 0.93 -0.10 -0.92 -1.40 0.00 0.00 179.01 177.49 3hsy h TYR 20 N 0.96 0.99 -0.85 4.33 3.20 -1.03 -0.31 116.97 124.25 3hsy h TYR 20 Ca 0.20 -0.19 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 3hsy h TYR 20 Cb 0.36 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 3hsy h TYR 20 CO 0.03 0.95 0.49 0.77 -1.64 0.00 0.00 178.16 178.75 3hsy h SER 21 N 0.81 1.04 -0.19 -2.11 0.02 -0.78 0.08 113.55 112.41 3hsy h SER 21 Ca 0.13 -0.07 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 3hsy h SER 21 Cb 0.62 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 3hsy h SER 21 CO 0.04 0.82 -0.23 0.00 -1.14 0.00 0.00 176.83 176.32 3hsy h ALA 22 N 1.36 0.98 -0.09 3.77 0.00 -0.50 -0.26 119.26 124.51 3hsy h ALA 22 Ca 0.30 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3hsy h ALA 22 Cb -0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3hsy h ALA 22 CO -0.05 0.60 0.05 0.35 0.00 0.00 0.00 179.25 180.20 3hsy h PHE 23 N 0.57 0.13 -0.67 0.00 3.57 -0.48 -0.34 116.94 119.71 3hsy h PHE 23 Ca 0.08 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3hsy h PHE 23 Cb 0.69 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.36 3hsy h PHE 23 CO 0.03 0.15 0.37 0.00 -2.23 0.00 0.00 178.31 176.63 3hsy h ARG 24 N 0.07 0.93 -0.53 1.11 3.08 -0.73 -0.10 114.38 118.21 3hsy h ARG 24 Ca 0.03 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 59.92 3hsy h ARG 24 Cb 0.07 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3hsy h ARG 24 CO -0.01 0.70 0.11 0.28 -1.07 0.00 0.00 179.97 179.98 3hsy h VAL 25 N 0.92 1.23 -0.48 2.04 2.07 -0.92 -2.24 116.25 118.87 3hsy h VAL 25 Ca 0.24 -0.85 -0.09 0.00 0.82 0.00 0.00 66.70 66.81 3hsy h VAL 25 Cb 0.03 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3hsy h VAL 25 CO -0.04 0.31 -0.08 1.23 0.02 0.00 0.00 177.57 179.01 3hsy h GLY 26 N 0.97 0.93 1.43 2.17 0.00 -0.55 -1.21 103.07 106.82 3hsy h GLY 26 Ca 0.17 -0.70 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 3hsy h GLY 26 CO 0.00 0.64 0.28 -0.33 0.00 0.00 0.00 176.54 177.13 3hsy h MET 27 N 0.78 0.74 -0.03 4.80 2.07 -0.46 -1.22 114.93 121.62 3hsy h MET 27 Ca 0.13 -0.08 -0.05 0.00 -2.07 0.00 0.00 59.70 57.63 3hsy h MET 27 Cb 0.58 -0.15 0.00 0.00 -1.87 0.00 0.00 31.60 30.17 3hsy h MET 27 CO 0.04 0.56 -0.20 0.28 1.07 0.00 0.00 176.91 178.66 3hsy h VAL 28 N 0.75 1.49 -0.38 -2.22 2.07 -1.25 -3.08 116.25 113.63 3hsy h VAL 28 Ca 0.19 -1.72 -0.07 0.00 0.82 0.00 0.00 66.70 65.92 3hsy h VAL 28 Cb 0.05 2.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 3hsy h VAL 28 CO -0.03 0.47 -0.07 -0.61 0.02 0.00 0.00 177.57 177.35 3hsy h GLN 29 N -0.40 0.63 -0.56 1.57 5.75 -0.91 -2.91 115.11 118.28 3hsy h GLN 29 Ca -0.02 -0.18 0.00 0.00 -0.15 0.00 0.00 58.65 58.31 3hsy h GLN 29 Cb 0.87 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.35 3hsy h GLN 29 CO 0.04 0.70 0.00 1.19 -2.65 0.00 0.00 178.83 178.11 3hsy n PHE 30 N -4.21 1.04 -1.85 3.99 3.72 -0.49 -4.97 117.46 114.70 3hsy n PHE 30 Ca 0.01 -0.58 -0.38 0.00 -0.05 0.00 0.00 57.45 56.45 3hsy n PHE 30 Cb 0.31 -0.13 0.03 0.00 -0.94 0.00 0.00 39.48 38.75 3hsy n PHE 30 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3hsy s SER 31 N -1.06 5.45 0.06 4.37 1.04 -1.10 -4.99 113.70 117.47 3hsy s SER 31 Ca 0.43 2.72 0.00 0.00 0.48 0.00 0.00 55.95 59.58 3hsy s SER 31 Cb 0.26 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 3hsy s SER 31 CO 0.23 -1.44 -0.04 0.42 0.98 0.00 0.00 173.24 173.39 3hsy s THR 32 N -1.32 0.37 -0.67 2.02 -4.23 -1.26 -5.04 115.64 105.51 3hsy s THR 32 Ca 0.69 -1.67 0.24 0.00 -1.18 0.00 0.00 61.69 59.77 3hsy s THR 32 Cb -0.39 -1.33 0.24 0.00 1.34 0.00 0.00 72.50 72.36 3hsy s THR 32 CO 0.47 -0.84 1.72 -1.54 -0.54 0.00 0.00 174.62 173.89 3hsy n SER 33 N 0.38 0.56 -0.08 3.99 3.41 -1.26 -3.66 113.62 116.96 3hsy n SER 33 Ca -0.16 0.60 -0.14 0.00 -0.26 0.00 0.00 58.87 58.91 3hsy n SER 33 Cb 0.60 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.78 3hsy n SER 33 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3hsy h GLU 34 N 0.00 0.88 -3.05 4.33 5.08 -1.96 -3.47 114.58 116.40 3hsy h GLU 34 Ca 0.00 -0.54 -0.01 0.00 -1.00 0.00 0.00 59.36 57.80 3hsy h GLU 34 Cb 0.48 0.06 -0.11 0.00 0.50 0.00 0.00 28.75 29.67 3hsy h GLU 34 CO 0.00 1.18 0.18 -0.59 -1.00 0.00 0.00 179.01 178.78 3hsy s PHE 35 N -4.16 -0.46 -0.13 4.33 -0.12 -1.24 -3.55 117.98 112.64 3hsy s PHE 35 Ca -0.11 0.21 -0.01 0.00 -0.05 0.00 0.00 56.93 56.98 3hsy s PHE 35 Cb 0.10 0.54 -0.02 0.00 -0.63 0.00 0.00 43.02 43.02 3hsy s PHE 35 CO 0.89 -0.88 -0.12 0.50 -0.05 0.00 0.00 175.22 175.56 3hsy s ARG 36 N -3.78 3.39 -0.16 1.99 3.52 0.30 -4.25 118.95 119.97 3hsy s ARG 36 Ca 0.02 -0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 54.68 3hsy s ARG 36 Cb -0.01 -2.66 -0.00 0.00 -1.56 0.00 0.00 34.95 30.71 3hsy s ARG 36 CO -0.11 0.24 1.00 -0.51 -0.81 0.00 0.00 175.30 175.11 3hsy s LEU 37 N 0.30 4.18 -0.41 -0.88 1.43 -1.26 0.34 118.68 122.38 3hsy s LEU 37 Ca -0.09 1.43 -0.04 0.00 -1.03 0.00 0.00 54.13 54.40 3hsy s LEU 37 Cb -0.15 -3.51 0.10 0.00 0.03 0.00 0.00 46.19 42.66 3hsy s LEU 37 CO 0.05 -0.53 0.21 -0.89 0.23 0.00 0.00 176.35 175.42 3hsy s THR 38 N 2.49 3.42 0.12 5.49 2.01 0.61 -4.90 115.64 124.89 3hsy s THR 38 Ca 0.45 -1.94 -0.23 0.00 0.31 0.00 0.00 61.69 60.28 3hsy s THR 38 Cb -0.17 -3.29 -0.07 0.00 0.01 0.00 0.00 72.50 68.98 3hsy s THR 38 CO 0.13 -0.65 0.71 -2.16 -0.69 0.00 0.00 174.62 171.96 3hsy s PRO 39 N 1.19 4.45 -0.22 4.92 0.04 -1.26 -1.52 135.00 142.60 3hsy s PRO 39 Ca 0.07 1.02 -0.04 0.00 0.04 0.00 0.00 61.00 62.08 3hsy s PRO 39 Cb -0.23 -3.27 -0.01 0.00 0.04 0.00 0.00 34.50 31.03 3hsy s PRO 39 CO -0.03 0.56 -0.02 -1.58 0.04 0.00 0.00 177.00 175.96 3hsy s HIS 40 N -1.00 2.98 -0.14 0.56 2.46 0.20 -4.94 115.29 115.42 3hsy s HIS 40 Ca 0.34 -0.79 -0.08 0.00 0.47 0.00 0.00 55.06 54.99 3hsy s HIS 40 Cb -0.22 -2.11 -0.04 0.00 -0.13 0.00 0.00 32.58 30.08 3hsy s HIS 40 CO 0.24 -0.47 0.16 0.42 -2.47 0.00 0.00 174.74 172.61 3hsy s ILE 41 N 1.40 5.45 -0.03 0.89 -1.09 -1.26 -0.91 121.20 125.64 3hsy s ILE 41 Ca 0.05 0.25 0.05 0.00 -2.23 0.00 0.00 60.65 58.77 3hsy s ILE 41 Cb -0.14 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.29 3hsy s ILE 41 CO -0.01 0.56 -0.19 -1.81 -1.23 0.00 0.00 174.94 172.26 3hsy s ASP 42 N -0.61 2.33 -0.19 3.58 1.01 0.63 -4.95 116.67 118.46 3hsy s ASP 42 Ca 0.14 -0.37 -0.03 0.00 0.71 0.00 0.00 52.55 52.99 3hsy s ASP 42 Cb -0.12 -0.50 -0.01 0.00 1.01 0.00 0.00 42.92 43.30 3hsy s ASP 42 CO 0.03 0.20 -0.07 0.20 0.21 0.00 0.00 175.17 175.74 3hsy s ASN 43 N -0.18 4.29 0.30 0.27 0.01 -1.26 -1.10 114.94 117.27 3hsy s ASN 43 Ca 0.01 -0.34 -0.11 0.00 -0.71 0.00 0.00 52.86 51.71 3hsy s ASN 43 Cb -0.10 -1.71 0.01 0.00 0.41 0.00 0.00 41.25 39.86 3hsy s ASN 43 CO 0.01 0.06 0.54 -1.48 -1.51 0.00 0.00 177.10 174.72 3hsy s LEU 44 N 1.01 0.41 -0.55 0.60 2.34 -0.58 -4.87 118.68 117.04 3hsy s LEU 44 Ca -0.00 -1.09 -0.26 0.00 0.06 0.00 0.00 54.13 52.85 3hsy s LEU 44 Cb -0.15 1.92 0.04 0.00 -0.56 0.00 0.00 46.19 47.44 3hsy s LEU 44 CO -0.00 -1.28 1.03 -0.70 -1.06 0.00 0.00 176.35 174.34 3hsy s GLU 45 N -3.50 3.43 0.40 1.48 2.56 -1.26 -2.51 118.70 119.29 3hsy s GLU 45 Ca 0.23 -0.01 0.28 0.00 0.00 0.00 0.00 54.97 55.47 3hsy s GLU 45 Cb -0.02 -4.02 1.23 0.00 2.00 0.00 0.00 34.13 33.32 3hsy s GLU 45 CO 0.12 -1.52 1.85 -0.39 -0.56 0.00 0.00 175.26 174.76 3hsy h VAL 46 N 6.08 0.00 0.00 3.70 -1.51 -1.93 -1.70 116.25 120.89 3hsy h VAL 46 Ca -0.25 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.92 3hsy h VAL 46 Cb 1.07 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.35 3hsy h VAL 46 CO 1.12 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.46 3hsy n ALA 47 N -1.91 2.11 -3.31 5.19 0.00 -1.26 -4.27 120.51 117.05 3hsy n ALA 47 Ca 0.01 -0.10 -0.43 0.00 0.00 0.00 0.00 53.44 52.92 3hsy n ALA 47 Cb 0.23 -1.35 -0.08 0.00 0.00 0.00 0.00 19.45 18.25 3hsy n ALA 47 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3hsy s ASN 48 N -2.65 5.89 0.40 0.00 3.84 -0.64 -4.65 114.94 117.14 3hsy s ASN 48 Ca 0.19 -1.69 0.13 0.00 0.21 0.00 0.00 52.86 51.69 3hsy s ASN 48 Cb 0.15 -2.09 0.84 0.00 -0.55 0.00 0.00 41.25 39.60 3hsy s ASN 48 CO 0.34 -0.70 1.91 0.28 -2.79 0.00 0.00 177.10 176.15 3hsy h SER 49 N 8.61 0.05 -0.11 -4.21 0.02 -1.84 -0.83 113.55 115.24 3hsy h SER 49 Ca -0.25 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.68 3hsy h SER 49 Cb 1.09 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.61 3hsy h SER 49 CO 0.89 0.30 0.05 0.15 -1.14 0.00 0.00 176.83 177.08 3hsy h PHE 50 N 0.05 0.15 -0.80 3.45 3.57 -1.95 -0.15 116.94 121.26 3hsy h PHE 50 Ca 0.01 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 3hsy h PHE 50 Cb 0.47 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 3hsy h PHE 50 CO 0.00 0.21 0.44 0.00 -2.23 0.00 0.00 178.31 176.73 3hsy h ALA 51 N 0.93 1.27 -0.46 2.41 0.00 -1.68 -0.23 119.26 121.51 3hsy h ALA 51 Ca 0.04 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 3hsy h ALA 51 Cb 0.12 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3hsy h ALA 51 CO -0.00 0.60 -0.02 0.28 0.00 0.00 0.00 179.25 180.10 3hsy h VAL 52 N 1.11 1.26 -0.41 0.00 2.07 -1.07 -0.76 116.25 118.46 3hsy h VAL 52 Ca 0.28 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.73 3hsy h VAL 52 Cb 0.02 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 3hsy h VAL 52 CO -0.05 0.37 0.24 0.74 0.02 0.00 0.00 177.57 178.90 3hsy h THR 53 N 0.66 1.05 -0.58 2.57 2.02 -0.59 0.80 112.91 118.85 3hsy h THR 53 Ca 0.13 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 67.15 3hsy h THR 53 Cb 0.53 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 3hsy h THR 53 CO 0.03 0.09 0.37 -1.13 0.37 0.00 0.00 175.52 175.25 3hsy h ASN 54 N 0.49 0.63 -0.38 4.18 -1.24 -0.79 -0.38 115.58 118.10 3hsy h ASN 54 Ca 0.16 -0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.10 3hsy h ASN 54 Cb -0.00 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 38.88 3hsy h ASN 54 CO -0.07 0.45 0.00 0.00 -1.29 0.00 0.00 177.43 176.53 3hsy h ALA 55 N 1.23 0.51 -0.24 1.57 0.00 -0.87 -1.50 119.26 119.95 3hsy h ALA 55 Ca 0.22 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.90 3hsy h ALA 55 Cb -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3hsy h ALA 55 CO -0.06 0.27 0.08 0.35 0.00 0.00 0.00 179.25 179.89 3hsy h PHE 56 N 0.48 0.15 -0.60 0.00 3.57 -0.64 -1.53 116.94 118.38 3hsy h PHE 56 Ca 0.11 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 3hsy h PHE 56 Cb 0.46 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 3hsy h PHE 56 CO 0.04 0.07 0.13 0.00 -2.23 0.00 0.00 178.31 176.32 3hsy h SER 58 N 0.89 0.27 -0.17 0.00 0.02 -0.92 -0.47 113.55 113.17 3hsy h SER 58 Ca 0.19 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 3hsy h SER 58 Cb 0.34 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 3hsy h SER 58 CO 0.00 0.20 0.09 1.56 -1.14 0.00 0.00 176.83 177.54 3hsy h GLN 59 N 0.36 0.23 -0.72 3.45 1.08 -0.88 -2.33 115.11 116.30 3hsy h GLN 59 Ca 0.13 -0.03 0.13 0.00 -1.45 0.00 0.00 58.65 57.43 3hsy h GLN 59 Cb 0.02 -0.05 -0.09 0.00 -0.05 0.00 0.00 27.48 27.32 3hsy h GLN 59 CO -0.07 0.24 0.29 0.35 -0.95 0.00 0.00 178.83 178.69 3hsy h PHE 60 N 0.16 0.49 0.00 2.96 3.57 -0.84 -0.80 116.94 122.48 3hsy h PHE 60 Ca 0.06 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 3hsy h PHE 60 Cb 0.08 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 3hsy h PHE 60 CO -0.04 0.08 -0.09 0.77 -2.23 0.00 0.00 178.31 176.80 3hsy h SER 61 N 0.45 0.00 0.01 0.41 0.02 -0.81 -1.03 113.55 112.59 3hsy h SER 61 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 3hsy h SER 61 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 3hsy h SER 61 CO -0.38 0.09 -0.00 0.54 -1.14 0.00 0.00 176.83 175.94 3hsy n ARG 62 N -3.21 1.10 -1.62 3.45 1.74 -0.33 -4.90 116.66 112.89 3hsy n ARG 62 Ca 0.01 -0.17 -0.04 0.00 -0.77 0.00 0.00 57.85 56.88 3hsy n ARG 62 Cb 0.38 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.32 3hsy n ARG 62 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hsy n GLY 63 N 1.04 0.42 3.75 -0.13 0.00 -0.39 -4.98 105.19 104.90 3hsy n GLY 63 Ca 0.23 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 3hsy n GLY 63 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hsy n VAL 64 N -3.49 2.48 0.35 1.61 0.24 -1.06 -4.53 118.33 113.93 3hsy n VAL 64 Ca -0.04 -0.50 0.12 0.00 -2.04 0.00 0.00 64.34 61.88 3hsy n VAL 64 Cb 0.34 -1.83 0.11 0.00 -1.47 0.00 0.00 33.84 31.00 3hsy n VAL 64 CO 0.00 0.00 0.00 1.88 -2.14 0.00 0.00 176.83 176.57 3hsy h TYR 65 N 2.47 0.00 -2.47 6.34 -1.99 -1.32 -3.47 116.97 116.53 3hsy h TYR 65 Ca -0.50 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.24 3hsy h TYR 65 Cb 1.27 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 39.84 3hsy h TYR 65 CO 0.50 0.00 0.30 0.00 -0.00 0.00 0.00 178.16 178.97 3hsy s ALA 66 N -3.25 -1.72 -0.11 3.88 0.00 -1.26 -4.50 121.76 114.81 3hsy s ALA 66 Ca 0.04 0.90 0.02 0.00 0.00 0.00 0.00 51.96 52.92 3hsy s ALA 66 Cb 0.11 0.43 0.01 0.00 0.00 0.00 0.00 23.12 23.67 3hsy s ALA 66 CO 0.74 -0.62 -0.16 0.42 0.00 0.00 0.00 175.76 176.14 3hsy s ILE 67 N -2.78 1.57 -0.09 0.00 1.01 0.31 -0.76 121.20 120.47 3hsy s ILE 67 Ca -0.01 -0.69 -0.17 0.00 0.00 0.00 0.00 60.65 59.78 3hsy s ILE 67 Cb -0.01 -1.43 -0.05 0.00 0.01 0.00 0.00 42.46 40.99 3hsy s ILE 67 CO -0.06 0.45 0.45 0.12 0.00 0.00 0.00 174.94 175.91 3hsy s PHE 68 N 0.95 3.57 0.00 3.97 5.36 0.09 -0.60 117.98 131.33 3hsy s PHE 68 Ca -0.07 0.90 0.00 0.00 -0.96 0.00 0.00 56.93 56.81 3hsy s PHE 68 Cb -0.15 -2.47 0.00 0.00 -0.34 0.00 0.00 43.02 40.06 3hsy s PHE 68 CO -0.01 0.30 0.00 0.41 -1.46 0.00 0.00 175.22 174.46 3hsy n GLY 69 N 2.87 1.30 3.24 13.12 0.00 -0.40 -0.34 105.19 124.98 3hsy n GLY 69 Ca -0.09 -0.75 -0.20 0.00 0.00 0.00 0.00 46.02 44.98 3hsy n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hsy s PHE 70 N -3.26 1.50 0.37 1.61 0.08 -0.92 -3.94 117.98 113.41 3hsy s PHE 70 Ca 0.00 -0.49 0.04 0.00 0.12 0.00 0.00 56.93 56.61 3hsy s PHE 70 Cb 0.00 -0.80 -0.03 0.00 -0.57 0.00 0.00 43.02 41.62 3hsy s PHE 70 CO 0.00 0.16 0.17 1.52 -0.10 0.00 0.00 175.22 176.96 3hsy s TYR 71 N -1.67 1.74 0.10 0.36 -0.85 -1.26 -4.95 117.35 110.81 3hsy s TYR 71 Ca 0.06 -1.38 0.02 0.00 -0.52 0.00 0.00 57.07 55.25 3hsy s TYR 71 Cb -0.08 -1.00 -0.01 0.00 0.38 0.00 0.00 41.96 41.26 3hsy s TYR 71 CO 0.04 -0.46 0.07 -0.40 -1.52 0.00 0.00 175.55 173.27 3hsy n ASP 72 N -1.26 0.07 0.18 -0.18 5.75 -1.26 -4.81 116.55 115.04 3hsy n ASP 72 Ca -0.02 -1.60 0.12 0.00 -0.01 0.00 0.00 54.79 53.28 3hsy n ASP 72 Cb 0.64 0.42 0.65 0.00 -1.03 0.00 0.00 41.12 41.81 3hsy n ASP 72 CO 0.00 0.00 0.00 0.07 -0.11 0.00 0.00 177.20 177.16 3hsy h LYS 73 N 0.00 0.00 0.00 0.11 2.10 -1.88 -0.42 116.57 116.48 3hsy h LYS 73 Ca -0.07 -0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.50 3hsy h LYS 73 Cb 0.33 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.65 3hsy h LYS 73 CO 0.10 0.00 -0.49 0.87 -2.00 0.00 0.00 179.45 177.93 3hsy h LYS 74 N 0.00 0.00 -0.00 0.07 1.57 -1.89 -3.36 116.57 112.95 3hsy h LYS 74 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3hsy h LYS 74 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 3hsy h LYS 74 CO -0.00 0.34 -0.19 -1.13 -0.57 0.00 0.00 179.45 177.90 3hsy n SER 75 N -3.14 0.92 -0.18 0.86 3.41 -0.63 -4.68 113.62 110.20 3hsy n SER 75 Ca 0.01 -0.96 0.04 0.00 -0.26 0.00 0.00 58.87 57.70 3hsy n SER 75 Cb 0.69 0.56 0.32 0.00 -0.26 0.00 0.00 64.21 65.53 3hsy n SER 75 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3hsy h VAL 76 N 0.70 1.08 -0.11 -3.33 3.04 -1.27 -1.55 116.25 114.82 3hsy h VAL 76 Ca 0.00 -0.28 -0.13 0.00 -1.01 0.00 0.00 66.70 65.28 3hsy h VAL 76 Cb 0.24 0.19 -0.01 0.00 -2.01 0.00 0.00 31.29 29.70 3hsy h VAL 76 CO 0.00 0.15 -0.52 0.78 -1.01 0.00 0.00 177.57 176.97 3hsy h ASN 77 N 0.82 0.32 -0.07 3.17 4.21 -1.84 -0.46 115.58 121.73 3hsy h ASN 77 Ca 0.29 -0.16 -0.00 0.00 1.21 0.00 0.00 56.30 57.64 3hsy h ASN 77 Cb 0.10 -0.09 -0.00 0.00 -1.12 0.00 0.00 38.32 37.21 3hsy h ASN 77 CO -0.08 0.78 0.05 0.74 -1.29 0.00 0.00 177.43 177.62 3hsy h THR 78 N 0.23 1.05 -0.08 2.81 2.02 -1.61 -0.93 112.91 116.40 3hsy h THR 78 Ca 0.01 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.06 3hsy h THR 78 Cb 0.99 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.39 3hsy h THR 78 CO 0.08 0.04 0.05 0.40 0.37 0.00 0.00 175.52 176.46 3hsy h ILE 79 N 0.07 1.03 -0.41 3.11 1.08 -1.21 -0.05 117.51 121.12 3hsy h ILE 79 Ca 0.03 -0.06 -0.01 0.00 -0.39 0.00 0.00 64.86 64.43 3hsy h ILE 79 Cb 0.03 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 34.69 3hsy h ILE 79 CO -0.01 0.03 0.24 0.74 -0.69 0.00 0.00 178.15 178.46 3hsy h THR 80 N 0.10 1.14 -0.25 -0.27 2.02 -1.02 0.87 112.91 115.49 3hsy h THR 80 Ca 0.03 -0.35 -0.09 0.00 0.77 0.00 0.00 66.41 66.76 3hsy h THR 80 Cb -0.00 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.04 3hsy h THR 80 CO -0.01 0.15 -0.21 -1.28 0.37 0.00 0.00 175.52 174.54 3hsy h SER 81 N 0.54 0.61 -0.37 4.18 0.87 -1.07 -1.60 113.55 116.71 3hsy h SER 81 Ca 0.15 -0.46 -0.06 0.00 -1.23 0.00 0.00 61.79 60.18 3hsy h SER 81 Cb 0.03 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 3hsy h SER 81 CO -0.03 0.94 -0.02 -0.26 -0.53 0.00 0.00 176.83 176.93 3hsy h PHE 82 N 0.29 0.73 -0.39 2.24 -1.00 -0.88 -1.00 116.94 116.93 3hsy h PHE 82 Ca 0.04 -0.14 0.05 0.00 2.81 0.00 0.00 57.97 60.73 3hsy h PHE 82 Cb 0.75 -0.19 -0.04 0.00 3.61 0.00 0.00 35.95 40.08 3hsy h PHE 82 CO 0.07 0.78 0.14 0.00 -1.61 0.00 0.00 178.31 177.69 3hsy h GLY 84 N 0.30 0.65 0.54 0.00 0.00 -1.18 0.15 103.07 103.53 3hsy h GLY 84 Ca 0.18 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 3hsy h GLY 84 CO -0.18 0.46 -0.08 -0.84 0.00 0.00 0.00 176.54 175.90 3hsy h THR 85 N 0.53 1.42 -0.01 4.70 2.02 -0.92 -3.33 112.91 117.33 3hsy h THR 85 Ca 0.09 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 65.88 3hsy h THR 85 Cb 0.62 2.24 0.00 0.00 -1.74 0.00 0.00 68.15 69.28 3hsy h THR 85 CO 0.04 0.38 -0.39 0.18 0.37 0.00 0.00 175.52 176.10 3hsy n LEU 86 N -4.70 1.00 -2.98 2.58 4.77 -0.20 -4.88 117.00 112.59 3hsy n LEU 86 Ca -0.08 -0.26 -0.22 0.00 -0.03 0.00 0.00 56.01 55.42 3hsy n LEU 86 Cb 0.33 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.33 3hsy n LEU 86 CO 0.36 0.20 0.05 1.41 -1.33 0.00 0.00 177.39 178.08 3hsy n HIS 87 N -0.85 -2.05 -3.85 -1.77 8.25 0.50 -4.66 115.22 110.80 3hsy n HIS 87 Ca 0.10 0.59 -0.35 0.00 -0.26 0.00 0.00 57.72 57.80 3hsy n HIS 87 Cb 0.36 -4.44 -0.10 0.00 1.12 0.00 0.00 29.99 26.93 3hsy n HIS 87 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3hsy s VAL 88 N -3.18 4.99 0.12 1.59 1.01 -1.07 -4.47 120.40 119.39 3hsy s VAL 88 Ca 0.34 0.04 -0.27 0.00 0.00 0.00 0.00 61.98 62.10 3hsy s VAL 88 Cb -0.15 -3.28 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 3hsy s VAL 88 CO 0.42 0.41 0.83 -0.44 0.00 0.00 0.00 175.10 176.33 3hsy s SER 89 N 0.69 7.37 -0.22 3.32 0.01 -1.26 -4.54 113.70 119.07 3hsy s SER 89 Ca 0.05 1.63 -0.01 0.00 1.31 0.00 0.00 55.95 58.94 3hsy s SER 89 Cb -0.13 -2.52 0.02 0.00 0.21 0.00 0.00 66.02 63.60 3hsy s SER 89 CO 0.01 0.07 -0.12 0.12 0.41 0.00 0.00 173.24 173.74 3hsy s PHE 90 N -0.49 2.95 -0.19 2.43 5.36 -0.06 -0.53 117.98 127.46 3hsy s PHE 90 Ca 0.40 -1.54 -0.07 0.00 -0.96 0.00 0.00 56.93 54.76 3hsy s PHE 90 Cb -0.22 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.42 3hsy s PHE 90 CO 0.26 -0.74 0.05 0.42 -1.46 0.00 0.00 175.22 173.75 3hsy s ILE 91 N 1.32 4.60 -0.03 3.12 1.09 0.23 -0.51 121.20 131.02 3hsy s ILE 91 Ca 0.02 -0.10 -0.09 0.00 -1.10 0.00 0.00 60.65 59.39 3hsy s ILE 91 Cb -0.15 -3.07 0.01 0.00 -1.06 0.00 0.00 42.46 38.19 3hsy s ILE 91 CO -0.08 0.45 0.19 0.28 -0.10 0.00 0.00 174.94 175.69 3hsy s THR 92 N 0.50 0.05 -2.25 2.92 -1.32 -0.69 -1.27 115.64 113.57 3hsy s THR 92 Ca 0.02 -0.38 0.20 0.00 -1.21 0.00 0.00 61.69 60.32 3hsy s THR 92 Cb -0.13 -0.41 0.44 0.00 -1.51 0.00 0.00 72.50 70.89 3hsy s THR 92 CO 0.01 -0.21 1.45 -0.81 -2.21 0.00 0.00 174.62 172.85 3hsy n PRO 93 N 2.03 2.05 -1.40 7.08 -0.04 -1.25 -0.51 135.00 142.96 3hsy n PRO 93 Ca -0.18 -1.60 -0.29 0.00 -0.04 0.00 0.00 63.50 61.39 3hsy n PRO 93 Cb 0.57 -1.42 0.18 0.00 -0.04 0.00 0.00 33.50 32.79 3hsy n PRO 93 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3hsy s SER 94 N -1.37 2.60 0.33 3.54 0.01 -1.26 -4.58 113.70 112.97 3hsy s SER 94 Ca 0.34 0.83 -0.29 0.00 1.31 0.00 0.00 55.95 58.14 3hsy s SER 94 Cb 0.19 -1.27 -0.12 0.00 0.21 0.00 0.00 66.02 65.02 3hsy s SER 94 CO 0.26 -3.10 1.41 2.22 0.41 0.00 0.00 173.24 174.44 3hsy n PHE 95 N -4.11 2.56 -1.75 2.43 1.16 -1.26 -4.50 117.46 111.98 3hsy n PHE 95 Ca 0.09 0.46 -0.31 0.00 -1.87 0.00 0.00 57.45 55.82 3hsy n PHE 95 Cb 0.59 -2.48 0.03 0.00 -1.61 0.00 0.00 39.48 36.01 3hsy n PHE 95 CO 0.00 0.00 0.00 -1.25 -1.87 0.00 0.00 176.76 173.64 3hsy s PRO 96 N -1.56 3.21 0.20 3.97 0.04 -1.26 -5.04 135.00 134.56 3hsy s PRO 96 Ca 0.58 0.78 0.09 0.00 0.04 0.00 0.00 61.00 62.48 3hsy s PRO 96 Cb -0.54 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 3hsy s PRO 96 CO 0.59 -0.86 -0.18 0.95 0.04 0.00 0.00 177.00 177.55 3hsy s THR 97 N -3.15 1.94 -0.42 1.26 -4.23 -1.26 -4.91 115.64 104.86 3hsy s THR 97 Ca 0.57 -2.11 0.23 0.00 -1.18 0.00 0.00 61.69 59.20 3hsy s THR 97 Cb -0.12 -2.01 -0.11 0.00 1.34 0.00 0.00 72.50 71.60 3hsy s THR 97 CO 0.54 -0.41 0.96 0.47 -0.54 0.00 0.00 174.62 175.64 3hsy n ASP 98 N -0.09 0.59 -3.30 3.99 8.00 -1.26 -4.97 116.55 119.51 3hsy n ASP 98 Ca -0.10 -0.02 -0.25 0.00 0.71 0.00 0.00 54.79 55.13 3hsy n ASP 98 Cb 0.59 0.85 0.22 0.00 -0.02 0.00 0.00 41.12 42.76 3hsy n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hsy n GLY 99 N 1.30 -3.19 3.57 0.44 0.00 -1.26 -4.93 105.19 101.12 3hsy n GLY 99 Ca 0.01 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 3hsy n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hsy s THR 100 N -2.36 4.31 -0.53 2.61 2.01 -1.26 -4.95 115.64 115.47 3hsy s THR 100 Ca 0.58 0.85 0.05 0.00 0.31 0.00 0.00 61.69 63.48 3hsy s THR 100 Cb -0.07 -4.54 0.19 0.00 0.01 0.00 0.00 72.50 68.09 3hsy s THR 100 CO 0.46 -1.00 0.47 0.00 -0.69 0.00 0.00 174.62 173.86 3hsy n HIS 101 N 7.59 1.05 -1.64 4.92 1.44 -1.26 -5.09 115.22 122.23 3hsy n HIS 101 Ca 0.08 -3.77 -0.39 0.00 -2.01 0.00 0.00 57.72 51.62 3hsy n HIS 101 Cb 0.49 -0.21 0.03 0.00 0.12 0.00 0.00 29.99 30.42 3hsy n HIS 101 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 3hsy n PRO 102 N 2.09 1.28 -1.07 -1.40 -0.02 -1.26 -2.61 135.00 132.02 3hsy n PRO 102 Ca 0.25 0.47 -0.02 0.00 -2.02 0.00 0.00 63.50 62.18 3hsy n PRO 102 Cb 0.44 -2.21 -0.01 0.00 -0.02 0.00 0.00 33.50 31.70 3hsy n PRO 102 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3hsy n PHE 103 N -1.05 0.00 -4.27 6.00 3.72 -1.26 -4.24 117.46 116.35 3hsy n PHE 103 Ca 0.11 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.19 3hsy n PHE 103 Cb 0.43 -0.83 -0.16 0.00 -0.94 0.00 0.00 39.48 37.98 3hsy n PHE 103 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3hsy s VAL 104 N -1.94 1.88 -0.30 -4.37 1.01 -1.07 -0.88 120.40 114.73 3hsy s VAL 104 Ca 0.00 -0.84 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 3hsy s VAL 104 Cb 0.00 -1.70 0.01 0.00 0.00 0.00 0.00 36.38 34.69 3hsy s VAL 104 CO 0.00 0.51 0.09 -0.63 0.00 0.00 0.00 175.10 175.07 3hsy s ILE 105 N 1.18 4.02 -0.47 2.22 1.09 0.34 -4.31 121.20 125.27 3hsy s ILE 105 Ca 0.01 -0.67 -0.14 0.00 -1.10 0.00 0.00 60.65 58.74 3hsy s ILE 105 Cb -0.14 -3.07 0.08 0.00 -1.06 0.00 0.00 42.46 38.27 3hsy s ILE 105 CO -0.08 0.08 0.38 -1.10 -0.10 0.00 0.00 174.94 174.11 3hsy s GLN 106 N 1.51 2.92 0.46 2.79 -0.21 0.34 -1.71 119.66 125.76 3hsy s GLN 106 Ca 0.03 -1.38 0.23 0.00 0.02 0.00 0.00 55.36 54.25 3hsy s GLN 106 Cb -0.17 -4.08 1.12 0.00 1.00 0.00 0.00 33.01 30.88 3hsy s GLN 106 CO 0.03 -1.03 1.94 0.52 -2.12 0.00 0.00 175.29 174.64 3hsy h MET 107 N 8.70 0.00 -5.78 2.91 2.86 -1.09 -3.33 114.93 119.21 3hsy h MET 107 Ca -0.28 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 56.77 3hsy h MET 107 Cb 1.11 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.68 3hsy h MET 107 CO 0.86 0.21 0.41 0.50 1.06 0.00 0.00 176.91 179.96 3hsy s ARG 108 N -4.06 4.20 0.57 1.72 3.52 -1.26 -4.91 118.95 118.73 3hsy s ARG 108 Ca -0.02 0.90 -0.20 0.00 -0.13 0.00 0.00 55.73 56.28 3hsy s ARG 108 Cb 0.13 -3.63 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 3hsy s ARG 108 CO 0.64 -0.47 1.28 -2.14 -0.81 0.00 0.00 175.30 173.80 3hsy s PRO 109 N 2.66 3.05 0.19 5.12 0.02 -1.26 -4.56 135.00 140.22 3hsy s PRO 109 Ca 0.34 2.02 -0.30 0.00 0.02 0.00 0.00 61.00 63.08 3hsy s PRO 109 Cb -0.15 -2.10 -0.09 0.00 0.02 0.00 0.00 34.50 32.18 3hsy s PRO 109 CO 0.08 -1.20 1.36 0.34 -0.33 0.00 0.00 177.00 177.26 3hsy s ASP 110 N -1.28 6.82 0.00 2.53 2.15 -1.26 -4.90 116.67 120.73 3hsy s ASP 110 Ca 0.75 2.46 0.22 0.00 0.43 0.00 0.00 52.55 56.40 3hsy s ASP 110 Cb -0.35 -2.61 -0.20 0.00 -0.30 0.00 0.00 42.92 39.46 3hsy s ASP 110 CO 0.40 -0.60 0.79 -0.11 -0.17 0.00 0.00 175.17 175.48 3hsy n LEU 111 N 2.83 0.57 -0.18 -1.34 7.94 -1.26 -4.62 117.00 120.95 3hsy n LEU 111 Ca 0.07 -0.22 -0.03 0.00 -1.11 0.00 0.00 56.01 54.73 3hsy n LEU 111 Cb 0.42 -0.02 0.07 0.00 0.53 0.00 0.00 43.42 44.42 3hsy n LEU 111 CO 0.59 0.12 0.99 0.11 -1.11 0.00 0.00 177.39 178.09 3hsy h LYS 112 N 0.00 0.41 -0.65 1.96 1.57 -1.99 -0.87 116.57 117.01 3hsy h LYS 112 Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3hsy h LYS 112 Cb 0.72 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 3hsy h LYS 112 CO 0.00 0.27 0.35 0.78 -0.57 0.00 0.00 179.45 180.28 3hsy h GLY 113 N 0.43 0.98 1.41 3.86 0.00 -2.00 -1.01 103.07 106.73 3hsy h GLY 113 Ca 0.25 -0.45 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 3hsy h GLY 113 CO -0.23 0.43 -0.22 0.00 0.00 0.00 0.00 176.54 176.53 3hsy h ALA 114 N 1.16 0.96 -0.05 3.60 0.00 -1.69 -1.66 119.26 121.58 3hsy h ALA 114 Ca 0.23 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3hsy h ALA 114 Cb 0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3hsy h ALA 114 CO -0.03 0.61 0.01 1.25 0.00 0.00 0.00 179.25 181.08 3hsy h LEU 115 N 0.61 0.07 -0.76 0.00 5.85 -0.82 -1.02 115.31 119.23 3hsy h LEU 115 Ca 0.09 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.61 3hsy h LEU 115 Cb 0.69 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 3hsy h LEU 115 CO 0.05 0.30 0.47 -0.07 -0.34 0.00 0.00 178.44 178.85 3hsy h LEU 116 N -0.16 0.76 -1.30 2.25 3.38 -1.12 -1.53 115.31 117.59 3hsy h LEU 116 Ca 0.01 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3hsy h LEU 116 Cb 0.26 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3hsy h LEU 116 CO 0.00 0.51 0.06 0.28 0.09 0.00 0.00 178.44 179.38 3hsy h SER 117 N 0.90 0.50 -0.23 -0.43 0.02 -1.15 -2.51 113.55 110.64 3hsy h SER 117 Ca 0.32 -0.08 -0.18 0.00 -0.84 0.00 0.00 61.79 61.02 3hsy h SER 117 Cb 0.09 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.50 3hsy h SER 117 CO -0.14 0.52 -0.54 0.25 -1.14 0.00 0.00 176.83 175.78 3hsy h LEU 118 N 0.53 0.88 -0.79 5.07 5.85 -0.47 -0.46 115.31 125.91 3hsy h LEU 118 Ca 0.12 -0.56 0.07 0.00 0.84 0.00 0.00 57.88 58.35 3hsy h LEU 118 Cb 0.24 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 3hsy h LEU 118 CO 0.00 1.28 0.46 0.40 -0.34 0.00 0.00 178.44 180.24 3hsy h ILE 119 N 0.51 0.97 -0.27 4.05 2.04 -1.16 -1.58 117.51 122.08 3hsy h ILE 119 Ca -0.00 -0.28 -0.14 0.00 1.00 0.00 0.00 64.86 65.44 3hsy h ILE 119 Cb 1.16 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3hsy h ILE 119 CO 0.12 0.15 -0.39 -0.33 0.00 0.00 0.00 178.15 177.70 3hsy h GLU 120 N 0.83 0.63 -0.69 2.37 5.08 -1.29 -1.98 114.58 119.53 3hsy h GLU 120 Ca 0.36 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 3hsy h GLU 120 Cb 0.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3hsy h GLU 120 CO -0.20 0.92 0.23 -0.92 -1.00 0.00 0.00 179.01 178.03 3hsy h TYR 121 N 0.52 1.07 -0.00 4.33 3.20 -0.48 -1.52 116.97 124.09 3hsy h TYR 121 Ca 0.05 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.82 3hsy h TYR 121 Cb 0.91 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.86 3hsy h TYR 121 CO 0.04 0.84 -0.02 0.66 -1.64 0.00 0.00 178.16 178.05 3hsy n TYR 122 N -4.27 0.00 -3.05 -3.82 4.01 -0.65 -4.92 117.16 104.47 3hsy n TYR 122 Ca 0.06 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.58 3hsy n TYR 122 Cb 0.21 -0.07 0.02 0.00 -0.31 0.00 0.00 39.34 39.19 3hsy n TYR 122 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3hsy n GLN 123 N -0.85 -4.24 -2.26 -0.72 6.02 -0.57 -4.96 117.38 109.80 3hsy n GLN 123 Ca 0.20 0.79 -0.41 0.00 -0.01 0.00 0.00 57.00 57.57 3hsy n GLN 123 Cb 0.20 -5.60 -0.03 0.00 1.02 0.00 0.00 30.24 25.83 3hsy n GLN 123 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 3hsy s TRP 124 N -3.08 3.28 0.00 1.08 0.52 -0.78 -4.90 118.94 115.06 3hsy s TRP 124 Ca 0.30 1.36 0.00 0.00 0.02 0.00 0.00 56.10 57.78 3hsy s TRP 124 Cb -0.14 -3.55 0.00 0.00 -1.15 0.00 0.00 33.47 28.63 3hsy s TRP 124 CO 0.37 -1.59 0.16 -0.40 0.02 0.00 0.00 176.95 175.51 3hsy n ASP 125 N 2.02 0.32 -3.66 2.95 5.68 -1.26 -4.79 116.55 117.82 3hsy n ASP 125 Ca 0.04 -0.69 -0.17 0.00 -0.50 0.00 0.00 54.79 53.47 3hsy n ASP 125 Cb 0.43 0.26 -0.16 0.00 -1.14 0.00 0.00 41.12 40.51 3hsy n ASP 125 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 3hsy s LYS 126 N -0.26 0.03 0.16 0.11 2.20 -1.26 -0.43 119.74 120.29 3hsy s LYS 126 Ca 0.00 0.53 -0.24 0.00 -0.36 0.00 0.00 55.97 55.90 3hsy s LYS 126 Cb 0.00 -0.33 0.06 0.00 -1.51 0.00 0.00 37.83 36.05 3hsy s LYS 126 CO 0.00 -0.32 0.84 -0.59 -0.36 0.00 0.00 175.35 174.92 3hsy s PHE 127 N 2.28 -0.23 -0.02 4.03 -0.12 -0.73 -4.69 117.98 118.49 3hsy s PHE 127 Ca 0.03 -0.07 -0.02 0.00 -0.05 0.00 0.00 56.93 56.82 3hsy s PHE 127 Cb -0.12 0.63 -0.04 0.00 -0.63 0.00 0.00 43.02 42.86 3hsy s PHE 127 CO -0.06 -0.89 0.10 0.00 -0.05 0.00 0.00 175.22 174.32 3hsy s ALA 128 N -3.48 3.65 -0.31 1.99 0.00 -0.46 -1.26 121.76 121.90 3hsy s ALA 128 Ca 0.09 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.26 3hsy s ALA 128 Cb -0.02 -1.66 0.08 0.00 0.00 0.00 0.00 23.12 21.52 3hsy s ALA 128 CO -0.00 0.69 -0.01 -0.47 0.00 0.00 0.00 175.76 175.96 3hsy s TYR 129 N -1.18 3.57 -0.31 0.00 5.04 0.62 -0.68 117.35 124.41 3hsy s TYR 129 Ca 0.22 -2.74 -0.10 0.00 -2.44 0.00 0.00 57.07 52.01 3hsy s TYR 129 Cb -0.12 -2.55 -0.01 0.00 0.35 0.00 0.00 41.96 39.63 3hsy s TYR 129 CO 0.13 -0.92 0.17 -0.51 -1.34 0.00 0.00 175.55 173.08 3hsy s LEU 130 N 0.98 4.18 0.11 6.97 1.43 -0.08 -1.38 118.68 130.89 3hsy s LEU 130 Ca 0.03 -0.48 -0.01 0.00 -1.03 0.00 0.00 54.13 52.64 3hsy s LEU 130 Cb -0.19 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 3hsy s LEU 130 CO -0.07 -0.19 0.03 -0.72 0.23 0.00 0.00 176.35 175.63 3hsy s TYR 131 N 1.64 0.78 0.36 0.29 -0.85 -0.62 -1.06 117.35 117.90 3hsy s TYR 131 Ca 0.05 -1.18 0.04 0.00 -0.52 0.00 0.00 57.07 55.46 3hsy s TYR 131 Cb -0.17 -0.46 -0.05 0.00 0.38 0.00 0.00 41.96 41.65 3hsy s TYR 131 CO 0.07 -0.46 0.06 0.16 -1.52 0.00 0.00 175.55 173.86 3hsy s ASP 132 N -3.02 2.72 -0.04 -0.18 1.47 -0.53 -0.26 116.67 116.82 3hsy s ASP 132 Ca 0.19 -1.46 0.13 0.00 1.18 0.00 0.00 52.55 52.59 3hsy s ASP 132 Cb 0.08 0.05 0.44 0.00 -0.34 0.00 0.00 42.92 43.15 3hsy s ASP 132 CO -0.01 -0.68 1.33 -1.54 0.68 0.00 0.00 175.17 174.95 3hsy n SER 133 N -0.88 2.93 0.29 2.11 3.41 -1.26 -4.47 113.62 115.74 3hsy n SER 133 Ca -0.04 -2.16 0.18 0.00 -0.26 0.00 0.00 58.87 56.59 3hsy n SER 133 Cb 0.66 -0.40 0.81 0.00 -0.26 0.00 0.00 64.21 65.03 3hsy n SER 133 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3hsy h ASP 134 N 2.69 0.00 -0.44 4.04 5.19 -1.97 -2.45 116.42 123.49 3hsy h ASP 134 Ca 0.00 0.00 -0.32 0.00 -0.62 0.00 0.00 57.03 56.09 3hsy h ASP 134 Cb 0.85 0.00 -0.27 0.00 0.18 0.00 0.00 39.33 40.09 3hsy h ASP 134 CO 0.09 0.01 -0.72 0.54 -3.12 0.00 0.00 179.24 176.03 3hsy n ARG 135 N -3.10 2.69 0.00 3.56 3.00 -1.26 -4.41 116.66 117.13 3hsy n ARG 135 Ca -0.00 -3.77 0.00 0.00 -0.01 0.00 0.00 57.85 54.07 3hsy n ARG 135 Cb 0.25 -1.95 0.00 0.00 0.00 0.00 0.00 32.46 30.76 3hsy n ARG 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3hsy n GLY 136 N -0.83 -0.11 0.37 -0.13 0.00 -0.92 -4.79 105.19 98.78 3hsy n GLY 136 Ca 0.32 -1.79 0.03 0.00 0.00 0.00 0.00 46.02 44.58 3hsy n GLY 136 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hsy n LEU 137 N -1.01 2.55 0.06 0.99 4.77 -1.26 -4.63 117.00 118.47 3hsy n LEU 137 Ca 0.00 -2.01 0.02 0.00 -0.03 0.00 0.00 56.01 53.99 3hsy n LEU 137 Cb 0.00 -0.14 0.38 0.00 -2.33 0.00 0.00 43.42 41.33 3hsy n LEU 137 CO 0.00 0.63 0.97 0.77 -1.33 0.00 0.00 177.39 178.44 3hsy h SER 138 N 1.17 0.35 -0.22 -1.43 4.64 -1.96 -1.41 113.55 114.70 3hsy h SER 138 Ca 0.00 -0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.14 3hsy h SER 138 Cb 0.64 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3hsy h SER 138 CO 0.00 0.41 -0.38 0.74 -0.87 0.00 0.00 176.83 176.73 3hsy h THR 139 N 0.37 1.32 -0.35 2.95 2.02 -1.90 -0.01 112.91 117.31 3hsy h THR 139 Ca 0.09 -1.59 0.07 0.00 0.77 0.00 0.00 66.41 65.75 3hsy h THR 139 Cb 0.24 1.80 -0.07 0.00 -1.74 0.00 0.00 68.15 68.38 3hsy h THR 139 CO 0.01 0.50 -0.11 0.25 0.37 0.00 0.00 175.52 176.53 3hsy h LEU 140 N 0.34 -0.39 -1.00 2.58 5.85 -1.79 -0.58 115.31 120.32 3hsy h LEU 140 Ca 0.02 0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 3hsy h LEU 140 Cb 0.97 0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 3hsy h LEU 140 CO 0.09 -0.14 0.40 1.56 -0.34 0.00 0.00 178.44 180.01 3hsy h GLN 141 N -0.03 1.11 -0.56 1.25 4.20 -0.98 -1.23 115.11 118.87 3hsy h GLN 141 Ca 0.17 -0.14 -0.11 0.00 0.06 0.00 0.00 58.65 58.63 3hsy h GLN 141 Cb 0.29 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 3hsy h GLN 141 CO -0.38 0.84 -0.06 0.00 -0.67 0.00 0.00 178.83 178.56 3hsy h ALA 142 N 1.33 0.76 -0.51 3.87 0.00 -0.48 0.30 119.26 124.53 3hsy h ALA 142 Ca 0.28 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3hsy h ALA 142 Cb 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3hsy h ALA 142 CO -0.04 0.65 0.14 0.28 0.00 0.00 0.00 179.25 180.28 3hsy h VAL 143 N 0.92 1.23 -0.62 0.00 2.07 -0.75 -1.59 116.25 117.52 3hsy h VAL 143 Ca 0.15 -0.81 -0.06 0.00 0.82 0.00 0.00 66.70 66.80 3hsy h VAL 143 Cb 0.63 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 3hsy h VAL 143 CO 0.04 0.29 0.14 -0.07 0.02 0.00 0.00 177.57 177.99 3hsy h LEU 144 N 0.70 0.95 -0.07 2.57 3.38 -1.05 0.32 115.31 122.11 3hsy h LEU 144 Ca 0.16 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3hsy h LEU 144 Cb 0.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3hsy h LEU 144 CO -0.00 0.94 0.02 0.44 0.09 0.00 0.00 178.44 179.93 3hsy h ASP 145 N 0.91 0.01 0.04 -0.43 3.32 -0.82 -2.75 116.42 116.70 3hsy h ASP 145 Ca 0.19 0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.16 3hsy h ASP 145 Cb 0.38 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 3hsy h ASP 145 CO 0.00 0.02 -0.27 0.28 -1.72 0.00 0.00 179.24 177.55 3hsy h SER 146 N 0.05 0.36 -0.15 6.45 0.02 -1.17 -2.75 113.55 116.37 3hsy h SER 146 Ca 0.03 -0.12 0.03 0.00 -0.84 0.00 0.00 61.79 60.89 3hsy h SER 146 Cb 0.02 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 3hsy h SER 146 CO -0.04 0.64 -0.02 0.00 -1.14 0.00 0.00 176.83 176.27 3hsy h ALA 147 N 1.39 0.12 -0.12 3.77 0.00 -0.73 0.13 119.26 123.81 3hsy h ALA 147 Ca 0.05 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3hsy h ALA 147 Cb 0.65 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 3hsy h ALA 147 CO 0.05 -0.46 -0.28 0.00 0.00 0.00 0.00 179.25 178.56 3hsy h ALA 148 N 1.14 1.31 -0.05 0.00 0.00 -1.40 0.19 119.26 120.45 3hsy h ALA 148 Ca 0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 3hsy h ALA 148 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3hsy h ALA 148 CO -0.13 0.47 -0.09 1.49 0.00 0.00 0.00 179.25 180.99 3hsy h GLU 149 N 0.21 0.14 -0.56 0.00 4.57 -1.15 -3.33 114.58 114.46 3hsy h GLU 149 Ca 0.03 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3hsy h GLU 149 Cb 0.60 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 3hsy h GLU 149 CO 0.04 0.67 0.00 1.63 -1.18 0.00 0.00 179.01 180.18 3hsy n LYS 150 N -4.69 2.57 -3.36 1.92 5.02 -0.01 -4.95 118.16 114.66 3hsy n LYS 150 Ca -0.08 -2.41 -0.17 0.00 -2.02 0.00 0.00 58.31 53.63 3hsy n LYS 150 Cb 0.34 -1.53 0.08 0.00 -0.02 0.00 0.00 35.03 33.90 3hsy n LYS 150 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3hsy n LYS 151 N 1.52 -6.38 -3.27 1.97 5.02 -0.15 -5.01 118.16 111.86 3hsy n LYS 151 Ca 0.22 0.79 -0.36 0.00 -2.02 0.00 0.00 58.31 56.94 3hsy n LYS 151 Cb 0.60 -5.66 -0.06 0.00 -0.02 0.00 0.00 35.03 29.89 3hsy n LYS 151 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3hsy s TRP 152 N -3.33 3.65 -0.44 2.13 0.51 0.50 -4.94 118.94 117.02 3hsy s TRP 152 Ca 0.07 1.19 -0.12 0.00 -2.12 0.00 0.00 56.10 55.12 3hsy s TRP 152 Cb -0.03 -2.46 0.07 0.00 -0.81 0.00 0.00 33.47 30.25 3hsy s TRP 152 CO 0.68 0.43 0.32 -0.65 -0.51 0.00 0.00 176.95 177.22 3hsy s GLN 153 N -1.81 2.77 -0.13 4.98 -0.21 0.43 -4.66 119.66 121.02 3hsy s GLN 153 Ca 0.38 -1.40 -0.01 0.00 0.02 0.00 0.00 55.36 54.34 3hsy s GLN 153 Cb -0.16 -3.93 -0.02 0.00 1.00 0.00 0.00 33.01 29.89 3hsy s GLN 153 CO 0.20 -0.98 -0.10 0.08 -2.12 0.00 0.00 175.29 172.37 3hsy s VAL 154 N 1.52 3.38 -0.45 1.09 1.01 -1.26 -1.78 120.40 123.92 3hsy s VAL 154 Ca 0.03 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 3hsy s VAL 154 Cb -0.23 -2.44 0.06 0.00 0.00 0.00 0.00 36.38 33.76 3hsy s VAL 154 CO 0.04 0.52 0.36 -0.89 0.00 0.00 0.00 175.10 175.13 3hsy s THR 155 N 0.25 5.18 -0.38 3.92 2.01 -0.39 -4.98 115.64 121.26 3hsy s THR 155 Ca -0.07 -0.95 -0.08 0.00 0.31 0.00 0.00 61.69 60.91 3hsy s THR 155 Cb -0.15 -4.03 0.05 0.00 0.01 0.00 0.00 72.50 68.39 3hsy s THR 155 CO 0.04 -0.48 0.18 0.00 -0.69 0.00 0.00 174.62 173.67 3hsy s ALA 156 N 1.64 3.18 -0.10 7.40 0.00 -1.26 -0.28 121.76 132.34 3hsy s ALA 156 Ca 0.04 -1.93 0.03 0.00 0.00 0.00 0.00 51.96 50.11 3hsy s ALA 156 Cb -0.22 -2.47 0.01 0.00 0.00 0.00 0.00 23.12 20.43 3hsy s ALA 156 CO 0.07 -1.48 -0.19 0.42 0.00 0.00 0.00 175.76 174.58 3hsy s ILE 157 N 1.42 1.75 -0.60 0.00 1.01 -0.48 -4.99 121.20 119.32 3hsy s ILE 157 Ca 0.01 -0.83 -0.28 0.00 0.00 0.00 0.00 60.65 59.56 3hsy s ILE 157 Cb -0.21 -1.55 0.03 0.00 0.01 0.00 0.00 42.46 40.74 3hsy s ILE 157 CO 0.03 0.49 1.19 0.21 0.00 0.00 0.00 174.94 176.86 3hsy s ASN 158 N 0.61 6.41 0.00 3.58 2.47 -1.26 -1.58 114.94 125.16 3hsy s ASN 158 Ca -0.14 0.02 0.28 0.00 0.42 0.00 0.00 52.86 53.45 3hsy s ASN 158 Cb -0.17 -2.55 1.15 0.00 -1.45 0.00 0.00 41.25 38.23 3hsy s ASN 158 CO 0.04 -1.51 1.80 1.33 -3.72 0.00 0.00 177.10 175.04 3hsy n VAL 159 N 6.62 0.00 0.34 -5.21 0.24 0.64 -4.30 118.33 116.66 3hsy n VAL 159 Ca 0.08 -0.20 0.15 0.00 -2.04 0.00 0.00 64.34 62.32 3hsy n VAL 159 Cb 0.49 0.34 0.54 0.00 -1.47 0.00 0.00 33.84 33.74 3hsy n VAL 159 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3hsy h GLY 160 N 4.88 0.00 -1.53 7.63 0.00 -1.89 -3.06 103.07 109.10 3hsy h GLY 160 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3hsy h GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 3hsy n ASN 161 N -2.73 3.11 -4.70 0.19 3.02 -1.26 -5.00 115.26 107.89 3hsy n ASN 161 Ca 0.02 -2.00 -0.42 0.00 -0.03 0.00 0.00 54.58 52.15 3hsy n ASN 161 Cb 0.32 -0.28 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 3hsy n ASN 161 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hsy s ILE 162 N -1.00 3.70 -1.59 2.41 1.01 -1.16 -5.23 121.20 119.33 3hsy s ILE 162 Ca 0.28 1.14 0.17 0.00 0.00 0.00 0.00 60.65 62.24 3hsy s ILE 162 Cb 0.14 -3.73 0.35 0.00 0.01 0.00 0.00 42.46 39.24 3hsy s ILE 162 CO 0.19 0.03 1.48 -3.20 0.00 0.00 0.00 174.94 173.44 3hsy n ASN 163 N 4.82 0.00 -1.35 3.58 2.85 -1.26 -5.16 115.26 118.75 3hsy n ASN 163 Ca 0.12 -0.13 -0.09 0.00 -0.11 0.00 0.00 54.58 54.37 3hsy n ASN 163 Cb 0.44 -0.20 0.15 0.00 1.24 0.00 0.00 39.78 41.40 3hsy n ASN 163 CO 0.00 0.00 0.00 -2.11 -2.11 0.00 0.00 177.26 173.04 3hsy n ARG 184 N -1.20 2.27 -3.63 1.20 1.85 -1.26 -5.29 116.66 110.59 3hsy n ARG 184 Ca 0.09 -3.46 -0.37 0.00 -1.00 0.00 0.00 57.85 53.11 3hsy n ARG 184 Cb 0.11 -1.92 -0.11 0.00 -1.05 0.00 0.00 32.46 29.49 3hsy n ARG 184 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 3hsy s ARG 185 N -3.38 3.95 -0.04 2.89 0.52 -1.26 -0.81 118.95 120.82 3hsy s ARG 185 Ca 0.46 -0.33 -0.01 0.00 -0.52 0.00 0.00 55.73 55.34 3hsy s ARG 185 Cb 0.41 -3.59 0.03 0.00 0.52 0.00 0.00 34.95 32.32 3hsy s ARG 185 CO -0.01 -0.11 0.02 0.08 0.02 0.00 0.00 175.30 175.30 3hsy s VAL 186 N 1.55 0.07 -0.19 3.52 1.01 -0.35 -1.35 120.40 124.66 3hsy s VAL 186 Ca 0.07 0.22 -0.12 0.00 0.00 0.00 0.00 61.98 62.15 3hsy s VAL 186 Cb -0.15 -0.23 -0.05 0.00 0.00 0.00 0.00 36.38 35.95 3hsy s VAL 186 CO 0.08 0.16 0.20 -0.63 0.00 0.00 0.00 175.10 174.91 3hsy s ILE 187 N 1.49 5.37 -0.29 2.22 1.01 0.14 -0.64 121.20 130.50 3hsy s ILE 187 Ca -0.03 0.33 -0.05 0.00 0.00 0.00 0.00 60.65 60.90 3hsy s ILE 187 Cb -0.13 -3.54 0.02 0.00 0.01 0.00 0.00 42.46 38.83 3hsy s ILE 187 CO -0.03 0.41 0.03 -0.76 0.00 0.00 0.00 174.94 174.60 3hsy s LEU 188 N 0.45 3.72 -0.58 2.97 1.43 -0.01 -0.90 118.68 125.75 3hsy s LEU 188 Ca 0.11 -0.88 0.06 0.00 -1.03 0.00 0.00 54.13 52.39 3hsy s LEU 188 Cb -0.12 -1.79 0.23 0.00 0.03 0.00 0.00 46.19 44.54 3hsy s LEU 188 CO 0.01 -0.20 0.63 -0.67 0.23 0.00 0.00 176.35 176.35 3hsy n ASP 189 N 4.77 2.60 -3.54 2.29 -0.08 -0.22 -1.05 116.55 121.31 3hsy n ASP 189 Ca -0.15 -3.18 -0.12 0.00 -1.51 0.00 0.00 54.79 49.84 3hsy n ASP 189 Cb 0.47 -0.67 -0.04 0.00 2.34 0.00 0.00 41.12 43.21 3hsy n ASP 189 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hsy n GLU 191 N -0.48 1.06 -0.28 0.00 -0.58 -1.26 -4.79 120.64 114.32 3hsy n GLU 191 Ca -0.01 0.41 0.07 0.00 -0.42 0.00 0.00 57.16 57.21 3hsy n GLU 191 Cb 0.62 -2.29 0.30 0.00 -0.57 0.00 0.00 31.44 29.50 3hsy n GLU 191 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hsy h ARG 192 N 0.65 0.85 -0.99 3.49 3.08 -2.01 -1.09 114.38 118.36 3hsy h ARG 192 Ca -0.49 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 59.55 3hsy h ARG 192 Cb 1.35 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 31.15 3hsy h ARG 192 CO 0.52 0.56 0.65 -0.44 -1.07 0.00 0.00 179.97 180.19 3hsy h ASP 193 N 0.87 1.08 0.55 7.04 3.32 -2.01 -2.62 116.42 124.65 3hsy h ASP 193 Ca 0.40 -0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.29 3hsy h ASP 193 Cb 0.40 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3hsy h ASP 193 CO -0.17 0.73 -0.70 0.11 -1.72 0.00 0.00 179.24 177.50 3hsy h LYS 194 N 1.25 0.13 -0.27 3.56 1.57 -1.55 -2.48 116.57 118.77 3hsy h LYS 194 Ca 0.40 -0.10 0.05 0.00 -1.87 0.00 0.00 60.65 59.12 3hsy h LYS 194 Cb 0.02 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 3hsy h LYS 194 CO -0.13 0.77 0.00 0.28 -0.57 0.00 0.00 179.45 179.81 3hsy h VAL 195 N 0.08 0.81 0.03 0.50 2.07 -1.10 0.43 116.25 119.07 3hsy h VAL 195 Ca -0.01 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.49 3hsy h VAL 195 Cb 1.24 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 3hsy h VAL 195 CO 0.10 0.01 -0.08 -1.13 0.02 0.00 0.00 177.57 176.49 3hsy h ASN 196 N 0.08 -0.23 -0.71 0.57 -0.73 -1.34 -0.70 115.58 112.52 3hsy h ASN 196 Ca 0.13 0.03 0.08 0.00 1.87 0.00 0.00 56.30 58.40 3hsy h ASN 196 Cb 0.16 0.09 -0.06 0.00 0.27 0.00 0.00 38.32 38.79 3hsy h ASN 196 CO -0.21 -0.12 0.39 0.44 -0.37 0.00 0.00 177.43 177.55 3hsy h ASP 197 N -0.16 0.55 0.00 1.15 5.19 -1.19 0.14 116.42 122.10 3hsy h ASP 197 Ca 0.02 0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.48 3hsy h ASP 197 Cb 0.18 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.63 3hsy h ASP 197 CO -0.06 0.34 -0.00 0.40 -3.12 0.00 0.00 179.24 176.79 3hsy h ILE 198 N 0.68 1.33 -0.54 0.35 2.04 -0.47 -2.12 117.51 118.78 3hsy h ILE 198 Ca 0.33 -1.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 3hsy h ILE 198 Cb 0.27 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 3hsy h ILE 198 CO -0.22 0.26 0.25 0.58 0.00 0.00 0.00 178.15 179.02 3hsy h VAL 199 N -0.43 1.20 -0.98 1.67 2.07 -1.01 -1.72 116.25 117.05 3hsy h VAL 199 Ca -0.00 -0.58 0.18 0.00 0.82 0.00 0.00 66.70 67.11 3hsy h VAL 199 Cb 0.43 0.59 -0.09 0.00 -1.52 0.00 0.00 31.29 30.69 3hsy h VAL 199 CO 0.00 0.23 0.61 0.44 0.02 0.00 0.00 177.57 178.88 3hsy h ASP 200 N 0.73 0.74 -0.39 0.57 5.19 -0.72 -1.38 116.42 121.16 3hsy h ASP 200 Ca 0.19 0.08 -0.08 0.00 -0.62 0.00 0.00 57.03 56.59 3hsy h ASP 200 Cb 0.13 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.57 3hsy h ASP 200 CO -0.02 0.30 -0.06 -0.61 -3.12 0.00 0.00 179.24 175.72 3hsy h GLN 201 N 0.74 0.74 -0.80 3.56 5.75 -0.62 -1.52 115.11 122.96 3hsy h GLN 201 Ca 0.54 -0.27 -0.02 0.00 -0.15 0.00 0.00 58.65 58.75 3hsy h GLN 201 Cb 0.87 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.33 3hsy h GLN 201 CO -0.31 0.86 0.43 0.28 -2.65 0.00 0.00 178.83 177.43 3hsy h VAL 202 N 0.55 1.24 -0.09 2.39 2.07 -0.74 -0.35 116.25 121.32 3hsy h VAL 202 Ca 0.10 -0.62 -0.14 0.00 0.82 0.00 0.00 66.70 66.87 3hsy h VAL 202 Cb 0.57 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3hsy h VAL 202 CO 0.03 0.27 -0.56 0.40 0.02 0.00 0.00 177.57 177.74 3hsy h ILE 203 N 1.11 1.36 -0.07 4.57 2.04 -1.29 -2.82 117.51 122.41 3hsy h ILE 203 Ca 0.28 -1.87 -0.01 0.00 1.00 0.00 0.00 64.86 64.26 3hsy h ILE 203 Cb 0.05 1.91 -0.00 0.00 -0.74 0.00 0.00 36.82 38.04 3hsy h ILE 203 CO -0.04 0.56 0.00 0.74 0.00 0.00 0.00 178.15 179.41 3hsy h THR 204 N 0.22 1.24 -0.99 -0.27 2.02 -0.73 -2.64 112.91 111.76 3hsy h THR 204 Ca 0.00 -0.76 0.21 0.00 0.77 0.00 0.00 66.41 66.63 3hsy h THR 204 Cb 1.05 1.61 -0.10 0.00 -1.74 0.00 0.00 68.15 68.97 3hsy h THR 204 CO 0.09 0.21 0.62 0.40 0.37 0.00 0.00 175.52 177.21 3hsy h ILE 205 N -0.15 0.66 -0.11 3.11 2.04 -1.04 -3.46 117.51 118.57 3hsy h ILE 205 Ca 0.02 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.62 3hsy h ILE 205 Cb 0.33 -0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 3hsy h ILE 205 CO 0.00 0.12 -0.04 0.61 0.00 0.00 0.00 178.15 178.84 3hsy n GLY 206 N -1.38 0.56 3.45 5.37 0.00 -1.00 -5.02 105.19 107.18 3hsy n GLY 206 Ca 0.23 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 45.16 3hsy n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hsy s LYS 207 N -1.78 3.56 -1.63 1.61 1.02 -1.26 -4.64 119.74 116.62 3hsy s LYS 207 Ca 0.00 -0.55 -0.16 0.00 0.02 0.00 0.00 55.97 55.28 3hsy s LYS 207 Cb 0.00 -3.42 0.12 0.00 -0.52 0.00 0.00 37.83 34.01 3hsy s LYS 207 CO 0.00 -0.26 0.81 0.72 -0.92 0.00 0.00 175.35 175.69 3hsy n HIS 208 N 4.95 -1.89 -0.27 3.18 8.25 -1.26 -4.86 115.22 123.32 3hsy n HIS 208 Ca -0.15 0.82 0.03 0.00 -0.26 0.00 0.00 57.72 58.17 3hsy n HIS 208 Cb 0.51 -3.31 0.17 0.00 1.12 0.00 0.00 29.99 28.48 3hsy n HIS 208 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3hsy h VAL 209 N -1.69 0.83 0.00 1.59 2.07 -1.88 0.64 116.25 117.82 3hsy h VAL 209 Ca -0.59 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 66.70 3hsy h VAL 209 Cb 1.38 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3hsy h VAL 209 CO 0.74 0.12 0.00 0.29 0.02 0.00 0.00 177.57 178.74 3hsy n LYS 210 N -4.83 0.10 0.00 1.57 5.02 -1.26 -3.15 118.16 115.62 3hsy n LYS 210 Ca 0.13 0.19 0.14 0.00 -2.02 0.00 0.00 58.31 56.75 3hsy n LYS 210 Cb 0.32 -1.64 0.56 0.00 -0.02 0.00 0.00 35.03 34.24 3hsy n LYS 210 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hsy n GLY 211 N 0.85 -0.13 3.85 0.72 0.00 0.22 -4.32 105.19 106.38 3hsy n GLY 211 Ca 0.05 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 3hsy n GLY 211 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hsy s TYR 212 N -2.02 3.43 -0.15 1.61 1.51 -1.19 -4.79 117.35 115.76 3hsy s TYR 212 Ca 0.38 1.35 -0.02 0.00 -1.01 0.00 0.00 57.07 57.77 3hsy s TYR 212 Cb 0.21 -2.68 0.05 0.00 -0.11 0.00 0.00 41.96 39.43 3hsy s TYR 212 CO 0.35 -0.22 0.03 -1.58 -1.11 0.00 0.00 175.55 173.01 3hsy s HIS 213 N -2.44 0.85 -0.14 2.71 2.46 0.01 -1.48 115.29 117.27 3hsy s HIS 213 Ca 0.57 -0.58 -0.09 0.00 0.47 0.00 0.00 55.06 55.43 3hsy s HIS 213 Cb -0.10 -0.93 -0.04 0.00 -0.13 0.00 0.00 32.58 31.38 3hsy s HIS 213 CO 0.27 -0.50 0.17 0.71 -2.47 0.00 0.00 174.74 172.92 3hsy s TYR 214 N 1.92 3.54 -0.21 3.88 2.02 -0.16 -1.22 117.35 127.12 3hsy s TYR 214 Ca 0.01 0.51 -0.04 0.00 -0.37 0.00 0.00 57.07 57.18 3hsy s TYR 214 Cb -0.15 -2.07 -0.02 0.00 -0.40 0.00 0.00 41.96 39.32 3hsy s TYR 214 CO -0.07 0.55 -0.02 0.42 -1.57 0.00 0.00 175.55 174.86 3hsy s ILE 215 N -0.48 3.64 -0.41 2.71 1.01 0.19 -0.56 121.20 127.30 3hsy s ILE 215 Ca 0.14 -0.41 -0.18 0.00 0.00 0.00 0.00 60.65 60.20 3hsy s ILE 215 Cb -0.12 -2.65 0.02 0.00 0.01 0.00 0.00 42.46 39.72 3hsy s ILE 215 CO 0.03 0.43 0.47 -0.63 0.00 0.00 0.00 174.94 175.23 3hsy s ILE 216 N 1.23 5.05 -1.38 2.92 -1.09 0.09 -0.83 121.20 127.18 3hsy s ILE 216 Ca 0.03 -0.21 -0.10 0.00 -2.23 0.00 0.00 60.65 58.14 3hsy s ILE 216 Cb -0.14 -4.05 0.09 0.00 -1.58 0.00 0.00 42.46 36.78 3hsy s ILE 216 CO -0.00 -0.42 2.21 0.00 -1.23 0.00 0.00 174.94 175.50 3hsy n ALA 217 N 5.70 5.97 -2.64 9.38 0.00 -0.22 -4.27 120.51 134.43 3hsy n ALA 217 Ca -0.06 -4.06 -0.11 0.00 0.00 0.00 0.00 53.44 49.21 3hsy n ALA 217 Cb 0.48 -3.14 -0.08 0.00 0.00 0.00 0.00 19.45 16.70 3hsy n ALA 217 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hsy s ASN 218 N 1.56 0.05 -0.09 0.00 2.20 -1.26 -4.80 114.94 112.59 3hsy s ASN 218 Ca 0.48 -1.16 0.14 0.00 -0.94 0.00 0.00 52.86 51.38 3hsy s ASN 218 Cb 0.14 0.47 0.56 0.00 -2.00 0.00 0.00 41.25 40.41 3hsy s ASN 218 CO -0.05 -0.97 1.43 0.18 -2.94 0.00 0.00 177.10 174.76 3hsy n LEU 219 N -0.31 3.78 -2.67 3.54 4.77 -1.26 -3.68 117.00 121.17 3hsy n LEU 219 Ca -0.00 -1.90 -0.20 0.00 -0.03 0.00 0.00 56.01 53.87 3hsy n LEU 219 Cb 0.64 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3hsy n LEU 219 CO 0.28 0.65 0.04 0.61 -1.33 0.00 0.00 177.39 177.63 3hsy n GLY 220 N 0.95 4.17 0.29 -0.72 0.00 -1.21 -3.11 105.19 105.57 3hsy n GLY 220 Ca 0.20 -2.16 0.09 0.00 0.00 0.00 0.00 46.02 44.16 3hsy n GLY 220 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3hsy h PHE 221 N 2.82 0.42 -0.62 1.61 3.57 -1.51 -0.94 116.94 122.29 3hsy h PHE 221 Ca 0.12 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.66 3hsy h PHE 221 Cb 0.96 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.64 3hsy h PHE 221 CO 0.68 -0.08 0.00 0.25 -2.23 0.00 0.00 178.31 176.92 3hsy n THR 222 N -5.12 1.90 -2.56 4.41 -2.24 -1.26 -4.50 114.28 104.91 3hsy n THR 222 Ca 0.18 -1.24 -0.41 0.00 -2.27 0.00 0.00 64.05 60.30 3hsy n THR 222 Cb 0.56 0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 3hsy n THR 222 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3hsy s ASP 223 N -0.96 6.24 0.76 3.42 1.11 -0.36 -4.84 116.67 122.04 3hsy s ASP 223 Ca 0.50 -0.71 0.00 0.00 0.18 0.00 0.00 52.55 52.53 3hsy s ASP 223 Cb 0.33 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.76 3hsy s ASP 223 CO 0.23 -1.75 0.00 0.61 1.18 0.00 0.00 175.17 175.44 3hsy n GLY 224 N 5.73 0.52 0.32 0.21 0.00 -1.26 -3.66 105.19 107.05 3hsy n GLY 224 Ca 0.10 0.69 -0.05 0.00 0.00 0.00 0.00 46.02 46.76 3hsy n GLY 224 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hsy h ASP 225 N 0.00 0.99 -0.45 1.61 3.32 -1.94 -3.30 116.42 116.65 3hsy h ASP 225 Ca 0.00 -0.12 0.06 0.00 0.02 0.00 0.00 57.03 57.00 3hsy h ASP 225 Cb 0.00 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.24 3hsy h ASP 225 CO 0.00 0.83 0.14 0.25 -1.72 0.00 0.00 179.24 178.74 3hsy h LEU 226 N 1.09 0.12 -0.42 1.55 5.85 -1.86 -2.03 115.31 119.60 3hsy h LEU 226 Ca 0.27 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.05 3hsy h LEU 226 Cb 0.08 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3hsy h LEU 226 CO -0.04 0.10 0.00 0.18 -0.34 0.00 0.00 178.44 178.34 3hsy n LEU 227 N -5.04 0.63 0.01 2.25 4.77 -1.24 -2.07 117.00 116.31 3hsy n LEU 227 Ca 0.04 -0.27 0.13 0.00 -0.03 0.00 0.00 56.01 55.88 3hsy n LEU 227 Cb 0.19 -0.05 0.48 0.00 -2.33 0.00 0.00 43.42 41.71 3hsy n LEU 227 CO 0.24 0.14 0.79 0.29 -1.33 0.00 0.00 177.39 177.52 3hsy n LYS 228 N -0.33 0.03 -2.36 3.23 5.02 -0.76 -4.87 118.16 118.12 3hsy n LYS 228 Ca 0.13 0.02 -0.41 0.00 -2.02 0.00 0.00 58.31 56.03 3hsy n LYS 228 Cb 0.15 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 33.59 3hsy n LYS 228 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hsy s ILE 229 N -3.01 3.32 -0.55 -0.18 1.01 -0.88 -4.98 121.20 115.93 3hsy s ILE 229 Ca 0.13 1.27 -0.26 0.00 0.00 0.00 0.00 60.65 61.78 3hsy s ILE 229 Cb 0.18 -3.81 0.03 0.00 0.01 0.00 0.00 42.46 38.88 3hsy s ILE 229 CO 0.59 0.28 1.07 -1.58 0.00 0.00 0.00 174.94 175.29 3hsy s GLN 230 N -1.21 3.45 0.00 2.79 2.00 -1.26 -4.87 119.66 120.56 3hsy s GLN 230 Ca 0.48 0.06 0.28 0.00 -2.00 0.00 0.00 55.36 54.17 3hsy s GLN 230 Cb -0.34 -4.02 0.96 0.00 0.80 0.00 0.00 33.01 30.41 3hsy s GLN 230 CO 0.43 -1.55 1.69 1.19 -0.50 0.00 0.00 175.29 176.55 3hsy n PHE 231 N 7.91 0.00 -1.79 1.67 3.72 -1.26 -4.79 117.46 122.91 3hsy n PHE 231 Ca 0.06 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.30 3hsy n PHE 231 Cb 0.48 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 38.95 3hsy n PHE 231 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hsy n GLY 232 N 1.22 0.82 1.53 1.37 0.00 -1.26 -2.32 105.19 106.55 3hsy n GLY 232 Ca 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3hsy n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hsy n GLY 233 N -1.05 0.76 3.72 -0.02 0.00 -1.26 -4.18 105.19 103.15 3hsy n GLY 233 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 3hsy n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hsy s ALA 234 N -2.67 1.97 0.31 4.61 0.00 -0.98 -4.74 121.76 120.26 3hsy s ALA 234 Ca 0.00 0.61 -0.29 0.00 0.00 0.00 0.00 51.96 52.28 3hsy s ALA 234 Cb 0.00 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.62 3hsy s ALA 234 CO 0.00 -2.09 1.22 -0.80 0.00 0.00 0.00 175.76 174.09 3hsy s ASN 235 N -2.61 6.98 -0.03 0.00 -0.87 -0.55 -4.96 114.94 112.89 3hsy s ASN 235 Ca 0.68 2.51 -0.00 0.00 -1.57 0.00 0.00 52.86 54.47 3hsy s ASN 235 Cb -0.23 -2.64 0.03 0.00 -0.02 0.00 0.00 41.25 38.39 3hsy s ASN 235 CO 0.51 -0.37 0.02 -0.69 -2.57 0.00 0.00 177.10 174.00 3hsy s VAL 236 N -1.16 0.07 0.21 1.60 1.01 -1.26 -0.99 120.40 119.88 3hsy s VAL 236 Ca 0.47 0.18 0.08 0.00 0.00 0.00 0.00 61.98 62.71 3hsy s VAL 236 Cb -0.36 -0.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 3hsy s VAL 236 CO 0.48 0.14 -0.14 -0.44 0.00 0.00 0.00 175.10 175.13 3hsy s SER 237 N 1.26 2.60 0.00 3.32 0.01 0.28 -0.91 113.70 120.25 3hsy s SER 237 Ca -0.07 -1.02 0.00 0.00 1.31 0.00 0.00 55.95 56.17 3hsy s SER 237 Cb -0.13 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 65.96 3hsy s SER 237 CO -0.03 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.07 3hsy n GLY 238 N -0.39 1.77 3.09 3.44 0.00 0.04 -0.73 105.19 112.42 3hsy n GLY 238 Ca -0.08 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.16 3hsy n GLY 238 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hsy s PHE 239 N -2.47 0.68 -0.12 1.61 0.08 -1.24 -0.69 117.98 115.84 3hsy s PHE 239 Ca 0.00 -0.73 -0.06 0.00 0.12 0.00 0.00 56.93 56.26 3hsy s PHE 239 Cb 0.00 -0.42 0.05 0.00 -0.57 0.00 0.00 43.02 42.08 3hsy s PHE 239 CO 0.00 -0.16 0.28 -1.14 -0.10 0.00 0.00 175.22 174.10 3hsy s GLN 240 N -2.68 0.24 -0.02 0.44 0.74 -0.26 -1.58 119.66 116.54 3hsy s GLN 240 Ca -0.01 0.58 0.14 0.00 0.05 0.00 0.00 55.36 56.12 3hsy s GLN 240 Cb -0.02 -0.10 -0.21 0.00 1.10 0.00 0.00 33.01 33.79 3hsy s GLN 240 CO -0.03 -0.16 0.38 1.51 -0.55 0.00 0.00 175.29 176.44 3hsy n ILE 241 N 4.20 0.00 -3.59 -2.34 0.13 -1.18 -0.55 119.36 116.03 3hsy n ILE 241 Ca -0.25 -0.29 -0.39 0.00 -1.10 0.00 0.00 62.75 60.72 3hsy n ILE 241 Cb 0.54 0.37 -0.11 0.00 -0.84 0.00 0.00 39.64 39.59 3hsy n ILE 241 CO 0.00 0.00 0.00 -0.69 2.80 0.00 0.00 176.55 178.66 3hsy s VAL 242 N -2.83 5.02 -0.42 9.51 1.01 -1.26 -4.33 120.40 127.09 3hsy s VAL 242 Ca -0.03 -0.21 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 3hsy s VAL 242 Cb 0.09 -3.53 0.05 0.00 0.00 0.00 0.00 36.38 33.00 3hsy s VAL 242 CO 0.59 0.08 0.29 -0.62 0.00 0.00 0.00 175.10 175.44 3hsy s ASP 243 N 1.69 5.91 0.00 3.32 -1.08 -1.26 -4.95 116.67 120.31 3hsy s ASP 243 Ca 0.06 -1.18 0.18 0.00 -0.52 0.00 0.00 52.55 51.09 3hsy s ASP 243 Cb -0.17 -2.09 0.97 0.00 -1.46 0.00 0.00 42.92 40.17 3hsy s ASP 243 CO 0.09 -0.51 1.51 -1.22 0.52 0.00 0.00 175.17 175.56 3hsy n TYR 244 N 5.07 0.00 0.43 -5.34 4.01 -1.26 -0.99 117.16 119.08 3hsy n TYR 244 Ca -0.11 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.75 3hsy n TYR 244 Cb 0.45 -0.17 0.22 0.00 -0.31 0.00 0.00 39.34 39.52 3hsy n TYR 244 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3hsy h ASP 245 N 0.00 0.00 -3.21 7.72 3.32 -1.98 -3.37 116.42 118.90 3hsy h ASP 245 Ca 0.00 -0.06 -0.53 0.00 0.02 0.00 0.00 57.03 56.47 3hsy h ASP 245 Cb 0.10 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.71 3hsy h ASP 245 CO 0.00 0.03 0.84 -1.81 -1.72 0.00 0.00 179.24 176.57 3hsy s ASP 246 N -5.02 6.54 0.18 6.45 1.11 -0.16 -4.89 116.67 120.88 3hsy s ASP 246 Ca 0.07 2.75 -0.16 0.00 0.18 0.00 0.00 52.55 55.39 3hsy s ASP 246 Cb 0.10 -2.62 0.14 0.00 1.07 0.00 0.00 42.92 41.61 3hsy s ASP 246 CO 0.68 -0.81 1.65 -1.28 1.18 0.00 0.00 175.17 176.59 3hsy h SER 247 N 5.45 -0.48 -0.76 0.27 0.87 -1.89 -0.68 113.55 116.34 3hsy h SER 247 Ca -0.45 0.15 0.10 0.00 -1.23 0.00 0.00 61.79 60.35 3hsy h SER 247 Cb 1.21 0.31 -0.07 0.00 -0.44 0.00 0.00 62.40 63.41 3hsy h SER 247 CO 0.82 -0.17 0.40 -0.07 -0.53 0.00 0.00 176.83 177.28 3hsy h LEU 248 N -0.02 0.54 -0.05 2.23 3.38 -1.94 -1.54 115.31 117.91 3hsy h LEU 248 Ca 0.23 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.21 3hsy h LEU 248 Cb 0.36 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3hsy h LEU 248 CO -0.49 0.30 -0.15 0.58 0.09 0.00 0.00 178.44 178.76 3hsy h VAL 249 N 0.67 1.45 -0.85 1.22 2.07 -1.67 -1.75 116.25 117.38 3hsy h VAL 249 Ca 0.38 -1.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.33 3hsy h VAL 249 Cb 0.39 2.36 -0.04 0.00 -1.52 0.00 0.00 31.29 32.48 3hsy h VAL 249 CO -0.27 0.43 0.51 0.77 0.02 0.00 0.00 177.57 179.03 3hsy h SER 250 N -0.36 1.03 -0.48 0.57 4.64 -1.02 0.11 113.55 118.04 3hsy h SER 250 Ca -0.01 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3hsy h SER 250 Cb 0.78 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 3hsy h SER 250 CO 0.03 0.80 0.31 0.11 -0.87 0.00 0.00 176.83 177.21 3hsy h LYS 251 N 1.17 0.64 -0.36 4.77 1.57 -1.31 -0.20 116.57 122.86 3hsy h LYS 251 Ca 0.31 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 59.06 3hsy h LYS 251 Cb -0.03 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.11 3hsy h LYS 251 CO -0.06 0.44 0.19 0.35 -0.57 0.00 0.00 179.45 179.81 3hsy h PHE 252 N 0.65 0.36 -0.27 -1.35 3.57 -0.60 -2.90 116.94 116.40 3hsy h PHE 252 Ca 0.18 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 3hsy h PHE 252 Cb -0.05 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 3hsy h PHE 252 CO -0.04 0.20 -0.20 0.82 -2.23 0.00 0.00 178.31 176.86 3hsy h ILE 253 N 0.39 1.25 -0.97 1.41 1.08 -0.51 0.15 117.51 120.31 3hsy h ILE 253 Ca 0.15 -1.17 0.15 0.00 -0.39 0.00 0.00 64.86 63.60 3hsy h ILE 253 Cb 0.04 1.26 -0.09 0.00 -3.07 0.00 0.00 36.82 34.96 3hsy h ILE 253 CO -0.09 0.38 0.61 -0.33 -0.69 0.00 0.00 178.15 178.03 3hsy h GLU 254 N 0.45 0.82 0.10 2.37 5.08 -0.84 0.18 114.58 122.74 3hsy h GLU 254 Ca 0.07 -0.05 -0.26 0.00 -1.00 0.00 0.00 59.36 58.12 3hsy h GLU 254 Cb 0.60 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 3hsy h GLU 254 CO 0.04 0.54 -1.35 0.00 -1.00 0.00 0.00 179.01 177.24 3hsy h ARG 255 N 0.84 0.21 -0.95 2.33 3.08 -1.30 -3.36 114.38 115.22 3hsy h ARG 255 Ca 0.51 -0.35 0.06 0.00 0.07 0.00 0.00 59.98 60.26 3hsy h ARG 255 Cb 0.68 0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.79 3hsy h ARG 255 CO -0.28 1.17 0.61 2.35 -1.07 0.00 0.00 179.97 182.75 3hsy h TRP 256 N -0.40 1.13 0.00 3.04 2.91 -0.50 -2.05 115.95 120.09 3hsy h TRP 256 Ca -0.30 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.75 3hsy h TRP 256 Cb 1.69 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 29.96 3hsy h TRP 256 CO 0.13 0.60 0.00 -1.13 -1.03 0.00 0.00 178.44 177.01 3hsy n SER 257 N -4.53 0.34 -0.30 2.65 3.41 0.61 -1.39 113.62 114.41 3hsy n SER 257 Ca 0.14 0.59 0.03 0.00 -0.26 0.00 0.00 58.87 59.37 3hsy n SER 257 Cb 0.16 -0.66 0.04 0.00 -0.26 0.00 0.00 64.21 63.49 3hsy n SER 257 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hsy n THR 258 N -1.88 0.22 -1.90 6.66 -2.24 -0.79 -4.33 114.28 110.01 3hsy n THR 258 Ca 0.02 -0.61 -0.36 0.00 -2.27 0.00 0.00 64.05 60.83 3hsy n THR 258 Cb 0.18 1.00 0.05 0.00 -2.10 0.00 0.00 70.33 69.46 3hsy n THR 258 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hsy s LEU 259 N -0.67 3.62 -0.39 3.22 1.43 -1.03 -4.92 118.68 119.94 3hsy s LEU 259 Ca 0.10 2.45 -0.28 0.00 -1.03 0.00 0.00 54.13 55.36 3hsy s LEU 259 Cb 0.06 -4.60 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 3hsy s LEU 259 CO 0.09 -1.75 1.62 -0.70 0.23 0.00 0.00 176.35 175.84 3hsy s GLU 260 N -3.39 3.41 0.53 1.70 2.12 -1.26 -4.14 118.70 117.66 3hsy s GLU 260 Ca 0.79 1.15 0.18 0.00 0.36 0.00 0.00 54.97 57.45 3hsy s GLU 260 Cb -0.32 -4.13 1.32 0.00 0.26 0.00 0.00 34.13 31.26 3hsy s GLU 260 CO 0.36 -1.77 2.13 1.49 -0.54 0.00 0.00 175.26 176.92 3hsy h GLU 261 N 11.97 0.00 -0.58 4.30 4.81 -1.87 0.25 114.58 133.46 3hsy h GLU 261 Ca -0.30 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 3hsy h GLU 261 Cb 1.14 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.49 3hsy h GLU 261 CO 1.07 0.00 0.37 0.87 -0.73 0.00 0.00 179.01 180.59 3hsy h LYS 262 N 0.00 0.78 0.12 1.92 1.79 -1.98 -2.46 116.57 116.74 3hsy h LYS 262 Ca 0.04 -0.06 -0.28 0.00 -2.18 0.00 0.00 60.65 58.17 3hsy h LYS 262 Cb 0.17 -0.17 0.02 0.00 -1.58 0.00 0.00 32.23 30.67 3hsy h LYS 262 CO -0.00 0.54 -1.21 1.49 -1.08 0.00 0.00 179.45 179.18 3hsy h GLU 263 N 0.79 0.45 -2.88 3.15 4.81 -1.28 -3.40 114.58 116.22 3hsy h GLU 263 Ca 0.21 -0.64 -0.61 0.00 -0.13 0.00 0.00 59.36 58.19 3hsy h GLU 263 Cb -0.06 0.22 -0.41 0.00 0.63 0.00 0.00 28.75 29.13 3hsy h GLU 263 CO -0.04 1.28 -0.68 0.66 -0.73 0.00 0.00 179.01 179.49 3hsy n TYR 264 N -3.69 2.12 -1.64 0.92 4.01 0.65 -5.06 117.16 114.47 3hsy n TYR 264 Ca -0.11 -4.04 -0.44 0.00 -0.16 0.00 0.00 57.90 53.15 3hsy n TYR 264 Cb 0.98 -0.38 -0.02 0.00 -0.31 0.00 0.00 39.34 39.61 3hsy n TYR 264 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3hsy n PRO 265 N 2.18 1.70 0.00 -0.72 -0.04 -0.93 -1.12 135.00 136.07 3hsy n PRO 265 Ca 0.23 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 64.29 3hsy n PRO 265 Cb 0.39 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 3hsy n PRO 265 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hsy n GLY 266 N 1.23 2.37 0.00 0.55 0.00 -1.26 -3.79 105.19 104.29 3hsy n GLY 266 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3hsy n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hsy n ALA 267 N -0.83 0.00 -3.69 4.61 0.00 -0.28 -4.54 120.51 115.77 3hsy n ALA 267 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 3hsy n ALA 267 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.51 3hsy n ALA 267 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3hsy n HIS 268 N -0.94 -2.41 -4.35 0.00 -0.00 -0.48 -4.81 115.22 102.23 3hsy n HIS 268 Ca 0.00 0.94 -0.19 0.00 -0.00 0.00 0.00 57.72 58.47 3hsy n HIS 268 Cb 0.00 -4.59 -0.10 0.00 -0.00 0.00 0.00 29.99 25.30 3hsy n HIS 268 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 3hsy s THR 269 N -3.39 1.72 -0.52 3.57 -4.23 -1.26 -4.91 115.64 106.62 3hsy s THR 269 Ca 0.41 -2.20 0.24 0.00 -1.18 0.00 0.00 61.69 58.95 3hsy s THR 269 Cb -0.19 -2.08 0.19 0.00 1.34 0.00 0.00 72.50 71.75 3hsy s THR 269 CO 0.78 -0.57 1.47 0.00 -0.54 0.00 0.00 174.62 175.77 3hsy h ALA 270 N 2.53 0.80 -2.15 3.99 0.00 -1.94 -3.32 119.26 119.17 3hsy h ALA 270 Ca -0.38 0.00 -0.42 0.00 0.00 0.00 0.00 54.91 54.11 3hsy h ALA 270 Cb 1.22 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 3hsy h ALA 270 CO 0.62 0.00 -0.66 0.95 0.00 0.00 0.00 179.25 180.16 3hsy s THR 271 N -3.20 1.23 -0.03 0.00 -4.23 -1.26 -5.01 115.64 103.15 3hsy s THR 271 Ca 0.06 -2.06 0.03 0.00 -1.18 0.00 0.00 61.69 58.55 3hsy s THR 271 Cb 0.10 -2.38 -0.00 0.00 1.34 0.00 0.00 72.50 71.56 3hsy s THR 271 CO 0.69 -0.32 -0.13 -0.51 -0.54 0.00 0.00 174.62 173.81 3hsy s ILE 272 N -3.28 1.05 0.60 2.99 2.07 -1.26 -5.03 121.20 118.33 3hsy s ILE 272 Ca 0.29 -0.52 -0.19 0.00 -1.41 0.00 0.00 60.65 58.82 3hsy s ILE 272 Cb 0.05 -0.91 -0.03 0.00 0.13 0.00 0.00 42.46 41.71 3hsy s ILE 272 CO 0.10 0.31 1.27 -0.54 -1.91 0.00 0.00 174.94 174.17 3hsy s LYS 273 N 0.04 2.85 0.39 3.50 1.02 -1.26 -4.80 119.74 121.49 3hsy s LYS 273 Ca -0.02 2.00 0.14 0.00 0.02 0.00 0.00 55.97 58.11 3hsy s LYS 273 Cb -0.09 -1.97 0.81 0.00 -0.52 0.00 0.00 37.83 36.06 3hsy s LYS 273 CO 0.01 -1.35 1.87 0.10 -0.92 0.00 0.00 175.35 175.06 3hsy h TYR 274 N 0.89 0.00 -0.35 3.18 -0.00 -1.95 -0.85 116.97 117.89 3hsy h TYR 274 Ca -0.51 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.14 3hsy h TYR 274 Cb 1.31 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 38.03 3hsy h TYR 274 CO 0.44 0.32 -0.15 1.79 -0.00 0.00 0.00 178.16 180.57 3hsy h THR 275 N 0.00 1.25 -0.46 -0.90 1.35 -1.92 0.41 112.91 112.65 3hsy h THR 275 Ca -0.00 -1.15 -0.14 0.00 -0.55 0.00 0.00 66.41 64.57 3hsy h THR 275 Cb 0.58 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.13 3hsy h THR 275 CO 0.04 0.38 -0.26 0.28 -0.25 0.00 0.00 175.52 175.72 3hsy h SER 276 N 0.57 1.02 -0.79 5.36 0.02 -1.58 -1.77 113.55 116.38 3hsy h SER 276 Ca 0.10 -0.40 -0.04 0.00 -0.84 0.00 0.00 61.79 60.60 3hsy h SER 276 Cb 0.58 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 3hsy h SER 276 CO 0.04 1.20 0.34 0.00 -1.14 0.00 0.00 176.83 177.28 3hsy h ALA 277 N 0.86 1.02 0.00 3.77 0.00 -0.77 -1.58 119.26 122.56 3hsy h ALA 277 Ca 0.10 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3hsy h ALA 277 Cb 0.84 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3hsy h ALA 277 CO 0.07 0.62 -0.35 -0.07 0.00 0.00 0.00 179.25 179.52 3hsy h LEU 278 N 1.13 0.00 -0.16 0.00 3.38 -0.83 -0.64 115.31 118.18 3hsy h LEU 278 Ca 0.27 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.18 3hsy h LEU 278 Cb 0.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3hsy h LEU 278 CO -0.03 0.35 -0.13 0.74 0.09 0.00 0.00 178.44 179.47 3hsy h THR 279 N 0.00 1.33 -0.50 0.22 2.02 -0.78 0.13 112.91 115.33 3hsy h THR 279 Ca -0.00 -1.25 0.02 0.00 0.77 0.00 0.00 66.41 65.94 3hsy h THR 279 Cb 0.65 1.80 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 3hsy h THR 279 CO 0.05 0.37 0.31 0.22 0.37 0.00 0.00 175.52 176.84 3hsy h TYR 280 N 0.02 0.59 -0.49 3.16 3.20 -1.14 -2.40 116.97 119.91 3hsy h TYR 280 Ca 0.03 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 3hsy h TYR 280 Cb 0.64 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 3hsy h TYR 280 CO 0.08 0.35 0.13 -0.44 -1.64 0.00 0.00 178.16 176.64 3hsy h ASP 281 N 0.63 0.68 -0.66 -2.11 3.32 -1.00 -2.25 116.42 115.03 3hsy h ASP 281 Ca 0.19 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 3hsy h ASP 281 Cb -0.02 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 3hsy h ASP 281 CO -0.07 0.66 0.41 0.00 -1.72 0.00 0.00 179.24 178.52 3hsy h ALA 282 N 1.43 1.46 -0.51 3.45 0.00 -0.25 -0.15 119.26 124.69 3hsy h ALA 282 Ca 0.16 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 3hsy h ALA 282 Cb 0.24 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3hsy h ALA 282 CO -0.01 0.47 0.13 0.28 0.00 0.00 0.00 179.25 180.13 3hsy h VAL 283 N 0.92 1.24 -0.37 0.00 2.07 -1.07 0.40 116.25 119.44 3hsy h VAL 283 Ca 0.24 -0.85 0.05 0.00 0.82 0.00 0.00 66.70 66.97 3hsy h VAL 283 Cb -0.04 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 3hsy h VAL 283 CO -0.05 0.31 0.09 -0.61 0.02 0.00 0.00 177.57 177.33 3hsy h GLN 284 N 0.71 0.22 -0.36 1.57 4.15 -1.10 -1.02 115.11 119.28 3hsy h GLN 284 Ca 0.16 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.56 3hsy h GLN 284 Cb 0.33 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 3hsy h GLN 284 CO 0.00 0.14 0.20 0.28 -1.93 0.00 0.00 178.83 177.53 3hsy h VAL 285 N 0.22 1.14 -0.42 2.39 2.07 -0.71 -0.98 116.25 119.97 3hsy h VAL 285 Ca 0.18 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 3hsy h VAL 285 Cb 0.19 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3hsy h VAL 285 CO -0.22 0.14 0.21 0.24 0.02 0.00 0.00 177.57 177.97 3hsy h MET 286 N 0.46 0.59 -0.54 1.57 2.86 -0.72 -0.79 114.93 118.37 3hsy h MET 286 Ca 0.13 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.71 3hsy h MET 286 Cb 0.05 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 3hsy h MET 286 CO -0.02 0.49 0.33 1.15 1.06 0.00 0.00 176.91 179.92 3hsy h THR 287 N 0.54 1.07 -0.69 2.22 2.02 -1.05 -1.75 112.91 115.26 3hsy h THR 287 Ca 0.14 -0.23 -0.07 0.00 0.77 0.00 0.00 66.41 67.03 3hsy h THR 287 Cb 0.09 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 66.83 3hsy h THR 287 CO -0.02 0.12 0.17 -0.08 0.37 0.00 0.00 175.52 176.08 3hsy h GLU 288 N 0.66 1.11 -0.34 6.66 4.57 -0.90 -0.89 114.58 125.46 3hsy h GLU 288 Ca 0.21 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 3hsy h GLU 288 Cb 0.00 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 3hsy h GLU 288 CO -0.08 0.98 0.22 0.00 -1.18 0.00 0.00 179.01 178.95 3hsy h ALA 289 N 1.08 0.43 -0.08 2.92 0.00 -0.78 -0.95 119.26 121.88 3hsy h ALA 289 Ca 0.22 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 3hsy h ALA 289 Cb 0.37 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3hsy h ALA 289 CO 0.00 -0.10 -0.48 0.74 0.00 0.00 0.00 179.25 179.41 3hsy h PHE 290 N 0.45 0.23 -0.54 0.00 0.04 -1.06 -0.19 116.94 115.88 3hsy h PHE 290 Ca 0.12 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 3hsy h PHE 290 Cb -0.04 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.04 3hsy h PHE 290 CO -0.05 0.64 0.31 0.00 -0.60 0.00 0.00 178.31 178.61 3hsy h ARG 291 N 0.16 0.74 -0.50 1.51 3.08 -0.94 -1.42 114.38 117.01 3hsy h ARG 291 Ca 0.01 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 59.86 3hsy h ARG 291 Cb 0.91 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.79 3hsy h ARG 291 CO 0.07 0.56 -0.16 -0.91 -1.07 0.00 0.00 179.97 178.46 3hsy h ASN 292 N 0.72 1.00 -0.56 7.04 2.35 -0.60 -1.35 115.58 124.19 3hsy h ASN 292 Ca 0.19 -0.35 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 3hsy h ASN 292 Cb 0.02 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.09 3hsy h ASN 292 CO -0.03 1.14 0.35 -0.07 -1.65 0.00 0.00 177.43 177.17 3hsy h LEU 293 N 0.87 0.66 -0.86 1.61 3.38 -0.97 -2.07 115.31 117.92 3hsy h LEU 293 Ca 0.12 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.10 3hsy h LEU 293 Cb 0.73 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 3hsy h LEU 293 CO 0.06 0.50 0.55 -0.09 0.09 0.00 0.00 178.44 179.55 3hsy h ARG 294 N 0.75 1.01 0.00 1.13 2.43 -0.93 -0.96 114.38 117.82 3hsy h ARG 294 Ca 0.20 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 3hsy h ARG 294 Cb -0.05 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.27 3hsy h ARG 294 CO -0.04 0.67 -0.10 0.87 -1.51 0.00 0.00 179.97 179.85 3hsy h LYS 295 N 1.04 0.00 -0.23 0.20 1.57 -0.79 -1.87 116.57 116.49 3hsy h LYS 295 Ca 0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 3hsy h LYS 295 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3hsy h LYS 295 CO -0.14 0.10 0.00 1.04 -0.57 0.00 0.00 179.45 179.88 3hsy n GLN 296 N -4.37 2.03 -2.04 3.15 6.02 -0.44 -4.93 117.38 116.80 3hsy n GLN 296 Ca -0.03 -1.55 -0.17 0.00 -0.01 0.00 0.00 57.00 55.25 3hsy n GLN 296 Cb 0.18 -1.44 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 3hsy n GLN 296 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3hsy n ARG 297 N 0.78 -1.26 -2.91 -1.09 1.74 -0.70 -4.98 116.66 108.24 3hsy n ARG 297 Ca 0.17 0.90 -0.42 0.00 -0.77 0.00 0.00 57.85 57.73 3hsy n ARG 297 Cb 0.44 -5.24 -0.04 0.00 -1.02 0.00 0.00 32.46 26.59 3hsy n ARG 297 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3hsy s ILE 298 N -2.76 4.86 0.13 0.55 1.01 -0.75 -5.00 121.20 119.25 3hsy s ILE 298 Ca 0.00 1.54 -0.31 0.00 0.00 0.00 0.00 60.65 61.88 3hsy s ILE 298 Cb 0.00 -4.10 -0.10 0.00 0.01 0.00 0.00 42.46 38.27 3hsy s ILE 298 CO 0.00 -0.04 1.66 -0.70 0.00 0.00 0.00 174.94 175.86 3hsy s GLU 299 N 2.66 4.19 -0.02 2.79 2.12 -1.26 -4.48 118.70 124.70 3hsy s GLU 299 Ca 0.35 2.41 0.03 0.00 0.36 0.00 0.00 54.97 58.12 3hsy s GLU 299 Cb -0.16 -3.38 0.04 0.00 0.26 0.00 0.00 34.13 30.90 3hsy s GLU 299 CO 0.08 -0.71 0.97 0.44 -0.54 0.00 0.00 175.26 175.51 3hsy n ILE 300 N 4.37 0.30 0.04 -3.70 -5.35 -1.26 -4.97 119.36 108.79 3hsy n ILE 300 Ca 0.15 -0.36 -0.01 0.00 -0.27 0.00 0.00 62.75 62.26 3hsy n ILE 300 Cb 0.39 0.44 -0.01 0.00 -1.74 0.00 0.00 39.64 38.72 3hsy n ILE 300 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3hsy h SER 301 N 0.00 -0.08 -2.69 7.28 4.64 -1.89 -3.45 113.55 117.36 3hsy h SER 301 Ca 0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 3hsy h SER 301 Cb 1.28 0.02 -0.21 0.00 -0.31 0.00 0.00 62.40 63.18 3hsy h SER 301 CO 0.00 -0.04 -0.05 -0.60 -0.87 0.00 0.00 176.83 175.27 3hsy s ARG 302 N -2.60 0.65 0.30 4.77 6.06 -1.26 -4.69 118.95 122.19 3hsy s ARG 302 Ca -0.01 1.28 -0.29 0.00 -2.50 0.00 0.00 55.73 54.20 3hsy s ARG 302 Cb 0.00 0.37 -0.10 0.00 0.06 0.00 0.00 34.95 35.28 3hsy s ARG 302 CO 0.04 -0.17 1.26 1.03 -2.50 0.00 0.00 175.30 174.97 3hsy s ARG 303 N 2.04 4.42 0.00 5.12 0.52 -1.26 -5.01 118.95 124.78 3hsy s ARG 303 Ca -0.09 2.11 0.00 0.00 -0.52 0.00 0.00 55.73 57.24 3hsy s ARG 303 Cb -0.07 -3.11 0.00 0.00 0.52 0.00 0.00 34.95 32.29 3hsy s ARG 303 CO -0.19 -0.11 0.00 0.41 0.02 0.00 0.00 175.30 175.43 3hsy n GLY 304 N 1.07 0.25 3.07 -3.53 0.00 -1.26 -4.89 105.19 99.90 3hsy n GLY 304 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3hsy n GLY 304 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hsy s ASN 305 N -1.37 4.32 -0.25 1.61 2.20 -1.26 -5.08 114.94 115.11 3hsy s ASN 305 Ca 0.00 -1.33 -0.14 0.00 -0.94 0.00 0.00 52.86 50.45 3hsy s ASN 305 Cb 0.00 -1.53 -0.04 0.00 -2.00 0.00 0.00 41.25 37.68 3hsy s ASN 305 CO 0.00 -0.18 0.35 0.00 -2.94 0.00 0.00 177.10 174.33 3hsy s ALA 306 N 1.13 3.57 1.00 3.54 0.00 -1.26 -5.08 121.76 124.65 3hsy s ALA 306 Ca -0.08 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.12 3hsy s ALA 306 Cb -0.19 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.29 3hsy s ALA 306 CO -0.06 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.61 3hsy n GLY 307 N 4.45 -2.09 3.75 0.00 0.00 -1.26 -4.91 105.19 105.12 3hsy n GLY 307 Ca -0.09 -1.38 -0.41 0.00 0.00 0.00 0.00 46.02 44.13 3hsy n GLY 307 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hsy s ASP 308 N -1.52 6.53 0.26 1.61 2.15 -1.26 -4.89 116.67 119.55 3hsy s ASP 308 Ca 0.00 2.80 -0.05 0.00 0.43 0.00 0.00 52.55 55.73 3hsy s ASP 308 Cb 0.00 -2.63 0.30 0.00 -0.30 0.00 0.00 42.92 40.29 3hsy s ASP 308 CO 0.00 -0.79 1.93 0.00 -0.17 0.00 0.00 175.17 176.14 3hsy n LEU 310 N -4.38 7.33 -4.76 0.00 4.77 -1.26 -4.94 117.00 113.75 3hsy n LEU 310 Ca 0.11 -4.68 -0.38 0.00 -0.03 0.00 0.00 56.01 51.03 3hsy n LEU 310 Cb 0.03 -1.10 -0.06 0.00 -2.33 0.00 0.00 43.42 39.95 3hsy n LEU 310 CO 0.37 1.75 0.14 0.00 -1.33 0.00 0.00 177.39 178.32 3hsy s ALA 311 N -3.61 3.56 -0.10 -1.18 0.00 -1.10 -5.07 121.76 114.25 3hsy s ALA 311 Ca 0.53 -0.21 -0.02 0.00 0.00 0.00 0.00 51.96 52.27 3hsy s ALA 311 Cb 0.43 -2.54 0.04 0.00 0.00 0.00 0.00 23.12 21.05 3hsy s ALA 311 CO -0.38 0.19 0.00 1.21 0.00 0.00 0.00 175.76 176.78 3hsy s ASN 312 N -0.04 1.95 0.76 0.00 3.84 -1.26 -2.43 114.94 117.75 3hsy s ASN 312 Ca 0.24 -0.28 -0.11 0.00 0.21 0.00 0.00 52.86 52.93 3hsy s ASN 312 Cb -0.16 -0.51 0.05 0.00 -0.55 0.00 0.00 41.25 40.09 3hsy s ASN 312 CO 0.11 -0.22 1.10 -2.84 -2.79 0.00 0.00 177.10 172.47 3hsy s PRO 313 N 1.93 2.27 0.60 0.43 0.02 -1.26 -5.15 135.00 133.84 3hsy s PRO 313 Ca 0.04 1.24 -0.14 0.00 0.02 0.00 0.00 61.00 62.15 3hsy s PRO 313 Cb -0.13 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 3hsy s PRO 313 CO -0.06 -1.64 1.03 0.00 -0.33 0.00 0.00 177.00 176.00 3hsy s ALA 314 N -2.78 2.87 0.03 -1.55 0.00 -1.02 -5.03 121.76 114.28 3hsy s ALA 314 Ca 0.63 0.19 -0.24 0.00 0.00 0.00 0.00 51.96 52.54 3hsy s ALA 314 Cb -0.18 -3.16 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 3hsy s ALA 314 CO 0.54 -0.73 0.73 0.54 0.00 0.00 0.00 175.76 176.84 3hsy s VAL 315 N -2.75 4.79 -0.41 0.00 0.11 -1.26 -5.00 120.40 115.87 3hsy s VAL 315 Ca 0.60 1.54 -0.28 0.00 -2.93 0.00 0.00 61.98 60.91 3hsy s VAL 315 Cb -0.13 -4.07 -0.02 0.00 -1.53 0.00 0.00 36.38 30.63 3hsy s VAL 315 CO 0.42 0.37 1.78 -2.84 -3.33 0.00 0.00 175.10 171.50 3hsy s PRO 316 N -0.02 3.17 -0.50 1.54 0.02 -1.26 -4.95 135.00 133.00 3hsy s PRO 316 Ca 0.37 1.17 -0.24 0.00 0.02 0.00 0.00 61.00 62.32 3hsy s PRO 316 Cb -0.20 -4.23 0.03 0.00 0.02 0.00 0.00 34.50 30.12 3hsy s PRO 316 CO 0.22 -2.06 0.90 -0.46 -0.33 0.00 0.00 177.00 175.27 3hsy s TRP 317 N 7.34 2.88 0.20 6.54 -0.00 -1.26 -4.96 118.94 129.68 3hsy s TRP 317 Ca 0.75 0.17 -0.10 0.00 -0.00 0.00 0.00 56.10 56.92 3hsy s TRP 317 Cb -0.19 -3.95 0.14 0.00 -0.00 0.00 0.00 33.47 29.47 3hsy s TRP 317 CO 0.30 -1.18 1.83 0.78 -0.00 0.00 0.00 176.95 178.68 3hsy h GLY 318 N 10.64 1.08 2.00 5.86 0.00 -1.97 -2.78 103.07 117.90 3hsy h GLY 318 Ca -0.25 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.57 3hsy h GLY 318 CO 1.04 0.45 -0.20 1.46 0.00 0.00 0.00 176.54 179.29 3hsy h GLN 319 N 1.00 0.00 -0.85 4.80 1.08 -1.93 -3.08 115.11 116.12 3hsy h GLN 319 Ca 0.26 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 57.60 3hsy h GLN 319 Cb -0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.34 3hsy h GLN 319 CO -0.05 0.20 0.45 0.78 -0.95 0.00 0.00 178.83 179.27 3hsy h GLY 320 N 0.76 1.38 1.00 3.46 0.00 -1.71 -0.75 103.07 107.21 3hsy h GLY 320 Ca -0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 3hsy h GLY 320 CO 0.03 -0.01 0.30 -2.08 0.00 0.00 0.00 176.54 174.78 3hsy h VAL 321 N 0.66 1.22 -0.30 4.60 2.07 -1.70 -1.05 116.25 121.76 3hsy h VAL 321 Ca 0.46 -0.64 -0.12 0.00 0.82 0.00 0.00 66.70 67.22 3hsy h VAL 321 Cb 0.62 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3hsy h VAL 321 CO -0.34 0.26 -0.31 -0.33 0.02 0.00 0.00 177.57 176.87 3hsy h GLU 322 N 0.89 0.62 -0.56 1.57 4.39 -1.38 -1.06 114.58 119.06 3hsy h GLU 322 Ca 0.22 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 3hsy h GLU 322 Cb 0.13 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 3hsy h GLU 322 CO -0.03 0.86 0.14 0.82 -1.16 0.00 0.00 179.01 179.64 3hsy h ILE 323 N 0.53 1.25 -0.44 3.13 2.04 -0.91 0.79 117.51 123.90 3hsy h ILE 323 Ca 0.06 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 3hsy h ILE 323 Cb 0.79 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 3hsy h ILE 323 CO 0.07 0.32 0.24 -0.08 0.00 0.00 0.00 178.15 178.70 3hsy h GLU 324 N 0.79 0.61 -0.63 2.37 4.81 -1.07 -0.76 114.58 120.70 3hsy h GLU 324 Ca 0.17 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3hsy h GLU 324 Cb 0.34 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 3hsy h GLU 324 CO 0.00 0.48 0.39 -0.09 -0.73 0.00 0.00 179.01 179.06 3hsy h ARG 325 N 0.57 0.85 -0.44 1.92 2.43 -0.88 -1.99 114.38 116.84 3hsy h ARG 325 Ca 0.15 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.22 3hsy h ARG 325 Cb 0.05 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 3hsy h ARG 325 CO -0.02 0.59 0.13 0.00 -1.51 0.00 0.00 179.97 179.16 3hsy h ALA 326 N 1.20 0.57 -0.52 2.80 0.00 -0.56 -1.46 119.26 121.30 3hsy h ALA 326 Ca 0.23 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.98 3hsy h ALA 326 Cb -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3hsy h ALA 326 CO -0.04 0.24 0.31 -0.07 0.00 0.00 0.00 179.25 179.68 3hsy h LEU 327 N 0.57 0.50 -0.78 0.00 3.38 -0.96 -2.16 115.31 115.86 3hsy h LEU 327 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3hsy h LEU 327 Cb 0.28 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3hsy h LEU 327 CO -0.00 0.35 0.00 0.11 0.09 0.00 0.00 178.44 178.99 3hsy h LYS 328 N 0.62 0.00 0.00 1.13 1.57 -1.12 -2.89 116.57 115.88 3hsy h LYS 328 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3hsy h LYS 328 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3hsy h LYS 328 CO -0.09 0.00 -0.84 0.94 -0.57 0.00 0.00 179.45 178.89 3hsy n GLN 329 N -2.39 0.21 -1.74 3.15 7.27 -0.57 -4.03 117.38 119.29 3hsy n GLN 329 Ca 0.02 0.02 -0.42 0.00 0.07 0.00 0.00 57.00 56.68 3hsy n GLN 329 Cb 0.25 -1.59 -0.01 0.00 2.41 0.00 0.00 30.24 31.31 3hsy n GLN 329 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3hsy n VAL 330 N -1.87 1.37 -3.86 1.69 0.31 -1.02 -4.95 118.33 110.00 3hsy n VAL 330 Ca 0.03 -0.34 -0.27 0.00 -0.01 0.00 0.00 64.34 63.75 3hsy n VAL 330 Cb 0.41 -1.85 -0.17 0.00 -0.91 0.00 0.00 33.84 31.33 3hsy n VAL 330 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3hsy s GLN 331 N -1.05 1.26 0.11 5.55 -0.21 -1.26 -4.34 119.66 119.72 3hsy s GLN 331 Ca 0.61 -0.38 -0.08 0.00 0.02 0.00 0.00 55.36 55.53 3hsy s GLN 331 Cb -0.52 -1.81 -0.01 0.00 1.00 0.00 0.00 33.01 31.67 3hsy s GLN 331 CO 0.54 -0.41 0.19 0.14 -2.12 0.00 0.00 175.29 173.64 3hsy s VAL 332 N 1.71 0.12 -0.17 1.09 -7.23 -1.04 -5.02 120.40 109.87 3hsy s VAL 332 Ca 0.02 -1.33 -0.08 0.00 -1.81 0.00 0.00 61.98 58.77 3hsy s VAL 332 Cb -0.15 -1.54 -0.04 0.00 0.56 0.00 0.00 36.38 35.21 3hsy s VAL 332 CO -0.07 -0.57 0.10 -0.70 -0.31 0.00 0.00 175.10 173.54 3hsy s GLU 333 N -3.91 3.93 0.00 4.82 2.12 -1.26 -0.65 118.70 123.75 3hsy s GLU 333 Ca 0.10 -0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.16 3hsy s GLU 333 Cb 0.05 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 31.17 3hsy s GLU 333 CO -0.07 0.38 0.00 0.41 -0.54 0.00 0.00 175.26 175.44 3hsy n GLY 334 N 3.23 5.13 0.25 -1.50 0.00 0.27 -4.98 105.19 107.59 3hsy n GLY 334 Ca -0.17 -1.68 0.05 0.00 0.00 0.00 0.00 46.02 44.22 3hsy n GLY 334 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hsy h LEU 335 N 0.00 0.11 -2.70 0.99 3.38 -1.94 -1.30 115.31 113.86 3hsy h LEU 335 Ca 0.00 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3hsy h LEU 335 Cb 0.00 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3hsy h LEU 335 CO 0.00 0.21 0.07 -1.54 0.09 0.00 0.00 178.44 177.27 3hsy n SER 336 N -4.38 3.86 0.00 -0.43 3.41 -1.26 -4.24 113.62 110.58 3hsy n SER 336 Ca -0.02 -2.65 0.00 0.00 -0.26 0.00 0.00 58.87 55.95 3hsy n SER 336 Cb 0.19 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 3hsy n SER 336 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hsy n GLY 337 N 0.23 -0.28 3.69 5.00 0.00 -0.49 -4.82 105.19 108.52 3hsy n GLY 337 Ca 0.21 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 3hsy n GLY 337 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hsy s ASN 338 N -4.00 7.04 -0.22 1.61 0.02 -1.26 -0.57 114.94 117.56 3hsy s ASN 338 Ca 0.00 1.87 -0.05 0.00 -1.02 0.00 0.00 52.86 53.65 3hsy s ASN 338 Cb 0.00 -2.56 -0.02 0.00 0.02 0.00 0.00 41.25 38.69 3hsy s ASN 338 CO 0.00 -0.58 0.01 -0.63 0.02 0.00 0.00 177.10 175.92 3hsy s ILE 339 N 2.09 3.89 -0.08 0.60 1.01 0.17 -4.50 121.20 124.38 3hsy s ILE 339 Ca 0.57 -0.32 -0.23 0.00 0.00 0.00 0.00 60.65 60.66 3hsy s ILE 339 Cb -0.26 -2.78 0.05 0.00 0.01 0.00 0.00 42.46 39.48 3hsy s ILE 339 CO 0.23 0.40 0.54 -0.75 0.00 0.00 0.00 174.94 175.36 3hsy s LYS 340 N 1.35 0.84 0.13 2.79 2.20 -1.26 -2.50 119.74 123.29 3hsy s LYS 340 Ca 0.04 0.25 0.09 0.00 -0.36 0.00 0.00 55.97 55.99 3hsy s LYS 340 Cb -0.15 0.39 -0.04 0.00 -1.51 0.00 0.00 37.83 36.53 3hsy s LYS 340 CO 0.01 -0.22 -0.20 -0.06 -0.36 0.00 0.00 175.35 174.51 3hsy s PHE 341 N -0.87 1.85 0.59 4.03 0.08 -1.26 -0.47 117.98 121.93 3hsy s PHE 341 Ca -0.09 -0.43 -0.03 0.00 0.12 0.00 0.00 56.93 56.49 3hsy s PHE 341 Cb -0.03 -0.98 0.12 0.00 -0.57 0.00 0.00 43.02 41.57 3hsy s PHE 341 CO 0.06 0.27 0.81 -0.40 -0.10 0.00 0.00 175.22 175.85 3hsy n ASP 342 N 0.78 0.76 0.10 1.36 5.68 -0.12 -4.84 116.55 120.27 3hsy n ASP 342 Ca -0.17 -1.72 0.10 0.00 -0.50 0.00 0.00 54.79 52.50 3hsy n ASP 342 Cb 0.55 -0.55 0.44 0.00 -1.14 0.00 0.00 41.12 40.41 3hsy n ASP 342 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hsy n GLN 343 N -2.56 0.13 -0.64 0.11 10.64 -1.26 -1.43 117.38 122.37 3hsy n GLN 343 Ca 0.12 0.42 0.08 0.00 -1.83 0.00 0.00 57.00 55.79 3hsy n GLN 343 Cb 0.43 -1.78 0.35 0.00 -0.86 0.00 0.00 30.24 28.38 3hsy n GLN 343 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 3hsy n ASN 344 N -2.03 4.80 -0.52 2.61 5.15 -1.26 -4.94 115.26 119.07 3hsy n ASN 344 Ca 0.02 -2.62 -0.07 0.00 -0.60 0.00 0.00 54.58 51.31 3hsy n ASN 344 Cb 0.18 -0.58 -0.03 0.00 -0.53 0.00 0.00 39.78 38.82 3hsy n ASN 344 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3hsy n GLY 345 N 0.74 0.86 3.85 8.20 0.00 -0.51 -4.74 105.19 113.58 3hsy n GLY 345 Ca 0.25 -0.74 -0.37 0.00 0.00 0.00 0.00 46.02 45.15 3hsy n GLY 345 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hsy s LYS 346 N -2.65 3.68 0.29 1.61 -0.14 -1.26 -0.50 119.74 120.78 3hsy s LYS 346 Ca 0.00 0.11 -0.30 0.00 -1.36 0.00 0.00 55.97 54.42 3hsy s LYS 346 Cb 0.00 -3.21 -0.12 0.00 -1.68 0.00 0.00 37.83 32.82 3hsy s LYS 346 CO 0.00 0.72 1.58 0.54 -0.76 0.00 0.00 175.35 177.42 3hsy n ARG 347 N 1.99 2.65 -4.24 1.68 5.12 -1.25 -0.94 116.66 121.66 3hsy n ARG 347 Ca -0.17 0.94 -0.14 0.00 -1.93 0.00 0.00 57.85 56.55 3hsy n ARG 347 Cb 0.54 -2.71 -0.10 0.00 -1.16 0.00 0.00 32.46 29.02 3hsy n ARG 347 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 3hsy s ILE 348 N -0.07 0.91 -1.37 0.55 -4.36 0.38 -4.80 121.20 112.43 3hsy s ILE 348 Ca 0.64 -2.01 -0.02 0.00 -0.26 0.00 0.00 60.65 59.00 3hsy s ILE 348 Cb -0.51 -1.97 0.00 0.00 1.25 0.00 0.00 42.46 41.23 3hsy s ILE 348 CO 0.49 -0.63 0.20 -3.20 0.24 0.00 0.00 174.94 172.05 3hsy n ASN 349 N -0.21 -5.10 -4.97 4.36 5.15 -1.26 -4.00 115.26 109.23 3hsy n ASN 349 Ca -0.09 -0.10 -0.19 0.00 -0.60 0.00 0.00 54.58 53.60 3hsy n ASN 349 Cb 0.62 -4.09 0.01 0.00 -0.53 0.00 0.00 39.78 35.78 3hsy n ASN 349 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 3hsy s TYR 350 N -2.93 2.36 -0.02 1.20 -0.85 -1.26 -4.75 117.35 111.10 3hsy s TYR 350 Ca 0.10 -0.54 0.03 0.00 -0.52 0.00 0.00 57.07 56.14 3hsy s TYR 350 Cb -0.04 -2.24 -0.00 0.00 0.38 0.00 0.00 41.96 40.05 3hsy s TYR 350 CO 0.12 -0.51 -0.10 0.99 -1.52 0.00 0.00 175.55 174.53 3hsy s THR 351 N -2.49 0.83 -0.13 -3.49 2.01 -1.26 -4.35 115.64 106.76 3hsy s THR 351 Ca 0.53 -0.41 0.01 0.00 0.31 0.00 0.00 61.69 62.12 3hsy s THR 351 Cb -0.06 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.71 3hsy s THR 351 CO 0.32 0.25 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.72 3hsy s ILE 352 N 0.00 2.85 0.06 1.82 1.01 -0.10 -4.84 121.20 122.00 3hsy s ILE 352 Ca -0.00 -0.73 -0.24 0.00 0.00 0.00 0.00 60.65 59.68 3hsy s ILE 352 Cb -0.07 -2.18 -0.06 0.00 0.01 0.00 0.00 42.46 40.16 3hsy s ILE 352 CO 0.00 0.53 0.72 0.20 0.00 0.00 0.00 174.94 176.39 3hsy s ASN 353 N 0.41 7.18 -0.21 3.58 0.01 0.29 -0.29 114.94 125.91 3hsy s ASN 353 Ca -0.12 1.41 -0.14 0.00 -0.71 0.00 0.00 52.86 53.30 3hsy s ASN 353 Cb -0.16 -2.44 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 3hsy s ASN 353 CO 0.06 0.08 0.34 -0.63 -1.51 0.00 0.00 177.10 175.43 3hsy s ILE 354 N -0.33 5.24 0.10 0.60 -1.09 0.17 -1.11 121.20 124.79 3hsy s ILE 354 Ca 0.36 0.57 0.10 0.00 -2.23 0.00 0.00 60.65 59.45 3hsy s ILE 354 Cb -0.20 -3.67 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 3hsy s ILE 354 CO 0.22 0.28 -0.23 -0.04 -1.23 0.00 0.00 174.94 173.93 3hsy s MET 355 N 1.22 1.65 0.07 2.79 -1.94 0.14 -0.69 119.30 122.54 3hsy s MET 355 Ca 0.16 -1.22 0.07 0.00 -1.71 0.00 0.00 55.69 52.99 3hsy s MET 355 Cb -0.14 -2.00 -0.03 0.00 2.01 0.00 0.00 34.83 34.66 3hsy s MET 355 CO 0.07 0.48 -0.18 -1.21 -0.01 0.00 0.00 175.02 174.16 3hsy s GLU 356 N -1.86 1.09 -0.65 2.03 2.02 -0.22 -0.78 118.70 120.32 3hsy s GLU 356 Ca 0.15 -1.00 -0.26 0.00 0.02 0.00 0.00 54.97 53.88 3hsy s GLU 356 Cb -0.10 -1.23 0.04 0.00 0.10 0.00 0.00 34.13 32.94 3hsy s GLU 356 CO 0.06 0.29 1.15 -1.17 0.02 0.00 0.00 175.26 175.62 3hsy s LEU 357 N -1.57 3.58 0.61 1.80 2.96 -0.08 -0.53 118.68 125.46 3hsy s LEU 357 Ca 0.04 -0.36 -0.02 0.00 -0.22 0.00 0.00 54.13 53.57 3hsy s LEU 357 Cb -0.09 -2.75 0.05 0.00 0.50 0.00 0.00 46.19 43.89 3hsy s LEU 357 CO 0.03 -1.58 0.87 -0.54 -1.32 0.00 0.00 176.35 173.81 3hsy s LYS 358 N 4.97 2.39 0.52 1.98 -0.14 -0.12 -4.61 119.74 124.74 3hsy s LYS 358 Ca 0.34 -0.59 0.17 0.00 -1.36 0.00 0.00 55.97 54.54 3hsy s LYS 358 Cb -0.10 -2.36 1.29 0.00 -1.68 0.00 0.00 37.83 34.97 3hsy s LYS 358 CO 0.18 -0.93 2.13 1.79 -0.76 0.00 0.00 175.35 177.76 3hsy h THR 359 N -0.20 0.96 0.00 2.17 1.35 -2.01 -0.49 112.91 114.70 3hsy h THR 359 Ca -0.43 -0.00 -0.13 0.00 -0.55 0.00 0.00 66.41 65.30 3hsy h THR 359 Cb 1.30 0.96 -0.02 0.00 -1.73 0.00 0.00 68.15 68.66 3hsy h THR 359 CO 0.55 0.00 -0.62 -1.13 -0.25 0.00 0.00 175.52 174.07 3hsy h ASN 360 N 0.00 0.00 -2.94 5.36 -0.73 -2.00 -3.50 115.58 111.77 3hsy h ASN 360 Ca 0.04 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.21 3hsy h ASN 360 Cb 0.15 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.74 3hsy h ASN 360 CO -0.00 0.62 0.00 0.61 -0.37 0.00 0.00 177.43 178.29 3hsy n GLY 361 N 1.10 0.00 3.75 1.57 0.00 -0.19 -5.11 105.19 106.32 3hsy n GLY 361 Ca 0.01 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 3hsy n GLY 361 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hsy s PRO 362 N -1.32 4.21 0.02 1.61 0.04 -1.26 -0.94 135.00 137.37 3hsy s PRO 362 Ca 0.00 2.41 0.02 0.00 0.04 0.00 0.00 61.00 63.46 3hsy s PRO 362 Cb 0.00 -3.07 -0.01 0.00 0.04 0.00 0.00 34.50 31.46 3hsy s PRO 362 CO 0.00 -0.48 -0.06 1.03 0.04 0.00 0.00 177.00 177.52 3hsy s ARG 363 N -0.64 0.47 -0.15 4.56 0.52 0.31 -4.88 118.95 119.15 3hsy s ARG 363 Ca 0.59 -0.49 -0.29 0.00 -0.52 0.00 0.00 55.73 55.02 3hsy s ARG 363 Cb -0.44 -0.34 -0.01 0.00 0.52 0.00 0.00 34.95 34.69 3hsy s ARG 363 CO 0.47 0.08 1.09 0.21 0.02 0.00 0.00 175.30 177.17 3hsy s LYS 364 N -0.90 4.33 -0.01 3.54 2.20 -1.26 -1.06 119.74 126.57 3hsy s LYS 364 Ca -0.05 1.47 0.20 0.00 -0.36 0.00 0.00 55.97 57.24 3hsy s LYS 364 Cb -0.06 -3.61 -0.26 0.00 -1.51 0.00 0.00 37.83 32.39 3hsy s LYS 364 CO 0.00 -0.50 0.67 0.44 -0.36 0.00 0.00 175.35 175.60 3hsy n ILE 365 N 4.95 0.00 -2.95 5.43 -5.35 0.14 -4.88 119.36 116.69 3hsy n ILE 365 Ca 0.11 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.37 3hsy n ILE 365 Cb 0.47 0.59 0.00 0.00 -1.74 0.00 0.00 39.64 38.96 3hsy n ILE 365 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hsy n GLY 366 N 1.41 -1.32 3.25 3.28 0.00 -1.20 0.68 105.19 111.29 3hsy n GLY 366 Ca 0.01 -0.95 -0.11 0.00 0.00 0.00 0.00 46.02 44.96 3hsy n GLY 366 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hsy s TYR 367 N -2.89 1.03 -0.04 1.61 1.13 -0.51 -0.65 117.35 117.03 3hsy s TYR 367 Ca 0.00 -1.28 0.02 0.00 -1.41 0.00 0.00 57.07 54.41 3hsy s TYR 367 Cb 0.00 -0.45 0.01 0.00 -1.10 0.00 0.00 41.96 40.42 3hsy s TYR 367 CO 0.00 -0.68 -0.09 -0.46 -2.51 0.00 0.00 175.55 171.81 3hsy s TRP 368 N -4.13 1.04 0.17 -3.49 -0.00 0.60 -0.73 118.94 112.39 3hsy s TRP 368 Ca 0.36 -0.30 0.03 0.00 -0.00 0.00 0.00 56.10 56.19 3hsy s TRP 368 Cb 0.06 -0.77 -0.05 0.00 -0.00 0.00 0.00 33.47 32.71 3hsy s TRP 368 CO 0.11 -0.16 -0.03 -1.54 -0.00 0.00 0.00 176.95 175.33 3hsy s SER 369 N 0.43 1.50 0.18 5.86 1.04 -0.99 -0.93 113.70 120.79 3hsy s SER 369 Ca -0.07 -1.12 -0.14 0.00 0.48 0.00 0.00 55.95 55.09 3hsy s SER 369 Cb -0.11 0.06 0.16 0.00 0.10 0.00 0.00 66.02 66.23 3hsy s SER 369 CO 0.01 -0.48 1.71 -0.33 0.98 0.00 0.00 173.24 175.13 3hsy h GLU 370 N 2.69 0.19 -0.13 4.02 5.08 -1.89 -0.12 114.58 124.42 3hsy h GLU 370 Ca -0.37 -0.01 -0.22 0.00 -1.00 0.00 0.00 59.36 57.76 3hsy h GLU 370 Cb 1.20 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.41 3hsy h GLU 370 CO 0.64 0.12 -0.78 -0.24 -1.00 0.00 0.00 179.01 177.75 3hsy h VAL 371 N 0.19 1.30 -0.01 3.13 3.04 -1.97 -3.34 116.25 118.60 3hsy h VAL 371 Ca 0.23 -2.02 0.00 0.00 -1.01 0.00 0.00 66.70 63.90 3hsy h VAL 371 Cb 0.32 2.02 0.00 0.00 -2.01 0.00 0.00 31.29 31.62 3hsy h VAL 371 CO -0.33 0.63 -0.44 0.47 -1.01 0.00 0.00 177.57 176.90 3hsy n ASP 372 N -3.91 1.47 0.00 3.17 8.00 -1.20 -5.08 116.55 119.01 3hsy n ASP 372 Ca -0.07 -1.24 0.00 0.00 0.71 0.00 0.00 54.79 54.20 3hsy n ASP 372 Cb 0.74 0.59 0.00 0.00 -0.02 0.00 0.00 41.12 42.43 3hsy n ASP 372 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3hsy n LYS 373 N -0.39 0.00 -3.23 -1.24 4.76 -0.06 -4.64 118.16 113.36 3hsy n LYS 373 Ca 0.06 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.11 3hsy n LYS 373 Cb 0.33 0.00 -0.06 0.00 -1.84 0.00 0.00 35.03 33.46 3hsy n LYS 373 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 3hsy s MET 374 N 0.00 4.23 -0.15 1.97 1.75 -1.26 -2.36 119.30 123.48 3hsy s MET 374 Ca 0.00 0.47 0.01 0.00 -1.25 0.00 0.00 55.69 54.92 3hsy s MET 374 Cb 0.00 -3.54 0.02 0.00 2.84 0.00 0.00 34.83 34.15 3hsy s MET 374 CO 0.00 -0.10 -0.17 0.08 -0.65 0.00 0.00 175.02 174.18 3hsy s VAL 375 N 1.46 1.79 0.38 10.11 1.01 0.09 -4.99 120.40 130.26 3hsy s VAL 375 Ca 0.26 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 61.21 3hsy s VAL 375 Cb -0.15 -1.64 -0.09 0.00 0.00 0.00 0.00 36.38 34.50 3hsy s VAL 375 CO 0.10 0.50 1.07 0.54 0.00 0.00 0.00 175.10 177.31 3hsy s VAL 376 N 1.29 3.62 0.00 2.92 0.11 -1.26 -1.42 120.40 125.65 3hsy s VAL 376 Ca 0.02 1.30 0.00 0.00 -2.93 0.00 0.00 61.98 60.37 3hsy s VAL 376 Cb -0.13 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 31.02 3hsy s VAL 376 CO -0.10 0.07 0.00 0.41 -3.33 0.00 0.00 175.10 172.15