#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 1.37 -0.07 0.53 1.04 -1.26 -1.59 113.70 113.72 3hsy s SER 5 Ca 0.00 -0.64 0.03 0.00 0.48 0.00 0.00 55.95 55.82 3hsy s SER 5 Cb 0.00 -0.01 0.01 0.00 0.10 0.00 0.00 66.02 66.12 3hsy s SER 5 CO 0.00 -0.16 -0.15 -0.63 0.98 0.00 0.00 173.24 173.28 3hsy s ILE 6 N -1.56 1.37 0.09 -1.02 -1.09 -0.89 -4.96 121.20 113.13 3hsy s ILE 6 Ca -0.03 -0.62 -0.30 0.00 -2.23 0.00 0.00 60.65 57.48 3hsy s ILE 6 Cb -0.08 -1.22 -0.05 0.00 -1.58 0.00 0.00 42.46 39.52 3hsy s ILE 6 CO 0.01 0.41 0.96 -1.10 -1.23 0.00 0.00 174.94 173.98 3hsy s GLN 7 N 0.56 4.67 0.13 2.79 -1.52 -1.26 -0.66 119.66 124.36 3hsy s GLN 7 Ca -0.15 1.43 0.04 0.00 -1.95 0.00 0.00 55.36 54.73 3hsy s GLN 7 Cb -0.16 -3.39 -0.04 0.00 -0.22 0.00 0.00 33.01 29.20 3hsy s GLN 7 CO 0.05 0.18 -0.10 0.96 -0.25 0.00 0.00 175.29 176.13 3hsy s ILE 8 N 0.15 1.07 0.17 1.08 -4.36 -0.39 -0.99 121.20 117.92 3hsy s ILE 8 Ca 0.47 -1.91 -0.02 0.00 -0.26 0.00 0.00 60.65 58.93 3hsy s ILE 8 Cb -0.23 -1.68 -0.05 0.00 1.25 0.00 0.00 42.46 41.76 3hsy s ILE 8 CO 0.29 -0.69 0.38 -0.83 0.24 0.00 0.00 174.94 174.33 3hsy s GLY 9 N -2.91 1.97 -0.14 6.27 0.00 0.07 -0.77 107.32 111.80 3hsy s GLY 9 Ca 0.13 -0.74 -0.03 0.00 0.00 0.00 0.00 44.72 44.08 3hsy s GLY 9 CO -0.00 -0.68 0.06 -0.32 0.00 0.00 0.00 173.10 172.16 3hsy s GLY 10 N -2.88 0.45 -0.35 0.20 0.00 -0.21 -0.45 107.32 104.07 3hsy s GLY 10 Ca 0.39 -0.31 -0.04 0.00 0.00 0.00 0.00 44.72 44.76 3hsy s GLY 10 CO 0.28 1.51 0.11 1.08 0.00 0.00 0.00 173.10 176.08 3hsy s LEU 11 N 2.04 4.51 -0.12 0.66 1.43 0.49 -0.73 118.68 126.96 3hsy s LEU 11 Ca 0.02 -1.47 -0.00 0.00 -1.03 0.00 0.00 54.13 51.65 3hsy s LEU 11 Cb -0.15 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 3hsy s LEU 11 CO -0.07 -0.38 -0.11 -0.36 0.23 0.00 0.00 176.35 175.65 3hsy s PHE 12 N 1.28 2.85 0.62 0.29 0.40 -0.61 -2.79 117.98 120.02 3hsy s PHE 12 Ca 0.00 -0.46 -0.14 0.00 -0.60 0.00 0.00 56.93 55.73 3hsy s PHE 12 Cb -0.21 -1.83 -0.02 0.00 0.51 0.00 0.00 43.02 41.47 3hsy s PHE 12 CO -0.01 -0.08 1.06 -2.14 0.70 0.00 0.00 175.22 174.75 3hsy s PRO 13 N 0.12 3.21 0.27 0.24 0.02 -1.26 -1.46 135.00 136.14 3hsy s PRO 13 Ca -0.05 1.13 -0.30 0.00 0.02 0.00 0.00 61.00 61.80 3hsy s PRO 13 Cb -0.15 -2.02 -0.11 0.00 0.02 0.00 0.00 34.50 32.24 3hsy s PRO 13 CO 0.04 -0.89 1.60 1.03 -0.33 0.00 0.00 177.00 178.45 3hsy s ARG 14 N -4.34 4.14 0.00 5.54 0.52 -1.22 -2.34 118.95 121.25 3hsy s ARG 14 Ca 0.62 2.55 0.00 0.00 -0.52 0.00 0.00 55.73 58.38 3hsy s ARG 14 Cb -0.15 -3.05 0.00 0.00 0.52 0.00 0.00 34.95 32.27 3hsy s ARG 14 CO 0.42 -0.63 0.00 0.41 0.02 0.00 0.00 175.30 175.52 3hsy n GLY 15 N 2.55 0.72 2.82 -3.53 0.00 -1.26 -4.94 105.19 101.54 3hsy n GLY 15 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.78 6.51 -0.03 4.61 0.00 -0.99 -4.70 120.51 125.12 3hsy n ALA 16 Ca 0.00 -3.89 -0.12 0.00 0.00 0.00 0.00 53.44 49.43 3hsy n ALA 16 Cb 0.00 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 17.34 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 3.03 0.19 -0.12 0.00 3.32 -1.91 -1.75 116.42 119.18 3hsy h ASP 17 Ca 0.53 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 57.21 3hsy h ASP 17 Cb 0.19 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 3hsy h ASP 17 CO 1.31 0.42 -0.21 -0.61 -1.72 0.00 0.00 179.24 178.43 3hsy h GLN 18 N -0.05 0.54 -0.78 3.56 4.15 -1.84 -1.55 115.11 119.14 3hsy h GLN 18 Ca 0.03 -0.19 -0.05 0.00 0.77 0.00 0.00 58.65 59.21 3hsy h GLN 18 Cb 0.31 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.93 3hsy h GLN 18 CO 0.00 0.72 0.27 0.93 -1.93 0.00 0.00 178.83 178.83 3hsy h GLU 19 N 0.49 1.19 -0.71 1.69 3.07 -1.85 -0.02 114.58 118.44 3hsy h GLU 19 Ca 0.08 -0.24 -0.07 0.00 -0.50 0.00 0.00 59.36 58.63 3hsy h GLU 19 Cb 0.63 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 3hsy h GLU 19 CO 0.04 0.98 0.17 -0.92 -1.40 0.00 0.00 179.01 177.88 3hsy h TYR 20 N 1.15 1.20 -0.76 4.33 3.20 -0.93 0.15 116.97 125.32 3hsy h TYR 20 Ca 0.25 -0.15 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 3hsy h TYR 20 Cb 0.27 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 38.16 3hsy h TYR 20 CO 0.02 0.98 0.44 0.77 -1.64 0.00 0.00 178.16 178.73 3hsy h SER 21 N 1.08 0.92 -0.47 -2.11 0.02 -0.86 -0.25 113.55 111.88 3hsy h SER 21 Ca 0.22 -0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 3hsy h SER 21 Cb 0.39 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3hsy h SER 21 CO 0.00 0.73 0.08 0.00 -1.14 0.00 0.00 176.83 176.50 3hsy h ALA 22 N 1.23 1.14 -0.09 3.77 0.00 -0.63 -0.25 119.26 124.43 3hsy h ALA 22 Ca 0.27 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3hsy h ALA 22 Cb -0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3hsy h ALA 22 CO -0.05 0.57 0.05 0.35 0.00 0.00 0.00 179.25 180.17 3hsy h PHE 23 N 0.80 0.12 -0.69 0.00 3.57 -0.42 0.08 116.94 120.40 3hsy h PHE 23 Ca 0.17 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 3hsy h PHE 23 Cb 0.37 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3hsy h PHE 23 CO 0.02 0.14 0.37 0.00 -2.23 0.00 0.00 178.31 176.62 3hsy h ARG 24 N 0.06 0.97 -0.72 1.11 3.08 -0.74 -0.80 114.38 117.35 3hsy h ARG 24 Ca 0.03 -0.12 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3hsy h ARG 24 Cb 0.06 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 3hsy h ARG 24 CO -0.01 0.73 0.20 0.28 -1.07 0.00 0.00 179.97 180.11 3hsy h VAL 25 N 0.95 1.26 -0.66 2.04 2.07 -0.94 -2.50 116.25 118.47 3hsy h VAL 25 Ca 0.24 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3hsy h VAL 25 Cb 0.05 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 3hsy h VAL 25 CO -0.04 0.36 0.42 1.23 0.02 0.00 0.00 177.57 179.57 3hsy h GLY 26 N 1.10 0.95 1.22 2.17 0.00 -0.61 -0.10 103.07 107.80 3hsy h GLY 26 Ca 0.23 -0.38 0.01 0.00 0.00 0.00 0.00 47.33 47.20 3hsy h GLY 26 CO -0.00 0.37 0.52 -0.33 0.00 0.00 0.00 176.54 177.09 3hsy h MET 27 N 0.90 1.01 -0.01 4.80 2.07 -0.81 -0.59 114.93 122.30 3hsy h MET 27 Ca 0.24 -0.06 -0.01 0.00 -2.07 0.00 0.00 59.70 57.80 3hsy h MET 27 Cb -0.07 -0.23 0.00 0.00 -1.87 0.00 0.00 31.60 29.44 3hsy h MET 27 CO -0.05 0.67 -0.02 0.28 1.07 0.00 0.00 176.91 178.86 3hsy h VAL 28 N 1.04 1.45 -0.66 -2.22 2.07 -1.03 -2.72 116.25 114.18 3hsy h VAL 28 Ca 0.29 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.52 3hsy h VAL 28 Cb -0.10 2.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.94 3hsy h VAL 28 CO -0.07 0.36 0.35 -0.61 0.02 0.00 0.00 177.57 177.62 3hsy h GLN 29 N -0.51 0.62 -0.02 1.57 5.75 -0.60 -3.08 115.11 118.84 3hsy h GLN 29 Ca 0.00 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 3hsy h GLN 29 Cb 0.59 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.00 3hsy h GLN 29 CO 0.01 0.41 -0.24 1.19 -2.65 0.00 0.00 178.83 177.55 3hsy n PHE 30 N -4.82 0.00 -1.98 3.99 3.72 -0.27 -4.91 117.46 113.20 3hsy n PHE 30 Ca 0.09 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.16 3hsy n PHE 30 Cb 0.19 -0.01 0.02 0.00 -0.94 0.00 0.00 39.48 38.74 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 -2.26 5.65 0.28 4.37 1.04 -1.03 -4.95 113.70 116.80 3hsy s SER 31 Ca 0.24 1.84 0.02 0.00 0.48 0.00 0.00 55.95 58.53 3hsy s SER 31 Cb 0.19 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.73 3hsy s SER 31 CO 0.44 -1.26 0.13 0.42 0.98 0.00 0.00 173.24 173.96 3hsy s THR 32 N -2.45 0.38 -0.28 2.02 -4.23 -0.21 -5.01 115.64 105.86 3hsy s THR 32 Ca 0.64 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.40 3hsy s THR 32 Cb -0.17 -2.56 0.26 0.00 1.34 0.00 0.00 72.50 71.38 3hsy s THR 32 CO 0.38 0.00 1.76 0.77 -0.54 0.00 0.00 174.62 176.99 3hsy h SER 33 N 2.31 0.00 0.00 3.99 4.64 -2.00 -3.04 113.55 119.45 3hsy h SER 33 Ca -0.35 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.92 3hsy h SER 33 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 3hsy h SER 33 CO 0.55 0.00 -1.89 -0.62 -0.87 0.00 0.00 176.83 174.00 3hsy n GLU 34 N -2.38 0.64 -3.67 4.77 1.02 -1.26 -4.71 120.64 115.05 3hsy n GLU 34 Ca 0.01 -0.15 -0.12 0.00 -0.02 0.00 0.00 57.16 56.88 3hsy n GLU 34 Cb 0.17 -1.44 -0.09 0.00 -0.02 0.00 0.00 31.44 30.07 3hsy n GLU 34 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 3hsy s PHE 35 N -3.17 -0.71 0.06 -0.32 5.36 -1.15 -0.45 117.98 117.60 3hsy s PHE 35 Ca -0.07 1.61 -0.09 0.00 -0.96 0.00 0.00 56.93 57.42 3hsy s PHE 35 Cb 0.11 0.30 0.00 0.00 -0.34 0.00 0.00 43.02 43.09 3hsy s PHE 35 CO 0.76 -0.35 0.19 -0.98 -1.46 0.00 0.00 175.22 173.37 3hsy s ARG 36 N 0.73 0.75 0.03 10.12 1.70 -0.62 -1.05 118.95 130.61 3hsy s ARG 36 Ca -0.03 -0.78 -0.12 0.00 -0.47 0.00 0.00 55.73 54.32 3hsy s ARG 36 Cb -0.05 0.31 -0.06 0.00 -0.57 0.00 0.00 34.95 34.58 3hsy s ARG 36 CO -0.05 -0.22 0.40 -0.51 -1.08 0.00 0.00 175.30 173.83 3hsy s LEU 37 N -2.43 4.42 -0.37 -1.89 1.43 -1.26 -2.11 118.68 116.47 3hsy s LEU 37 Ca -0.01 0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 53.96 3hsy s LEU 37 Cb 0.02 -2.74 0.10 0.00 0.03 0.00 0.00 46.19 43.60 3hsy s LEU 37 CO -0.07 0.26 0.13 -0.89 0.23 0.00 0.00 176.35 176.01 3hsy s THR 38 N -1.21 2.94 0.31 5.49 2.01 0.16 -4.88 115.64 120.46 3hsy s THR 38 Ca 0.27 -2.05 -0.12 0.00 0.31 0.00 0.00 61.69 60.10 3hsy s THR 38 Cb -0.15 -3.01 -0.08 0.00 0.01 0.00 0.00 72.50 69.27 3hsy s THR 38 CO 0.15 -0.58 0.68 -2.16 -0.69 0.00 0.00 174.62 172.02 3hsy s PRO 39 N 1.09 3.89 -0.21 4.92 0.04 -1.26 -1.27 135.00 142.20 3hsy s PRO 39 Ca 0.07 0.49 0.01 0.00 0.04 0.00 0.00 61.00 61.61 3hsy s PRO 39 Cb -0.21 -2.50 0.04 0.00 0.04 0.00 0.00 34.50 31.87 3hsy s PRO 39 CO -0.05 0.17 -0.12 -1.01 0.04 0.00 0.00 177.00 176.03 3hsy s HIS 40 N -2.01 2.68 -0.22 0.56 3.76 0.05 -4.91 115.29 115.20 3hsy s HIS 40 Ca 0.51 -1.78 -0.10 0.00 -0.15 0.00 0.00 55.06 53.55 3hsy s HIS 40 Cb -0.10 -1.76 -0.05 0.00 1.11 0.00 0.00 32.58 31.78 3hsy s HIS 40 CO 0.21 -0.79 0.13 0.42 -0.85 0.00 0.00 174.74 173.86 3hsy s ILE 41 N 1.31 5.15 0.02 0.60 -1.09 -1.26 -1.05 121.20 124.89 3hsy s ILE 41 Ca -0.02 0.10 0.07 0.00 -2.23 0.00 0.00 60.65 58.58 3hsy s ILE 41 Cb -0.17 -3.38 -0.03 0.00 -1.58 0.00 0.00 42.46 37.30 3hsy s ILE 41 CO -0.08 0.38 -0.20 -1.81 -1.23 0.00 0.00 174.94 172.00 3hsy s ASP 42 N 0.88 3.65 -0.21 3.58 1.01 0.09 -4.97 116.67 120.69 3hsy s ASP 42 Ca 0.06 -0.43 0.01 0.00 0.71 0.00 0.00 52.55 52.91 3hsy s ASP 42 Cb -0.13 -0.56 0.03 0.00 1.01 0.00 0.00 42.92 43.27 3hsy s ASP 42 CO 0.03 0.28 -0.16 0.20 0.21 0.00 0.00 175.17 175.73 3hsy s ASN 43 N -1.22 3.61 0.09 0.27 0.01 -1.26 -1.58 114.94 114.87 3hsy s ASN 43 Ca 0.13 -0.82 0.01 0.00 -0.71 0.00 0.00 52.86 51.47 3hsy s ASN 43 Cb -0.10 -1.53 -0.04 0.00 0.41 0.00 0.00 41.25 39.98 3hsy s ASN 43 CO 0.03 -0.06 -0.06 -1.48 -1.51 0.00 0.00 177.10 174.03 3hsy s LEU 44 N 1.26 2.49 -0.72 0.60 2.34 -0.54 -4.94 118.68 119.17 3hsy s LEU 44 Ca 0.02 -1.01 -0.26 0.00 0.06 0.00 0.00 54.13 52.93 3hsy s LEU 44 Cb -0.15 -0.03 0.04 0.00 -0.56 0.00 0.00 46.19 45.49 3hsy s LEU 44 CO -0.10 -0.49 1.23 -0.70 -1.06 0.00 0.00 176.35 175.23 3hsy s GLU 45 N -3.85 3.20 0.58 1.48 2.12 -1.26 -3.38 118.70 117.59 3hsy s GLU 45 Ca 0.12 -0.29 0.35 0.00 0.36 0.00 0.00 54.97 55.50 3hsy s GLU 45 Cb 0.06 -4.18 1.77 0.00 0.26 0.00 0.00 34.13 32.04 3hsy s GLU 45 CO -0.05 -2.08 2.15 -0.39 -0.54 0.00 0.00 175.26 174.35 3hsy h VAL 46 N 6.03 0.21 0.00 3.70 -1.51 -1.93 -1.92 116.25 120.83 3hsy h VAL 46 Ca -0.28 -0.34 0.00 0.00 -1.23 0.00 0.00 66.70 64.85 3hsy h VAL 46 Cb 1.05 1.27 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 3hsy h VAL 46 CO 1.26 0.04 0.00 0.00 -1.23 0.00 0.00 177.57 177.64 3hsy n ALA 47 N -2.16 2.07 -3.20 5.19 0.00 -1.26 -4.26 120.51 116.90 3hsy n ALA 47 Ca -0.02 -0.09 -0.40 0.00 0.00 0.00 0.00 53.44 52.94 3hsy n ALA 47 Cb 0.20 -1.37 -0.10 0.00 0.00 0.00 0.00 19.45 18.18 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 -2.90 5.66 0.38 0.00 3.84 -0.72 -4.70 114.94 116.50 3hsy s ASN 48 Ca 0.14 -1.41 0.11 0.00 0.21 0.00 0.00 52.86 51.90 3hsy s ASN 48 Cb 0.15 -2.00 0.75 0.00 -0.55 0.00 0.00 41.25 39.61 3hsy s ASN 48 CO 0.40 -0.51 1.87 0.28 -2.79 0.00 0.00 177.10 176.35 3hsy h SER 49 N 8.42 0.14 -0.36 -4.21 0.02 -1.85 -0.84 113.55 114.87 3hsy h SER 49 Ca -0.23 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.66 3hsy h SER 49 Cb 1.09 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 3hsy h SER 49 CO 0.74 0.39 0.14 0.15 -1.14 0.00 0.00 176.83 177.11 3hsy h PHE 50 N 0.13 0.55 -0.43 3.45 3.04 -1.95 0.11 116.94 121.85 3hsy h PHE 50 Ca 0.02 -0.04 -0.10 0.00 3.98 0.00 0.00 57.97 61.83 3hsy h PHE 50 Cb 0.51 -0.16 -0.02 0.00 2.56 0.00 0.00 35.95 38.84 3hsy h PHE 50 CO 0.00 0.51 -0.15 0.00 -2.02 0.00 0.00 178.31 176.66 3hsy h ALA 51 N 0.98 0.94 -0.59 2.41 0.00 -1.70 -0.85 119.26 120.44 3hsy h ALA 51 Ca 0.12 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3hsy h ALA 51 Cb 0.20 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hsy h ALA 51 CO -0.01 0.62 0.06 0.28 0.00 0.00 0.00 179.25 180.20 3hsy h VAL 52 N 0.71 1.26 -0.39 0.00 2.07 -1.03 -1.31 116.25 117.56 3hsy h VAL 52 Ca 0.11 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.58 3hsy h VAL 52 Cb 0.64 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 3hsy h VAL 52 CO 0.04 0.38 0.25 0.74 0.02 0.00 0.00 177.57 179.01 3hsy h THR 53 N 0.91 1.11 -0.66 2.57 2.02 -0.63 -0.66 112.91 117.56 3hsy h THR 53 Ca 0.18 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 3hsy h THR 53 Cb 0.47 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 3hsy h THR 53 CO 0.02 0.10 0.38 -1.13 0.37 0.00 0.00 175.52 175.26 3hsy h ASN 54 N 0.52 0.81 -0.28 4.18 -0.73 -0.87 -0.76 115.58 118.45 3hsy h ASN 54 Ca 0.14 -0.08 -0.05 0.00 1.87 0.00 0.00 56.30 58.18 3hsy h ASN 54 Cb -0.05 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.33 3hsy h ASN 54 CO -0.03 0.66 -0.02 0.00 -0.37 0.00 0.00 177.43 177.67 3hsy h ALA 55 N 1.19 0.38 -0.45 1.57 0.00 -0.96 -1.25 119.26 119.74 3hsy h ALA 55 Ca 0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3hsy h ALA 55 Cb 0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3hsy h ALA 55 CO -0.04 0.13 0.18 0.35 0.00 0.00 0.00 179.25 179.87 3hsy h PHE 56 N 0.28 0.68 -0.17 0.00 3.04 -1.00 -2.25 116.94 117.52 3hsy h PHE 56 Ca 0.08 -0.05 -0.11 0.00 3.98 0.00 0.00 57.97 61.86 3hsy h PHE 56 Cb 0.45 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.75 3hsy h PHE 56 CO 0.04 0.59 -0.39 0.00 -2.02 0.00 0.00 178.31 176.53 3hsy h SER 58 N 0.31 1.04 -0.26 0.00 0.87 -1.00 -0.07 113.55 114.44 3hsy h SER 58 Ca 0.03 -0.18 -0.07 0.00 -1.23 0.00 0.00 61.79 60.35 3hsy h SER 58 Cb 0.82 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 3hsy h SER 58 CO 0.07 0.95 -0.10 1.56 -0.53 0.00 0.00 176.83 178.77 3hsy h GLN 59 N 1.08 0.53 -0.74 2.24 1.08 -0.96 -1.79 115.11 116.55 3hsy h GLN 59 Ca 0.24 -0.22 0.13 0.00 -1.45 0.00 0.00 58.65 57.35 3hsy h GLN 59 Cb 0.26 -0.02 -0.09 0.00 -0.05 0.00 0.00 27.48 27.58 3hsy h GLN 59 CO -0.01 0.77 0.32 0.35 -0.95 0.00 0.00 178.83 179.30 3hsy h PHE 60 N 0.27 0.55 -0.76 2.96 3.57 -1.04 -2.18 116.94 120.31 3hsy h PHE 60 Ca 0.06 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 3hsy h PHE 60 Cb 0.59 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.16 3hsy h PHE 60 CO 0.06 0.11 0.42 1.03 -2.23 0.00 0.00 178.31 177.70 3hsy h SER 61 N 0.49 0.94 0.61 0.41 0.87 -0.73 -2.42 113.55 113.72 3hsy h SER 61 Ca 0.40 -0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.84 3hsy h SER 61 Cb 0.56 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 3hsy h SER 61 CO -0.37 0.76 -0.12 0.03 -0.53 0.00 0.00 176.83 176.61 3hsy h ARG 62 N 1.05 0.00 -1.58 2.24 3.08 -0.71 -3.46 114.38 115.00 3hsy h ARG 62 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3hsy h ARG 62 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 3hsy h ARG 62 CO -0.04 0.12 0.00 0.41 -1.07 0.00 0.00 179.97 179.38 3hsy n GLY 63 N -0.36 0.62 3.89 0.04 0.00 -0.91 -4.63 105.19 103.84 3hsy n GLY 63 Ca -0.01 -0.37 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 3hsy n GLY 63 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hsy s VAL 64 N -2.46 4.92 0.17 1.61 -7.23 -1.23 -4.89 120.40 111.30 3hsy s VAL 64 Ca 0.00 0.30 0.10 0.00 -1.81 0.00 0.00 61.98 60.58 3hsy s VAL 64 Cb 0.00 -3.73 -0.08 0.00 0.56 0.00 0.00 36.38 33.14 3hsy s VAL 64 CO 0.00 -0.39 1.48 1.88 -0.31 0.00 0.00 175.10 177.76 3hsy h TYR 65 N 1.54 0.00 -2.73 2.82 0.05 -1.45 -3.47 116.97 113.73 3hsy h TYR 65 Ca -0.47 0.00 0.03 0.00 0.05 0.00 0.00 58.73 58.34 3hsy h TYR 65 Cb 1.19 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 38.80 3hsy h TYR 65 CO 0.59 0.74 0.32 0.00 -1.05 0.00 0.00 178.16 178.75 3hsy s ALA 66 N -3.22 -1.67 -0.17 3.88 0.00 -1.26 -4.42 121.76 114.91 3hsy s ALA 66 Ca 0.00 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.63 3hsy s ALA 66 Cb 0.11 0.71 0.01 0.00 0.00 0.00 0.00 23.12 23.96 3hsy s ALA 66 CO 0.78 -0.75 -0.19 0.42 0.00 0.00 0.00 175.76 176.02 3hsy s ILE 67 N -3.52 2.25 -0.08 0.00 1.01 0.01 -0.75 121.20 120.12 3hsy s ILE 67 Ca 0.03 -0.90 -0.19 0.00 0.00 0.00 0.00 60.65 59.60 3hsy s ILE 67 Cb -0.01 -1.94 -0.05 0.00 0.01 0.00 0.00 42.46 40.48 3hsy s ILE 67 CO -0.11 0.53 0.50 0.12 0.00 0.00 0.00 174.94 175.99 3hsy s PHE 68 N 1.06 3.57 0.00 3.97 5.36 0.40 -0.96 117.98 131.39 3hsy s PHE 68 Ca -0.01 0.98 0.00 0.00 -0.96 0.00 0.00 56.93 56.95 3hsy s PHE 68 Cb -0.14 -2.55 0.00 0.00 -0.34 0.00 0.00 43.02 39.99 3hsy s PHE 68 CO -0.06 0.25 0.00 0.41 -1.46 0.00 0.00 175.22 174.36 3hsy n GLY 69 N 2.93 1.07 3.32 13.12 0.00 -0.64 -0.38 105.19 124.60 3hsy n GLY 69 Ca -0.07 -0.84 -0.20 0.00 0.00 0.00 0.00 46.02 44.91 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 -4.21 1.68 0.22 1.61 0.40 -1.12 -4.01 117.98 112.55 3hsy s PHE 70 Ca 0.00 -0.53 -0.01 0.00 -0.60 0.00 0.00 56.93 55.79 3hsy s PHE 70 Cb 0.00 -0.82 -0.04 0.00 0.51 0.00 0.00 43.02 42.67 3hsy s PHE 70 CO 0.00 0.29 0.16 1.52 0.70 0.00 0.00 175.22 177.90 3hsy s TYR 71 N -2.42 1.19 0.07 0.36 -0.85 -1.26 -4.98 117.35 109.46 3hsy s TYR 71 Ca 0.17 -1.38 0.01 0.00 -0.52 0.00 0.00 57.07 55.34 3hsy s TYR 71 Cb -0.04 -0.54 -0.00 0.00 0.38 0.00 0.00 41.96 41.76 3hsy s TYR 71 CO 0.06 -0.68 0.03 -0.40 -1.52 0.00 0.00 175.55 173.03 3hsy n ASP 72 N -0.42 1.01 -0.34 -0.18 5.68 -1.26 -4.78 116.55 116.25 3hsy n ASP 72 Ca 0.02 -1.39 0.12 0.00 -0.50 0.00 0.00 54.79 53.05 3hsy n ASP 72 Cb 0.65 0.18 0.32 0.00 -1.14 0.00 0.00 41.12 41.14 3hsy n ASP 72 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3hsy h LYS 73 N 0.00 0.76 0.00 0.11 3.64 -1.82 0.01 116.57 119.27 3hsy h LYS 73 Ca -0.06 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.21 3hsy h LYS 73 Cb 0.22 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3hsy h LYS 73 CO 0.09 0.50 -0.33 0.87 -2.27 0.00 0.00 179.45 178.31 3hsy h LYS 74 N 0.78 0.00 -0.01 1.90 1.57 -1.89 -3.35 116.57 115.58 3hsy h LYS 74 Ca 0.55 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.33 3hsy h LYS 74 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3hsy h LYS 74 CO -0.33 0.33 -0.13 -1.13 -0.57 0.00 0.00 179.45 177.61 3hsy n SER 75 N -3.21 1.08 -0.16 0.86 3.41 -0.67 -4.67 113.62 110.25 3hsy n SER 75 Ca 0.02 -1.04 0.02 0.00 -0.26 0.00 0.00 58.87 57.61 3hsy n SER 75 Cb 0.64 0.42 0.29 0.00 -0.26 0.00 0.00 64.21 65.30 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 0.86 1.16 -0.12 -3.33 3.04 -1.17 -1.99 116.25 114.71 3hsy h VAL 76 Ca 0.00 -0.31 -0.10 0.00 -1.01 0.00 0.00 66.70 65.29 3hsy h VAL 76 Cb 0.25 0.19 -0.01 0.00 -2.01 0.00 0.00 31.29 29.71 3hsy h VAL 76 CO 0.00 0.16 -0.37 0.78 -1.01 0.00 0.00 177.57 177.14 3hsy h ASN 77 N 0.90 0.25 -0.16 3.17 4.21 -1.84 -0.99 115.58 121.12 3hsy h ASN 77 Ca 0.25 -0.09 0.01 0.00 1.21 0.00 0.00 56.30 57.67 3hsy h ASN 77 Cb -0.08 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.04 3hsy h ASN 77 CO -0.06 0.60 0.08 0.74 -1.29 0.00 0.00 177.43 177.51 3hsy h THR 78 N 0.21 1.01 -0.04 2.81 2.02 -1.68 -1.37 112.91 115.87 3hsy h THR 78 Ca 0.02 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 3hsy h THR 78 Cb 0.75 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.97 3hsy h THR 78 CO 0.06 0.03 0.02 0.40 0.37 0.00 0.00 175.52 176.40 3hsy h ILE 79 N 0.18 1.11 -0.63 3.11 1.08 -1.06 -0.23 117.51 121.08 3hsy h ILE 79 Ca 0.06 -0.34 -0.06 0.00 -0.39 0.00 0.00 64.86 64.14 3hsy h ILE 79 Cb 0.00 1.27 -0.03 0.00 -3.07 0.00 0.00 36.82 35.00 3hsy h ILE 79 CO -0.04 0.09 0.18 0.71 -0.69 0.00 0.00 178.15 178.40 3hsy h THR 80 N -0.07 1.25 -0.28 -0.27 1.35 -1.21 0.39 112.91 114.07 3hsy h THR 80 Ca 0.01 -0.88 -0.13 0.00 -0.55 0.00 0.00 66.41 64.87 3hsy h THR 80 Cb 0.14 0.62 -0.00 0.00 -1.73 0.00 0.00 68.15 67.17 3hsy h THR 80 CO -0.00 0.33 -0.31 -1.28 -0.25 0.00 0.00 175.52 174.01 3hsy h SER 81 N 0.92 0.77 -0.32 5.36 0.87 -1.18 -1.74 113.55 118.22 3hsy h SER 81 Ca 0.20 -0.48 -0.10 0.00 -1.23 0.00 0.00 61.79 60.18 3hsy h SER 81 Cb 0.32 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 3hsy h SER 81 CO -0.00 1.09 -0.19 -0.26 -0.53 0.00 0.00 176.83 176.95 3hsy h PHE 82 N 0.45 0.81 -0.09 2.24 -1.00 -0.89 -0.93 116.94 117.54 3hsy h PHE 82 Ca 0.04 -0.21 0.03 0.00 2.81 0.00 0.00 57.97 60.64 3hsy h PHE 82 Cb 0.89 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 40.23 3hsy h PHE 82 CO 0.07 0.92 -0.10 0.00 -1.61 0.00 0.00 178.31 177.60 3hsy h GLY 84 N -0.13 0.65 0.28 0.00 0.00 -1.25 0.10 103.07 102.72 3hsy h GLY 84 Ca 0.07 -0.39 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 3hsy h GLY 84 CO -0.17 0.36 -0.31 -0.84 0.00 0.00 0.00 176.54 175.59 3hsy h THR 85 N 0.58 1.68 0.00 4.70 2.02 -0.97 -3.36 112.91 117.56 3hsy h THR 85 Ca 0.12 -2.39 0.00 0.00 0.77 0.00 0.00 66.41 64.91 3hsy h THR 85 Cb 0.34 3.29 0.00 0.00 -1.74 0.00 0.00 68.15 70.03 3hsy h THR 85 CO 0.01 0.64 -0.19 -0.07 0.37 0.00 0.00 175.52 176.28 3hsy h LEU 86 N -0.74 0.00 -1.68 2.58 3.38 -0.86 -3.45 115.31 114.53 3hsy h LEU 86 Ca -0.05 -0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.65 3hsy h LEU 86 Cb 1.23 0.00 0.11 0.00 0.09 0.00 0.00 40.66 42.09 3hsy h LEU 86 CO 0.06 0.02 -0.50 1.41 0.09 0.00 0.00 178.44 179.52 3hsy n HIS 87 N -2.46 -1.48 -4.71 1.13 8.25 0.35 -1.43 115.22 114.86 3hsy n HIS 87 Ca 0.04 0.62 -0.31 0.00 -0.26 0.00 0.00 57.72 57.82 3hsy n HIS 87 Cb 0.46 -3.99 -0.17 0.00 1.12 0.00 0.00 29.99 27.42 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 -3.23 1.86 0.24 1.59 1.01 -1.14 -4.49 120.40 116.23 3hsy s VAL 88 Ca 0.04 -0.87 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 3hsy s VAL 88 Cb -0.02 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.62 3hsy s VAL 88 CO 0.48 0.51 1.13 -0.44 0.00 0.00 0.00 175.10 176.78 3hsy s SER 89 N 0.76 7.20 -0.15 3.32 0.01 -1.26 -4.61 113.70 118.98 3hsy s SER 89 Ca -0.10 2.24 0.02 0.00 1.31 0.00 0.00 55.95 59.42 3hsy s SER 89 Cb -0.16 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.47 3hsy s SER 89 CO 0.00 -0.23 -0.20 0.12 0.41 0.00 0.00 173.24 173.34 3hsy s PHE 90 N -0.71 2.62 -0.11 2.43 5.36 -0.21 -0.81 117.98 126.55 3hsy s PHE 90 Ca 0.48 -1.40 0.00 0.00 -0.96 0.00 0.00 56.93 55.05 3hsy s PHE 90 Cb -0.32 -1.80 -0.02 0.00 -0.34 0.00 0.00 43.02 40.54 3hsy s PHE 90 CO 0.39 -0.66 -0.12 -1.50 -1.46 0.00 0.00 175.22 171.86 3hsy s ILE 91 N 1.01 3.15 -0.05 3.12 2.07 -0.13 -0.54 121.20 129.81 3hsy s ILE 91 Ca -0.03 -0.64 -0.14 0.00 -1.41 0.00 0.00 60.65 58.43 3hsy s ILE 91 Cb -0.15 -2.31 0.03 0.00 0.13 0.00 0.00 42.46 40.17 3hsy s ILE 91 CO -0.06 0.54 0.32 0.28 -1.91 0.00 0.00 174.94 174.11 3hsy s THR 92 N 0.07 0.04 -2.06 4.00 -1.32 -0.63 -1.63 115.64 114.10 3hsy s THR 92 Ca -0.05 -0.31 0.17 0.00 -1.21 0.00 0.00 61.69 60.29 3hsy s THR 92 Cb -0.14 -0.56 0.45 0.00 -1.51 0.00 0.00 72.50 70.73 3hsy s THR 92 CO 0.04 -0.17 1.39 -0.81 -2.21 0.00 0.00 174.62 172.87 3hsy n PRO 93 N 1.85 2.16 -1.51 7.08 -0.04 -1.26 -0.80 135.00 142.49 3hsy n PRO 93 Ca -0.19 -1.79 -0.29 0.00 -0.04 0.00 0.00 63.50 61.19 3hsy n PRO 93 Cb 0.57 -1.40 0.17 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 -1.09 2.86 0.24 3.54 0.01 -1.26 -4.56 113.70 113.44 3hsy s SER 94 Ca 0.34 0.76 -0.31 0.00 1.31 0.00 0.00 55.95 58.05 3hsy s SER 94 Cb 0.18 -1.16 -0.13 0.00 0.21 0.00 0.00 66.02 65.12 3hsy s SER 94 CO 0.24 -2.94 1.56 0.33 0.41 0.00 0.00 173.24 172.84 3hsy n PHE 95 N -3.99 2.52 -2.36 2.43 7.35 -1.26 -4.52 117.46 117.63 3hsy n PHE 95 Ca 0.10 0.28 -0.36 0.00 -0.76 0.00 0.00 57.45 56.70 3hsy n PHE 95 Cb 0.59 -2.56 -0.02 0.00 0.35 0.00 0.00 39.48 37.85 3hsy n PHE 95 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3hsy s PRO 96 N 0.06 3.81 0.29 -7.13 0.04 -1.26 -5.00 135.00 125.81 3hsy s PRO 96 Ca 0.70 1.64 -0.22 0.00 0.04 0.00 0.00 61.00 63.15 3hsy s PRO 96 Cb -0.58 -2.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.52 3hsy s PRO 96 CO 0.44 -0.48 0.84 0.95 0.04 0.00 0.00 177.00 178.79 3hsy s THR 97 N -1.66 4.41 0.23 1.26 -4.23 -1.26 -4.97 115.64 109.43 3hsy s THR 97 Ca 0.64 1.50 -0.07 0.00 -1.18 0.00 0.00 61.69 62.58 3hsy s THR 97 Cb -0.25 -3.87 0.18 0.00 1.34 0.00 0.00 72.50 69.90 3hsy s THR 97 CO 0.30 0.09 1.81 0.44 -0.54 0.00 0.00 174.62 176.72 3hsy h ASP 98 N 3.05 1.10 -3.54 3.99 5.19 -2.02 -3.45 116.42 120.74 3hsy h ASP 98 Ca -0.48 -0.14 0.00 0.00 -0.62 0.00 0.00 57.03 55.79 3hsy h ASP 98 Cb 1.19 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.42 3hsy h ASP 98 CO 0.65 0.94 0.00 0.61 -3.12 0.00 0.00 179.24 178.32 3hsy n GLY 99 N -0.98 1.26 3.81 2.75 0.00 -1.26 -5.10 105.19 105.67 3hsy n GLY 99 Ca 0.08 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 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 0.57 5.33 -0.21 2.61 2.01 -1.26 -5.09 115.64 119.59 3hsy s THR 100 Ca 0.00 0.45 -0.05 0.00 0.31 0.00 0.00 61.69 62.40 3hsy s THR 100 Cb 0.00 -3.54 0.11 0.00 0.01 0.00 0.00 72.50 69.07 3hsy s THR 100 CO 0.00 0.53 0.39 -1.00 -0.69 0.00 0.00 174.62 173.85 3hsy s HIS 101 N -0.51 -0.78 0.70 4.92 3.76 -1.26 -5.16 115.29 116.97 3hsy s HIS 101 Ca 0.17 1.17 -0.15 0.00 -0.15 0.00 0.00 55.06 56.10 3hsy s HIS 101 Cb -0.13 0.15 0.02 0.00 1.11 0.00 0.00 32.58 33.73 3hsy s HIS 101 CO 0.06 -0.58 1.16 -1.25 -0.85 0.00 0.00 174.74 173.28 3hsy s PRO 102 N 2.57 2.40 -1.06 8.40 0.04 -1.26 -3.39 135.00 142.69 3hsy s PRO 102 Ca 0.05 1.60 0.00 0.00 0.04 0.00 0.00 61.00 62.69 3hsy s PRO 102 Cb -0.14 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.52 3hsy s PRO 102 CO -0.14 -1.60 0.00 1.19 0.04 0.00 0.00 177.00 176.49 3hsy n PHE 103 N -2.62 0.00 -4.74 0.56 3.72 -1.26 -4.23 117.46 108.90 3hsy n PHE 103 Ca 0.12 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.21 3hsy n PHE 103 Cb 0.51 -1.95 -0.17 0.00 -0.94 0.00 0.00 39.48 36.93 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 -2.34 1.86 -0.29 -4.37 1.01 -1.22 -1.05 120.40 114.00 3hsy s VAL 104 Ca 0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 61.06 3hsy s VAL 104 Cb 0.00 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.75 3hsy s VAL 104 CO 0.00 0.51 0.05 -0.63 0.00 0.00 0.00 175.10 175.03 3hsy s ILE 105 N 0.74 3.68 -0.50 2.22 -1.09 0.29 -4.23 121.20 122.32 3hsy s ILE 105 Ca -0.10 -0.82 -0.16 0.00 -2.23 0.00 0.00 60.65 57.34 3hsy s ILE 105 Cb -0.16 -2.91 0.08 0.00 -1.58 0.00 0.00 42.46 37.89 3hsy s ILE 105 CO 0.01 0.08 0.47 -1.10 -1.23 0.00 0.00 174.94 173.17 3hsy s GLN 106 N 1.45 3.01 0.42 2.79 -1.52 0.22 -1.61 119.66 124.41 3hsy s GLN 106 Ca 0.01 -1.33 0.16 0.00 -1.95 0.00 0.00 55.36 52.26 3hsy s GLN 106 Cb -0.17 -4.16 0.91 0.00 -0.22 0.00 0.00 33.01 29.36 3hsy s GLN 106 CO 0.01 -1.14 1.90 0.52 -0.25 0.00 0.00 175.29 176.33 3hsy h MET 107 N 8.85 0.00 -5.91 2.91 2.86 -1.25 -3.33 114.93 119.06 3hsy h MET 107 Ca -0.29 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 56.77 3hsy h MET 107 Cb 1.10 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.69 3hsy h MET 107 CO 0.93 0.28 0.41 0.50 1.06 0.00 0.00 176.91 180.10 3hsy s ARG 108 N -4.25 4.27 0.65 1.72 3.52 -1.26 -4.90 118.95 118.70 3hsy s ARG 108 Ca -0.03 1.00 -0.17 0.00 -0.13 0.00 0.00 55.73 56.40 3hsy s ARG 108 Cb 0.14 -3.59 -0.01 0.00 -1.56 0.00 0.00 34.95 29.93 3hsy s ARG 108 CO 0.69 -0.38 1.23 -2.14 -0.81 0.00 0.00 175.30 173.89 3hsy s PRO 109 N 2.32 2.63 0.40 5.12 0.02 -1.26 -4.60 135.00 139.63 3hsy s PRO 109 Ca 0.38 1.85 -0.26 0.00 0.02 0.00 0.00 61.00 62.99 3hsy s PRO 109 Cb -0.16 -1.88 -0.09 0.00 0.02 0.00 0.00 34.50 32.39 3hsy s PRO 109 CO 0.11 -1.48 1.32 0.34 -0.33 0.00 0.00 177.00 176.96 3hsy s ASP 110 N -1.70 6.34 -0.08 2.53 -1.08 -1.26 -4.88 116.67 116.54 3hsy s ASP 110 Ca 0.78 2.70 0.18 0.00 -0.52 0.00 0.00 52.55 55.68 3hsy s ASP 110 Cb -0.32 -2.64 -0.27 0.00 -1.46 0.00 0.00 42.92 38.23 3hsy s ASP 110 CO 0.38 -0.83 0.29 -0.11 0.52 0.00 0.00 175.17 175.42 3hsy n LEU 111 N 0.21 0.00 -0.23 -1.34 7.94 -1.26 -4.67 117.00 117.65 3hsy n LEU 111 Ca 0.03 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.91 3hsy n LEU 111 Cb 0.43 0.15 0.09 0.00 0.53 0.00 0.00 43.42 44.62 3hsy n LEU 111 CO 0.57 0.15 1.10 0.11 -1.11 0.00 0.00 177.39 178.21 3hsy h LYS 112 N 0.00 0.70 -0.30 1.96 1.57 -1.97 -1.41 116.57 117.12 3hsy h LYS 112 Ca -0.17 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.60 3hsy h LYS 112 Cb 1.31 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 33.43 3hsy h LYS 112 CO 0.01 0.46 0.12 0.78 -0.57 0.00 0.00 179.45 180.25 3hsy h GLY 113 N 0.72 0.39 1.38 3.86 0.00 -2.00 -0.99 103.07 106.43 3hsy h GLY 113 Ca 0.28 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 47.42 3hsy h GLY 113 CO -0.15 0.05 -0.22 0.00 0.00 0.00 0.00 176.54 176.22 3hsy h ALA 114 N 1.18 0.93 -0.09 3.60 0.00 -1.74 -1.91 119.26 121.23 3hsy h ALA 114 Ca 0.13 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 3hsy h ALA 114 Cb 0.08 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3hsy h ALA 114 CO -0.12 0.62 0.03 1.25 0.00 0.00 0.00 179.25 181.02 3hsy h LEU 115 N 0.62 0.13 -0.63 0.00 5.85 -0.94 -0.27 115.31 120.07 3hsy h LEU 115 Ca 0.09 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.65 3hsy h LEU 115 Cb 0.71 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 3hsy h LEU 115 CO 0.05 0.31 0.35 -0.07 -0.34 0.00 0.00 178.44 178.75 3hsy h LEU 116 N -0.05 0.53 -0.99 2.25 3.38 -1.14 -1.34 115.31 117.94 3hsy h LEU 116 Ca 0.03 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3hsy h LEU 116 Cb 0.23 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3hsy h LEU 116 CO -0.00 0.35 0.27 0.28 0.09 0.00 0.00 178.44 179.43 3hsy h SER 117 N 0.66 0.92 -0.42 -0.43 0.02 -1.17 -2.41 113.55 110.72 3hsy h SER 117 Ca 0.28 -0.13 -0.14 0.00 -0.84 0.00 0.00 61.79 60.96 3hsy h SER 117 Cb 0.15 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 3hsy h SER 117 CO -0.17 0.82 -0.27 0.25 -1.14 0.00 0.00 176.83 176.32 3hsy h LEU 118 N 0.98 0.98 -0.54 5.07 5.85 -0.43 0.61 115.31 127.84 3hsy h LEU 118 Ca 0.23 -0.40 0.04 0.00 0.84 0.00 0.00 57.88 58.60 3hsy h LEU 118 Cb 0.19 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 3hsy h LEU 118 CO -0.02 1.18 0.29 0.40 -0.34 0.00 0.00 178.44 179.95 3hsy h ILE 119 N 0.80 0.97 -0.63 4.05 2.04 -1.10 -1.86 117.51 121.79 3hsy h ILE 119 Ca 0.09 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 3hsy h ILE 119 Cb 0.85 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 3hsy h ILE 119 CO 0.07 0.10 0.16 -0.33 0.00 0.00 0.00 178.15 178.15 3hsy h GLU 120 N 0.55 1.01 -0.92 2.37 5.08 -1.22 -2.53 114.58 118.92 3hsy h GLU 120 Ca 0.24 -0.24 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 3hsy h GLU 120 Cb 0.13 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.18 3hsy h GLU 120 CO -0.15 0.91 0.59 -0.92 -1.00 0.00 0.00 179.01 178.44 3hsy h TYR 121 N 0.93 1.10 -0.00 4.33 3.20 -0.43 0.39 116.97 126.49 3hsy h TYR 121 Ca 0.20 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.10 3hsy h TYR 121 Cb 0.35 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3hsy h TYR 121 CO 0.03 0.60 -0.04 0.66 -1.64 0.00 0.00 178.16 177.76 3hsy n TYR 122 N -4.54 0.00 -3.33 -3.82 4.01 -0.74 -4.92 117.16 103.82 3hsy n TYR 122 Ca 0.13 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.63 3hsy n TYR 122 Cb 0.14 -0.13 0.05 0.00 -0.31 0.00 0.00 39.34 39.08 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 -0.92 -5.87 -2.20 -0.72 6.02 0.13 -4.96 117.38 108.86 3hsy n GLN 123 Ca 0.18 0.82 -0.40 0.00 -0.01 0.00 0.00 57.00 57.58 3hsy n GLN 123 Cb 0.23 -5.74 -0.02 0.00 1.02 0.00 0.00 30.24 25.72 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 -3.22 3.15 0.00 1.08 0.52 -0.99 -4.93 118.94 114.55 3hsy s TRP 124 Ca 0.44 1.49 0.00 0.00 0.02 0.00 0.00 56.10 58.05 3hsy s TRP 124 Cb -0.20 -3.58 0.00 0.00 -1.15 0.00 0.00 33.47 28.54 3hsy s TRP 124 CO 0.55 -1.55 0.32 -0.40 0.02 0.00 0.00 176.95 175.89 3hsy n ASP 125 N 0.79 0.65 -3.65 2.95 5.68 -1.26 -4.85 116.55 116.85 3hsy n ASP 125 Ca 0.00 -0.93 -0.07 0.00 -0.50 0.00 0.00 54.79 53.29 3hsy n ASP 125 Cb 0.43 0.07 -0.08 0.00 -1.14 0.00 0.00 41.12 40.41 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 -0.07 0.62 0.06 0.11 2.20 -1.26 -0.60 119.74 120.79 3hsy s LYS 126 Ca 0.00 1.15 -0.27 0.00 -0.36 0.00 0.00 55.97 56.49 3hsy s LYS 126 Cb 0.00 0.18 0.09 0.00 -1.51 0.00 0.00 37.83 36.59 3hsy s LYS 126 CO 0.00 -0.16 0.78 -0.59 -0.36 0.00 0.00 175.35 175.02 3hsy s PHE 127 N 1.73 -0.41 0.16 4.03 -0.71 -0.81 -4.70 117.98 117.27 3hsy s PHE 127 Ca -0.09 0.25 -0.15 0.00 -1.04 0.00 0.00 56.93 55.90 3hsy s PHE 127 Cb -0.07 0.55 -0.07 0.00 -1.21 0.00 0.00 43.02 42.22 3hsy s PHE 127 CO -0.18 -0.66 0.58 0.00 -1.34 0.00 0.00 175.22 173.62 3hsy s ALA 128 N -3.35 3.55 -0.29 1.99 0.00 0.00 -1.53 121.76 122.13 3hsy s ALA 128 Ca 0.04 -0.08 0.03 0.00 0.00 0.00 0.00 51.96 51.94 3hsy s ALA 128 Cb -0.01 -2.57 0.08 0.00 0.00 0.00 0.00 23.12 20.62 3hsy s ALA 128 CO -0.10 0.43 -0.02 -0.47 0.00 0.00 0.00 175.76 175.60 3hsy s TYR 129 N -1.48 3.15 -0.41 0.00 6.14 0.26 -0.76 117.35 124.26 3hsy s TYR 129 Ca 0.39 -2.42 -0.19 0.00 0.64 0.00 0.00 57.07 55.49 3hsy s TYR 129 Cb -0.15 -2.21 0.01 0.00 0.42 0.00 0.00 41.96 40.03 3hsy s TYR 129 CO 0.19 -0.88 0.56 -0.51 0.64 0.00 0.00 175.55 175.55 3hsy s LEU 130 N 1.13 4.53 0.46 6.97 1.43 0.52 -0.85 118.68 132.86 3hsy s LEU 130 Ca 0.00 -0.30 0.04 0.00 -1.03 0.00 0.00 54.13 52.85 3hsy s LEU 130 Cb -0.19 -2.62 -0.05 0.00 0.03 0.00 0.00 46.19 43.36 3hsy s LEU 130 CO -0.08 -0.65 0.01 -0.72 0.23 0.00 0.00 176.35 175.14 3hsy s TYR 131 N 2.55 2.22 -0.20 0.29 1.13 -0.12 -0.66 117.35 122.57 3hsy s TYR 131 Ca 0.19 -0.80 -0.01 0.00 -1.41 0.00 0.00 57.07 55.05 3hsy s TYR 131 Cb -0.15 -1.70 0.05 0.00 -1.10 0.00 0.00 41.96 39.06 3hsy s TYR 131 CO 0.16 0.35 -0.03 0.34 -2.51 0.00 0.00 175.55 173.86 3hsy s ASP 132 N -3.78 3.23 0.46 -0.18 -1.08 -1.23 0.12 116.67 114.21 3hsy s ASP 132 Ca 0.22 -0.90 0.17 0.00 -0.52 0.00 0.00 52.55 51.52 3hsy s ASP 132 Cb 0.06 -0.93 1.09 0.00 -1.46 0.00 0.00 42.92 41.68 3hsy s ASP 132 CO 0.11 -0.23 2.01 0.77 0.52 0.00 0.00 175.17 178.35 3hsy h SER 133 N 8.09 0.00 1.04 -0.34 4.64 -1.92 -0.68 113.55 124.37 3hsy h SER 133 Ca -0.20 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.11 3hsy h SER 133 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 3hsy h SER 133 CO 0.39 0.17 -0.08 0.44 -0.87 0.00 0.00 176.83 176.88 3hsy h ASP 134 N 0.00 0.00 0.26 4.97 3.32 -1.95 -2.98 116.42 120.04 3hsy h ASP 134 Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 3hsy h ASP 134 Cb 0.32 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.89 3hsy h ASP 134 CO 0.02 0.08 -1.55 -0.09 -1.72 0.00 0.00 179.24 175.98 3hsy h ARG 135 N 0.00 0.49 0.00 3.56 2.43 -1.56 -3.41 114.38 115.88 3hsy h ARG 135 Ca -0.00 -0.84 0.00 0.00 -0.81 0.00 0.00 59.98 58.33 3hsy h ARG 135 Cb 0.62 0.31 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 3hsy h ARG 135 CO 0.01 1.40 0.00 0.41 -1.51 0.00 0.00 179.97 180.28 3hsy n GLY 136 N 1.75 4.22 0.11 2.80 0.00 -0.95 -4.65 105.19 108.47 3hsy n GLY 136 Ca -0.19 -1.57 0.01 0.00 0.00 0.00 0.00 46.02 44.27 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 0.00 1.44 -0.31 0.99 4.32 -1.26 -4.66 117.00 117.52 3hsy n LEU 137 Ca 0.00 -1.23 0.03 0.00 -0.02 0.00 0.00 56.01 54.79 3hsy n LEU 137 Cb 0.00 -0.01 0.17 0.00 -1.62 0.00 0.00 43.42 41.96 3hsy n LEU 137 CO 0.00 0.34 1.16 0.28 -1.22 0.00 0.00 177.39 177.95 3hsy h SER 138 N 0.47 0.74 -0.16 -1.43 0.02 -1.99 0.13 113.55 111.33 3hsy h SER 138 Ca 0.00 0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.86 3hsy h SER 138 Cb 0.21 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.64 3hsy h SER 138 CO 0.00 0.43 -0.42 0.74 -1.14 0.00 0.00 176.83 176.44 3hsy h THR 139 N 0.86 1.35 -0.69 -2.27 2.02 -2.00 -1.96 112.91 110.22 3hsy h THR 139 Ca 0.41 -1.69 0.09 0.00 0.77 0.00 0.00 66.41 65.99 3hsy h THR 139 Cb 0.34 2.00 -0.07 0.00 -1.74 0.00 0.00 68.15 68.68 3hsy h THR 139 CO -0.24 0.51 0.33 0.25 0.37 0.00 0.00 175.52 176.75 3hsy h LEU 140 N 0.21 0.42 -1.13 2.58 5.85 -1.77 -1.74 115.31 119.73 3hsy h LEU 140 Ca -0.01 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3hsy h LEU 140 Cb 1.04 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 3hsy h LEU 140 CO 0.09 0.25 0.27 1.56 -0.34 0.00 0.00 178.44 180.26 3hsy h GLN 141 N 0.57 0.88 -0.56 1.25 4.20 -0.54 0.74 115.11 121.64 3hsy h GLN 141 Ca 0.34 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.90 3hsy h GLN 141 Cb 0.36 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.95 3hsy h GLN 141 CO -0.27 0.70 0.29 0.00 -0.67 0.00 0.00 178.83 178.88 3hsy h ALA 142 N 1.42 0.72 -0.28 3.87 0.00 -0.71 0.16 119.26 124.44 3hsy h ALA 142 Ca 0.21 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3hsy h ALA 142 Cb 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3hsy h ALA 142 CO -0.02 0.27 0.06 0.28 0.00 0.00 0.00 179.25 179.83 3hsy h VAL 143 N 0.76 1.22 -0.59 0.00 2.07 -0.58 -2.28 116.25 116.85 3hsy h VAL 143 Ca 0.20 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 3hsy h VAL 143 Cb 0.09 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 3hsy h VAL 143 CO -0.03 0.24 0.21 -0.07 0.02 0.00 0.00 177.57 177.95 3hsy h LEU 144 N 0.29 0.80 -0.99 2.57 3.38 -0.64 -1.51 115.31 119.20 3hsy h LEU 144 Ca 0.09 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3hsy h LEU 144 Cb 0.30 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3hsy h LEU 144 CO 0.00 0.73 0.38 0.44 0.09 0.00 0.00 178.44 180.08 3hsy h ASP 145 N 0.85 0.99 1.57 -0.43 3.45 -0.47 -2.74 116.42 119.65 3hsy h ASP 145 Ca 0.20 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3hsy h ASP 145 Cb 0.20 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 38.72 3hsy h ASP 145 CO -0.01 0.83 -0.17 0.28 -1.57 0.00 0.00 179.24 178.59 3hsy h SER 146 N 1.09 0.00 -0.70 6.45 0.02 -1.02 -3.38 113.55 116.01 3hsy h SER 146 Ca 0.27 -0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.23 3hsy h SER 146 Cb 0.09 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 3hsy h SER 146 CO -0.04 0.01 0.46 0.00 -1.14 0.00 0.00 176.83 176.13 3hsy h ALA 147 N 2.25 1.61 0.15 3.77 0.00 -0.96 -0.10 119.26 125.98 3hsy h ALA 147 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3hsy h ALA 147 Cb 0.87 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3hsy h ALA 147 CO 0.00 0.32 -0.07 0.00 0.00 0.00 0.00 179.25 179.49 3hsy h ALA 148 N 1.59 -0.20 -0.36 0.00 0.00 -1.74 0.13 119.26 118.68 3hsy h ALA 148 Ca 0.28 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3hsy h ALA 148 Cb 0.08 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3hsy h ALA 148 CO -0.08 -0.47 -0.03 1.49 0.00 0.00 0.00 179.25 180.16 3hsy h GLU 149 N -0.48 0.58 -0.01 0.00 4.81 -1.73 -2.92 114.58 114.82 3hsy h GLU 149 Ca -0.02 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 3hsy h GLU 149 Cb 0.38 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.68 3hsy h GLU 149 CO 0.03 0.62 -0.30 1.63 -0.73 0.00 0.00 179.01 180.27 3hsy n LYS 150 N -4.25 1.04 -3.22 1.92 4.76 -0.08 -4.98 118.16 113.35 3hsy n LYS 150 Ca 0.01 -0.71 -0.14 0.00 -2.87 0.00 0.00 58.31 54.61 3hsy n LYS 150 Cb 0.28 -1.49 0.06 0.00 -1.84 0.00 0.00 35.03 32.04 3hsy n LYS 150 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3hsy n LYS 151 N -0.36 -2.16 -4.69 1.97 4.01 -0.23 -4.99 118.16 111.71 3hsy n LYS 151 Ca 0.12 0.92 -0.33 0.00 -0.51 0.00 0.00 58.31 58.50 3hsy n LYS 151 Cb 0.39 -5.80 -0.13 0.00 -0.51 0.00 0.00 35.03 28.98 3hsy n LYS 151 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 3hsy s TRP 152 N -3.35 2.86 -0.56 2.13 0.51 0.28 -4.66 118.94 116.13 3hsy s TRP 152 Ca 0.42 -0.40 -0.16 0.00 -2.12 0.00 0.00 56.10 53.84 3hsy s TRP 152 Cb -0.05 -1.82 0.14 0.00 -0.81 0.00 0.00 33.47 30.93 3hsy s TRP 152 CO 0.74 -0.04 0.52 -0.65 -0.51 0.00 0.00 176.95 177.01 3hsy s GLN 153 N 0.03 3.04 -0.13 4.98 -0.21 0.23 -4.71 119.66 122.89 3hsy s GLN 153 Ca -0.03 -1.77 -0.12 0.00 0.02 0.00 0.00 55.36 53.46 3hsy s GLN 153 Cb -0.14 -4.31 -0.05 0.00 1.00 0.00 0.00 33.01 29.51 3hsy s GLN 153 CO 0.04 -1.33 0.25 0.08 -2.12 0.00 0.00 175.29 172.21 3hsy s VAL 154 N 1.48 5.32 -0.35 1.09 1.01 -1.26 -1.92 120.40 125.77 3hsy s VAL 154 Ca 0.04 0.47 -0.04 0.00 0.00 0.00 0.00 61.98 62.44 3hsy s VAL 154 Cb -0.28 -3.57 0.06 0.00 0.00 0.00 0.00 36.38 32.59 3hsy s VAL 154 CO 0.02 0.47 0.11 -0.89 0.00 0.00 0.00 175.10 174.82 3hsy s THR 155 N -0.08 3.48 -0.18 3.92 2.01 -0.58 -4.99 115.64 119.21 3hsy s THR 155 Ca 0.16 -1.45 -0.14 0.00 0.31 0.00 0.00 61.69 60.56 3hsy s THR 155 Cb -0.13 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.24 3hsy s THR 155 CO 0.04 -0.31 0.32 0.00 -0.69 0.00 0.00 174.62 173.98 3hsy s ALA 156 N 1.30 3.58 -0.07 7.40 0.00 -1.26 -0.57 121.76 132.13 3hsy s ALA 156 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.45 3hsy s ALA 156 Cb -0.21 -2.47 0.02 0.00 0.00 0.00 0.00 23.12 20.46 3hsy s ALA 156 CO -0.00 -0.07 -0.05 0.42 0.00 0.00 0.00 175.76 176.06 3hsy s ILE 157 N 0.82 0.71 -0.87 0.00 1.01 -0.03 -4.95 121.20 117.87 3hsy s ILE 157 Ca 0.17 -0.15 -0.24 0.00 0.00 0.00 0.00 60.65 60.42 3hsy s ILE 157 Cb -0.14 -0.75 0.05 0.00 0.01 0.00 0.00 42.46 41.64 3hsy s ILE 157 CO 0.05 0.29 1.31 0.21 0.00 0.00 0.00 174.94 176.81 3hsy s ASN 158 N 1.35 6.35 0.00 3.58 3.84 -1.26 -0.94 114.94 127.86 3hsy s ASN 158 Ca -0.04 -1.08 0.22 0.00 0.21 0.00 0.00 52.86 52.17 3hsy s ASN 158 Cb -0.14 -2.54 1.18 0.00 -0.55 0.00 0.00 41.25 39.21 3hsy s ASN 158 CO -0.03 -1.59 1.78 1.33 -2.79 0.00 0.00 177.10 175.80 3hsy n VAL 159 N 6.49 0.04 0.31 -5.21 0.24 0.12 -2.78 118.33 117.54 3hsy n VAL 159 Ca 0.18 -0.09 0.12 0.00 -2.04 0.00 0.00 64.34 62.51 3hsy n VAL 159 Cb 0.50 -0.13 0.55 0.00 -1.47 0.00 0.00 33.84 33.29 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 5.21 0.00 -2.87 7.63 0.00 -1.84 -2.28 103.07 108.92 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 -2.32 4.49 0.15 0.19 3.02 -1.12 -4.58 115.26 115.08 3hsy n ASN 161 Ca 0.01 -2.33 0.12 0.00 -0.03 0.00 0.00 54.58 52.35 3hsy n ASN 161 Cb 0.17 -0.54 0.52 0.00 -0.61 0.00 0.00 39.78 39.31 3hsy n ASN 161 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3hsy h ILE 162 N 4.02 0.00 0.00 2.41 2.10 -1.62 -2.35 117.51 122.07 3hsy h ILE 162 Ca 0.00 -0.23 0.00 0.00 1.08 0.00 0.00 64.86 65.71 3hsy h ILE 162 Cb 1.31 0.97 0.00 0.00 -1.09 0.00 0.00 36.82 38.01 3hsy h ILE 162 CO 0.16 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 177.82 3hsy n ASN 163 N -2.31 1.03 -2.14 2.19 5.03 -1.26 -4.80 115.26 113.00 3hsy n ASN 163 Ca 0.02 -1.16 -0.02 0.00 0.87 0.00 0.00 54.58 54.29 3hsy n ASN 163 Cb 0.22 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 38.99 3hsy n ASN 163 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3hsy n ASN 164 N -0.08 0.05 0.21 6.41 4.13 -0.93 -4.87 115.26 120.18 3hsy n ASN 164 Ca 0.00 -1.05 0.07 0.00 1.68 0.00 0.00 54.58 55.27 3hsy n ASN 164 Cb 0.08 -0.05 0.47 0.00 -1.54 0.00 0.00 39.78 38.74 3hsy n ASN 164 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 3hsy h ASP 165 N -0.08 0.00 -0.13 6.41 5.19 -1.99 -1.16 116.42 124.67 3hsy h ASP 165 Ca -0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 3hsy h ASP 165 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 3hsy h ASP 165 CO 0.02 0.28 0.00 0.29 -3.12 0.00 0.00 179.24 176.71 3hsy n LYS 166 N -3.84 1.50 0.04 3.56 5.02 -1.26 -4.33 118.16 118.85 3hsy n LYS 166 Ca -0.01 -0.54 -0.11 0.00 -2.02 0.00 0.00 58.31 55.62 3hsy n LYS 166 Cb 0.37 -1.34 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 3hsy n LYS 166 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 3hsy h LYS 167 N 0.79 -0.14 -0.13 1.97 3.64 -0.75 0.18 116.57 122.12 3hsy h LYS 167 Ca 0.00 0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.32 3hsy h LYS 167 Cb 0.44 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 3hsy h LYS 167 CO 0.04 -0.09 -0.23 -0.44 -2.27 0.00 0.00 179.45 176.46 3hsy h ASP 168 N -0.14 0.23 -0.30 4.20 3.45 -1.82 0.09 116.42 122.13 3hsy h ASP 168 Ca 0.04 -0.06 -0.10 0.00 0.43 0.00 0.00 57.03 57.34 3hsy h ASP 168 Cb 0.20 -0.06 -0.02 0.00 -0.56 0.00 0.00 39.33 38.89 3hsy h ASP 168 CO -0.11 0.47 -0.15 -0.33 -1.57 0.00 0.00 179.24 177.55 3hsy h GLU 169 N 0.21 0.74 -0.36 3.56 3.07 -1.74 -0.41 114.58 119.65 3hsy h GLU 169 Ca 0.04 -0.26 -0.14 0.00 -0.50 0.00 0.00 59.36 58.49 3hsy h GLU 169 Cb 0.53 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3hsy h GLU 169 CO 0.04 0.85 -0.33 1.15 -1.40 0.00 0.00 179.01 179.31 3hsy h THR 170 N 0.66 1.28 -0.32 1.13 2.02 0.57 -0.79 112.91 117.47 3hsy h THR 170 Ca 0.11 -1.50 -0.13 0.00 0.77 0.00 0.00 66.41 65.66 3hsy h THR 170 Cb 0.63 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 3hsy h THR 170 CO 0.04 0.50 -0.32 1.88 0.37 0.00 0.00 175.52 177.99 3hsy h TYR 171 N 0.66 0.81 -0.78 3.16 -1.99 -0.92 -1.04 116.97 116.87 3hsy h TYR 171 Ca 0.06 -0.21 -0.05 0.00 2.00 0.00 0.00 58.73 60.53 3hsy h TYR 171 Cb 0.92 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 39.43 3hsy h TYR 171 CO 0.07 0.93 0.31 -0.09 -0.00 0.00 0.00 178.16 179.37 3hsy h ARG 172 N 0.59 1.17 -0.21 4.88 2.43 -0.90 0.93 114.38 123.26 3hsy h ARG 172 Ca 0.07 -0.21 -0.02 0.00 -0.81 0.00 0.00 59.98 59.00 3hsy h ARG 172 Cb 0.83 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 3hsy h ARG 172 CO 0.07 0.95 0.05 0.77 -1.51 0.00 0.00 179.97 180.30 3hsy h SER 173 N 1.13 0.33 -0.71 -3.80 0.02 -0.86 0.22 113.55 109.88 3hsy h SER 173 Ca 0.26 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3hsy h SER 173 Cb 0.22 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 3hsy h SER 173 CO -0.02 0.48 0.46 -0.07 -1.14 0.00 0.00 176.83 176.53 3hsy h LEU 174 N 0.16 0.83 -0.29 5.07 3.38 -1.03 -2.06 115.31 121.36 3hsy h LEU 174 Ca 0.07 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3hsy h LEU 174 Cb 0.28 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3hsy h LEU 174 CO 0.00 0.62 0.14 0.15 0.09 0.00 0.00 178.44 179.44 3hsy h PHE 175 N 0.97 0.42 -0.68 1.13 3.57 -0.56 -0.47 116.94 121.32 3hsy h PHE 175 Ca 0.26 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.70 3hsy h PHE 175 Cb -0.08 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.50 3hsy h PHE 175 CO -0.02 0.38 0.27 -0.56 -2.23 0.00 0.00 178.31 176.15 3hsy h GLN 176 N 0.34 0.99 -0.00 1.11 3.07 -0.72 0.48 115.11 120.38 3hsy h GLN 176 Ca 0.10 -0.16 -0.16 0.00 0.09 0.00 0.00 58.65 58.51 3hsy h GLN 176 Cb 0.12 -0.17 0.01 0.00 0.08 0.00 0.00 27.48 27.52 3hsy h GLN 176 CO -0.01 0.81 -0.64 0.22 0.09 0.00 0.00 178.83 179.30 3hsy h ASP 177 N 0.98 0.57 0.46 0.06 3.58 -1.22 -1.15 116.42 119.69 3hsy h ASP 177 Ca 0.23 -0.75 -0.30 0.00 0.42 0.00 0.00 57.03 56.62 3hsy h ASP 177 Cb 0.19 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 3hsy h ASP 177 CO -0.02 1.25 -1.48 -0.07 -2.88 0.00 0.00 179.24 176.04 3hsy h LEU 178 N -0.05 0.44 0.00 2.28 3.38 -1.03 -1.22 115.31 119.11 3hsy h LEU 178 Ca -0.08 -0.57 -0.27 0.00 0.09 0.00 0.00 57.88 57.05 3hsy h LEU 178 Cb 1.34 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 3hsy h LEU 178 CO 0.13 1.47 -1.62 -0.62 0.09 0.00 0.00 178.44 177.89 3hsy n GLU 179 N -3.49 0.56 -0.03 1.13 -0.58 0.14 -3.35 120.64 115.01 3hsy n GLU 179 Ca -0.15 0.43 -0.15 0.00 -0.42 0.00 0.00 57.16 56.87 3hsy n GLU 179 Cb 1.05 -1.62 -0.09 0.00 -0.57 0.00 0.00 31.44 30.20 3hsy n GLU 179 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3hsy h LEU 180 N -1.00 0.35 -1.20 -4.62 3.38 -1.31 -3.31 115.31 107.59 3hsy h LEU 180 Ca -0.41 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 56.93 3hsy h LEU 180 Cb 1.30 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.95 3hsy h LEU 180 CO -0.25 0.93 -0.18 0.29 0.09 0.00 0.00 178.44 179.32 3hsy n LYS 181 N -4.48 1.61 -3.19 1.13 4.76 -0.46 -4.97 118.16 112.56 3hsy n LYS 181 Ca -0.08 -1.20 -0.23 0.00 -2.87 0.00 0.00 58.31 53.93 3hsy n LYS 181 Cb 0.47 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 32.21 3hsy n LYS 181 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3hsy n LYS 182 N 0.35 -4.52 -2.18 1.97 5.02 -0.99 -4.92 118.16 112.90 3hsy n LYS 182 Ca 0.13 0.74 -0.40 0.00 -2.02 0.00 0.00 58.31 56.77 3hsy n LYS 182 Cb 0.46 -5.56 -0.02 0.00 -0.02 0.00 0.00 35.03 29.89 3hsy n LYS 182 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3hsy s GLU 183 N -5.87 4.27 0.00 1.97 2.56 -0.50 -4.91 118.70 116.22 3hsy s GLU 183 Ca 0.36 2.09 0.00 0.00 0.00 0.00 0.00 54.97 57.42 3hsy s GLU 183 Cb -0.17 -2.96 0.00 0.00 2.00 0.00 0.00 34.13 33.00 3hsy s GLU 183 CO 0.44 -0.22 0.13 2.89 -0.56 0.00 0.00 175.26 177.94 3hsy n ARG 184 N 0.60 1.48 -3.96 4.30 1.85 -1.26 -4.70 116.66 114.97 3hsy n ARG 184 Ca 0.01 -0.13 -0.35 0.00 -1.00 0.00 0.00 57.85 56.38 3hsy n ARG 184 Cb 0.43 -0.51 -0.13 0.00 -1.05 0.00 0.00 32.46 31.21 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 -0.25 3.61 -0.05 2.89 0.52 -1.26 -0.57 118.95 123.84 3hsy s ARG 185 Ca 0.00 -0.51 0.00 0.00 -0.52 0.00 0.00 55.73 54.70 3hsy s ARG 185 Cb 0.00 -3.14 0.02 0.00 0.52 0.00 0.00 34.95 32.35 3hsy s ARG 185 CO 0.00 -0.06 -0.03 0.08 0.02 0.00 0.00 175.30 175.32 3hsy s VAL 186 N 1.21 0.45 -0.18 3.52 1.01 -0.61 -0.82 120.40 124.98 3hsy s VAL 186 Ca 0.03 -0.02 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 3hsy s VAL 186 Cb -0.15 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 3hsy s VAL 186 CO 0.02 0.23 0.05 -0.63 0.00 0.00 0.00 175.10 174.76 3hsy s ILE 187 N 1.25 4.66 -0.34 2.22 1.01 0.06 -0.66 121.20 129.39 3hsy s ILE 187 Ca -0.06 -0.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 3hsy s ILE 187 Cb -0.14 -3.09 0.05 0.00 0.01 0.00 0.00 42.46 39.29 3hsy s ILE 187 CO -0.02 0.47 0.11 -0.76 0.00 0.00 0.00 174.94 174.74 3hsy s LEU 188 N 0.35 4.39 -0.60 2.97 1.43 -0.14 -0.36 118.68 126.72 3hsy s LEU 188 Ca 0.02 -1.26 -0.06 0.00 -1.03 0.00 0.00 54.13 51.80 3hsy s LEU 188 Cb -0.13 -1.85 0.16 0.00 0.03 0.00 0.00 46.19 44.40 3hsy s LEU 188 CO 0.00 -0.35 0.45 -0.62 0.23 0.00 0.00 176.35 176.06 3hsy s ASP 189 N 1.48 5.59 0.29 2.29 3.68 0.17 -0.40 116.67 129.77 3hsy s ASP 189 Ca -0.01 -2.53 -0.17 0.00 2.13 0.00 0.00 52.55 51.96 3hsy s ASP 189 Cb -0.20 -1.94 0.02 0.00 -1.45 0.00 0.00 42.92 39.35 3hsy s ASP 189 CO 0.02 -0.49 0.66 0.00 0.13 0.00 0.00 175.17 175.49 3hsy n GLU 191 N -0.46 2.34 -0.20 0.00 2.13 -1.26 -4.86 120.64 118.33 3hsy n GLU 191 Ca -0.04 0.83 0.03 0.00 0.66 0.00 0.00 57.16 58.64 3hsy n GLU 191 Cb 0.60 -2.54 0.30 0.00 0.27 0.00 0.00 31.44 30.06 3hsy n GLU 191 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 3hsy h ARG 192 N 4.44 0.87 -0.05 5.31 9.65 -1.97 0.21 114.38 132.84 3hsy h ARG 192 Ca -0.46 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 3hsy h ARG 192 Cb 1.25 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 3hsy h ARG 192 CO 0.77 0.57 0.00 -0.40 2.80 0.00 0.00 179.97 183.72 3hsy n ASP 193 N -4.45 0.36 -0.32 -3.80 5.68 -1.26 -2.67 116.55 110.09 3hsy n ASP 193 Ca 0.09 -1.71 0.09 0.00 -0.50 0.00 0.00 54.79 52.77 3hsy n ASP 193 Cb 0.12 -0.03 -0.03 0.00 -1.14 0.00 0.00 41.12 40.04 3hsy n ASP 193 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3hsy n LYS 194 N -0.45 1.43 0.05 0.11 5.02 0.06 -4.66 118.16 119.72 3hsy n LYS 194 Ca 0.09 -0.67 -0.11 0.00 -2.02 0.00 0.00 58.31 55.61 3hsy n LYS 194 Cb 0.09 -1.35 -0.04 0.00 -0.02 0.00 0.00 35.03 33.71 3hsy n LYS 194 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3hsy h VAL 195 N 1.55 0.58 -0.28 -0.18 2.07 -1.52 -1.91 116.25 116.57 3hsy h VAL 195 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 3hsy h VAL 195 Cb 0.58 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3hsy h VAL 195 CO 0.00 0.00 -0.08 0.78 0.02 0.00 0.00 177.57 178.29 3hsy h ASN 196 N -0.27 0.43 -0.56 0.57 4.21 -1.83 0.12 115.58 118.25 3hsy h ASN 196 Ca 0.06 -0.09 -0.07 0.00 1.21 0.00 0.00 56.30 57.41 3hsy h ASN 196 Cb 0.35 -0.11 -0.02 0.00 -1.12 0.00 0.00 38.32 37.41 3hsy h ASN 196 CO -0.18 0.55 0.07 0.44 -1.29 0.00 0.00 177.43 177.03 3hsy h ASP 197 N 0.43 0.91 -0.15 5.81 3.32 -1.77 0.14 116.42 125.10 3hsy h ASP 197 Ca 0.09 -0.27 -0.06 0.00 0.02 0.00 0.00 57.03 56.81 3hsy h ASP 197 Cb 0.40 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 3hsy h ASP 197 CO 0.02 0.96 -0.13 0.40 -1.72 0.00 0.00 179.24 178.77 3hsy h ILE 198 N 0.84 1.34 -0.69 0.35 2.04 -0.95 -2.89 117.51 117.53 3hsy h ILE 198 Ca 0.17 -1.26 0.04 0.00 1.00 0.00 0.00 64.86 64.81 3hsy h ILE 198 Cb 0.44 1.83 -0.05 0.00 -0.74 0.00 0.00 36.82 38.31 3hsy h ILE 198 CO 0.02 0.37 0.42 0.58 0.00 0.00 0.00 178.15 179.53 3hsy h VAL 199 N -0.01 1.04 -1.00 1.67 2.07 -0.89 -0.83 116.25 118.31 3hsy h VAL 199 Ca 0.03 -0.27 0.08 0.00 0.82 0.00 0.00 66.70 67.36 3hsy h VAL 199 Cb 0.64 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.52 3hsy h VAL 199 CO 0.03 0.14 0.64 0.44 0.02 0.00 0.00 177.57 178.84 3hsy h ASP 200 N 0.79 0.99 -0.29 0.57 3.45 -0.68 0.51 116.42 121.77 3hsy h ASP 200 Ca 0.29 0.02 -0.08 0.00 0.43 0.00 0.00 57.03 57.69 3hsy h ASP 200 Cb 0.10 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.67 3hsy h ASP 200 CO -0.14 0.61 -0.13 1.56 -1.57 0.00 0.00 179.24 179.56 3hsy h GLN 201 N 1.11 0.60 -0.85 3.56 1.08 -1.13 -2.77 115.11 116.71 3hsy h GLN 201 Ca 0.45 -0.26 0.09 0.00 -1.45 0.00 0.00 58.65 57.48 3hsy h GLN 201 Cb 0.26 -0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 27.60 3hsy h GLN 201 CO -0.20 0.83 0.50 0.28 -0.95 0.00 0.00 178.83 179.29 3hsy h VAL 202 N 0.35 0.94 -0.27 -0.54 2.07 -0.16 -2.20 116.25 116.44 3hsy h VAL 202 Ca 0.07 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 3hsy h VAL 202 Cb 0.65 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3hsy h VAL 202 CO 0.04 0.15 -0.14 0.40 0.02 0.00 0.00 177.57 178.04 3hsy h ILE 203 N 0.85 1.23 0.00 4.57 1.08 -0.80 0.62 117.51 125.05 3hsy h ILE 203 Ca 0.40 -1.03 -0.03 0.00 -0.39 0.00 0.00 64.86 63.82 3hsy h ILE 203 Cb 0.34 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.26 3hsy h ILE 203 CO -0.23 0.33 -0.12 0.71 -0.69 0.00 0.00 178.15 178.15 3hsy h THR 204 N 0.43 0.24 0.06 -0.27 1.35 -1.13 -3.33 112.91 110.26 3hsy h THR 204 Ca 0.08 -1.08 -0.37 0.00 -0.55 0.00 0.00 66.41 64.49 3hsy h THR 204 Cb 0.50 1.89 -0.04 0.00 -1.73 0.00 0.00 68.15 68.77 3hsy h THR 204 CO 0.03 0.12 -2.19 -0.38 -0.25 0.00 0.00 175.52 172.85 3hsy n ILE 205 N -3.17 1.64 -1.30 6.82 5.41 -0.89 -5.00 119.36 122.86 3hsy n ILE 205 Ca 0.02 -0.64 0.00 0.00 1.00 0.00 0.00 62.75 63.13 3hsy n ILE 205 Cb 0.48 -1.50 0.00 0.00 -0.71 0.00 0.00 39.64 37.91 3hsy n ILE 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hsy n GLY 206 N 2.06 -0.27 3.22 7.39 0.00 0.16 -4.70 105.19 113.05 3hsy n GLY 206 Ca -0.37 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 43.77 3hsy n GLY 206 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hsy s LYS 207 N -1.96 0.76 -1.50 1.61 2.20 -1.26 -4.85 119.74 114.74 3hsy s LYS 207 Ca 0.00 -0.56 -0.09 0.00 -0.36 0.00 0.00 55.97 54.96 3hsy s LYS 207 Cb 0.00 0.32 0.07 0.00 -1.51 0.00 0.00 37.83 36.71 3hsy s LYS 207 CO 0.00 -0.24 0.74 0.72 -0.36 0.00 0.00 175.35 176.21 3hsy n HIS 208 N 0.61 -1.93 0.29 4.03 8.25 -1.26 -4.82 115.22 120.40 3hsy n HIS 208 Ca -0.19 0.83 0.18 0.00 -0.26 0.00 0.00 57.72 58.29 3hsy n HIS 208 Cb 0.59 -3.75 0.84 0.00 1.12 0.00 0.00 29.99 28.79 3hsy n HIS 208 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 3hsy h VAL 209 N -1.85 0.05 -0.01 1.59 -1.51 -1.89 -1.34 116.25 111.30 3hsy h VAL 209 Ca -0.60 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.49 3hsy h VAL 209 Cb 1.37 1.36 -0.00 0.00 -2.13 0.00 0.00 31.29 31.90 3hsy h VAL 209 CO 0.67 0.01 0.02 0.11 -1.23 0.00 0.00 177.57 177.15 3hsy h LYS 210 N 0.00 0.00 -0.01 5.19 1.57 -1.88 -2.18 116.57 119.26 3hsy h LYS 210 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hsy h LYS 210 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3hsy h LYS 210 CO 0.00 0.00 -0.06 0.41 -0.57 0.00 0.00 179.45 179.23 3hsy n GLY 211 N -1.31 -0.24 3.76 3.86 0.00 -0.50 -3.47 105.19 107.28 3hsy n GLY 211 Ca -0.03 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.14 2.46 -0.19 1.61 1.51 -0.82 -4.87 117.35 114.92 3hsy s TYR 212 Ca 0.35 1.58 -0.02 0.00 -1.01 0.00 0.00 57.07 57.97 3hsy s TYR 212 Cb 0.21 -3.15 0.05 0.00 -0.11 0.00 0.00 41.96 38.96 3hsy s TYR 212 CO 0.39 -1.92 0.00 -1.58 -1.11 0.00 0.00 175.55 171.33 3hsy s HIS 213 N -2.61 1.33 -0.00 2.71 2.46 0.27 -1.54 115.29 117.91 3hsy s HIS 213 Ca 0.65 -0.99 -0.10 0.00 0.47 0.00 0.00 55.06 55.08 3hsy s HIS 213 Cb -0.20 -1.15 -0.05 0.00 -0.13 0.00 0.00 32.58 31.05 3hsy s HIS 213 CO 0.50 -0.62 0.33 0.71 -2.47 0.00 0.00 174.74 173.19 3hsy s TYR 214 N 1.75 3.64 -0.20 3.88 2.02 -0.32 -1.57 117.35 126.55 3hsy s TYR 214 Ca -0.01 0.77 -0.03 0.00 -0.37 0.00 0.00 57.07 57.43 3hsy s TYR 214 Cb -0.17 -2.13 -0.01 0.00 -0.40 0.00 0.00 41.96 39.25 3hsy s TYR 214 CO -0.07 0.63 -0.06 0.42 -1.57 0.00 0.00 175.55 174.90 3hsy s ILE 215 N -1.19 3.36 -0.56 2.71 1.01 0.16 -0.62 121.20 126.07 3hsy s ILE 215 Ca 0.25 -0.51 -0.23 0.00 0.00 0.00 0.00 60.65 60.16 3hsy s ILE 215 Cb -0.14 -2.50 0.05 0.00 0.01 0.00 0.00 42.46 39.87 3hsy s ILE 215 CO 0.13 0.45 0.89 -0.63 0.00 0.00 0.00 174.94 175.78 3hsy s ILE 216 N 1.20 4.46 -1.18 2.92 1.01 0.85 -0.96 121.20 129.50 3hsy s ILE 216 Ca 0.02 0.06 -0.17 0.00 0.00 0.00 0.00 60.65 60.56 3hsy s ILE 216 Cb -0.14 -4.52 0.11 0.00 0.01 0.00 0.00 42.46 37.91 3hsy s ILE 216 CO -0.02 -1.12 1.51 0.00 0.00 0.00 0.00 174.94 175.32 3hsy s ALA 217 N 3.75 3.47 -0.13 9.38 0.00 0.47 -4.17 121.76 134.53 3hsy s ALA 217 Ca 0.27 -2.95 -0.30 0.00 0.00 0.00 0.00 51.96 48.97 3hsy s ALA 217 Cb -0.14 -4.37 0.10 0.00 0.00 0.00 0.00 23.12 18.71 3hsy s ALA 217 CO 0.17 -3.12 0.88 1.21 0.00 0.00 0.00 175.76 174.89 3hsy s ASN 218 N 3.78 -0.49 0.00 0.00 3.84 -1.26 -4.25 114.94 116.55 3hsy s ASN 218 Ca 0.46 0.59 0.21 0.00 0.21 0.00 0.00 52.86 54.33 3hsy s ASN 218 Cb -0.00 0.47 0.96 0.00 -0.55 0.00 0.00 41.25 42.13 3hsy s ASN 218 CO 0.00 -0.42 1.65 0.18 -2.79 0.00 0.00 177.10 175.73 3hsy n LEU 219 N 0.98 0.89 -3.06 3.21 4.77 -1.26 -3.86 117.00 118.67 3hsy n LEU 219 Ca -0.14 -0.36 -0.26 0.00 -0.03 0.00 0.00 56.01 55.22 3hsy n LEU 219 Cb 0.57 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 3hsy n LEU 219 CO 0.17 0.18 0.09 0.61 -1.33 0.00 0.00 177.39 177.11 3hsy n GLY 220 N 0.98 5.21 0.26 -0.72 0.00 -1.23 -3.05 105.19 106.65 3hsy n GLY 220 Ca 0.16 -2.65 0.03 0.00 0.00 0.00 0.00 46.02 43.55 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 3.22 -0.19 -0.60 1.61 3.57 -1.29 -1.45 116.94 121.81 3hsy h PHE 221 Ca 0.14 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.70 3hsy h PHE 221 Cb 0.58 0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.52 3hsy h PHE 221 CO 0.77 -0.26 0.00 0.25 -2.23 0.00 0.00 178.31 176.84 3hsy n THR 222 N -5.39 1.66 0.24 4.41 -2.24 -1.26 -4.33 114.28 107.37 3hsy n THR 222 Ca 0.11 -1.07 0.11 0.00 -2.27 0.00 0.00 64.05 60.93 3hsy n THR 222 Cb 0.41 0.08 0.57 0.00 -2.10 0.00 0.00 70.33 69.29 3hsy n THR 222 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3hsy h ASP 223 N 3.75 0.00 -2.03 3.42 5.19 -1.61 -3.43 116.42 121.71 3hsy h ASP 223 Ca 0.00 0.00 -0.61 0.00 -0.62 0.00 0.00 57.03 55.80 3hsy h ASP 223 Cb 1.35 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 40.72 3hsy h ASP 223 CO 0.22 0.19 -0.67 -0.83 -3.12 0.00 0.00 179.24 175.02 3hsy s GLY 224 N -4.25 2.20 0.21 2.75 0.00 -1.26 -4.91 107.32 102.05 3hsy s GLY 224 Ca -0.01 -2.10 -0.32 0.00 0.00 0.00 0.00 44.72 42.29 3hsy s GLY 224 CO 0.61 -2.02 1.65 1.22 0.00 0.00 0.00 173.10 174.57 3hsy n ASP 225 N -0.79 3.67 -4.08 1.64 8.00 -1.26 -4.96 116.55 118.76 3hsy n ASP 225 Ca -0.05 1.08 -0.34 0.00 0.71 0.00 0.00 54.79 56.19 3hsy n ASP 225 Cb 0.64 -1.53 -0.13 0.00 -0.02 0.00 0.00 41.12 40.09 3hsy n ASP 225 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hsy s LEU 226 N 0.85 5.04 -0.24 0.64 1.43 -1.26 -5.04 118.68 120.11 3hsy s LEU 226 Ca 0.74 -2.22 0.02 0.00 -1.03 0.00 0.00 54.13 51.64 3hsy s LEU 226 Cb -0.56 -1.76 0.05 0.00 0.03 0.00 0.00 46.19 43.95 3hsy s LEU 226 CO 0.37 -0.46 -0.13 -0.76 0.23 0.00 0.00 176.35 175.61 3hsy s LEU 227 N 0.84 3.05 0.37 1.79 1.43 -1.26 -4.87 118.68 120.03 3hsy s LEU 227 Ca 0.11 -1.20 0.19 0.00 -1.03 0.00 0.00 54.13 52.20 3hsy s LEU 227 Cb -0.22 -1.49 1.22 0.00 0.03 0.00 0.00 46.19 45.73 3hsy s LEU 227 CO -0.05 -0.15 1.64 0.11 0.23 0.00 0.00 176.35 178.13 3hsy h LYS 228 N 7.83 0.20 -0.85 1.70 1.57 -1.94 0.86 116.57 125.94 3hsy h LYS 228 Ca -0.25 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.54 3hsy h LYS 228 Cb 1.07 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.29 3hsy h LYS 228 CO 0.50 0.13 0.56 -0.84 -0.57 0.00 0.00 179.45 179.23 3hsy h ILE 229 N 0.21 1.18 0.00 1.86 -0.00 -1.94 0.54 117.51 119.36 3hsy h ILE 229 Ca 0.77 -0.38 -0.05 0.00 -0.00 0.00 0.00 64.86 65.20 3hsy h ILE 229 Cb 1.98 -0.03 -0.01 0.00 -0.00 0.00 0.00 36.82 38.77 3hsy h ILE 229 CO -0.58 0.20 -0.23 1.56 -0.00 0.00 0.00 178.15 179.10 3hsy h GLN 230 N 1.11 0.00 -0.54 0.16 4.20 0.32 -2.01 115.11 118.36 3hsy h GLN 230 Ca 0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.03 3hsy h GLN 230 Cb -0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.72 3hsy h GLN 230 CO -0.08 0.23 0.00 1.19 -0.67 0.00 0.00 178.83 179.50 3hsy n PHE 231 N -3.91 0.71 -1.69 2.96 3.72 -0.00 -4.81 117.46 114.45 3hsy n PHE 231 Ca -0.02 -0.36 -0.16 0.00 -0.05 0.00 0.00 57.45 56.86 3hsy n PHE 231 Cb 0.31 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.80 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 1.36 1.16 1.43 1.37 0.00 -0.49 -2.55 105.19 107.47 3hsy n GLY 232 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.97 0.76 3.72 -0.02 0.00 -0.16 -3.52 105.19 105.00 3hsy n GLY 233 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.76 1.57 0.29 4.61 0.00 -1.06 -4.79 121.76 119.62 3hsy s ALA 234 Ca 0.00 -0.10 -0.28 0.00 0.00 0.00 0.00 51.96 51.58 3hsy s ALA 234 Cb 0.00 -3.18 -0.09 0.00 0.00 0.00 0.00 23.12 19.85 3hsy s ALA 234 CO 0.00 -2.33 1.01 -0.80 0.00 0.00 0.00 175.76 173.64 3hsy s ASN 235 N -3.47 7.35 -0.04 0.00 -0.87 -0.59 -4.99 114.94 112.32 3hsy s ASN 235 Ca 0.63 2.06 0.00 0.00 -1.57 0.00 0.00 52.86 53.99 3hsy s ASN 235 Cb -0.18 -2.61 0.03 0.00 -0.02 0.00 0.00 41.25 38.47 3hsy s ASN 235 CO 0.57 -0.07 -0.01 -0.69 -2.57 0.00 0.00 177.10 174.33 3hsy s VAL 236 N -1.30 0.33 0.22 1.60 1.01 -1.26 -1.17 120.40 119.82 3hsy s VAL 236 Ca 0.46 0.05 0.09 0.00 0.00 0.00 0.00 61.98 62.58 3hsy s VAL 236 Cb -0.27 -0.42 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 3hsy s VAL 236 CO 0.33 0.20 -0.17 -0.44 0.00 0.00 0.00 175.10 175.02 3hsy s SER 237 N 1.28 2.98 0.00 3.32 0.01 0.21 -1.11 113.70 120.39 3hsy s SER 237 Ca -0.06 -0.99 0.00 0.00 1.31 0.00 0.00 55.95 56.21 3hsy s SER 237 Cb -0.13 -0.20 0.00 0.00 0.21 0.00 0.00 66.02 65.90 3hsy s SER 237 CO -0.02 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.18 3hsy n GLY 238 N -0.32 1.41 3.09 3.44 0.00 -0.29 -0.11 105.19 112.41 3hsy n GLY 238 Ca -0.08 -0.69 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.69 0.89 -0.12 1.61 0.08 -1.25 -0.83 117.98 115.66 3hsy s PHE 239 Ca 0.00 -0.42 -0.06 0.00 0.12 0.00 0.00 56.93 56.57 3hsy s PHE 239 Cb 0.00 -0.52 0.05 0.00 -0.57 0.00 0.00 43.02 41.98 3hsy s PHE 239 CO 0.00 -0.02 0.28 -1.14 -0.10 0.00 0.00 175.22 174.25 3hsy s GLN 240 N -1.37 0.24 -0.01 0.44 2.00 -0.36 -1.10 119.66 119.50 3hsy s GLN 240 Ca -0.04 0.62 0.15 0.00 -2.00 0.00 0.00 55.36 54.09 3hsy s GLN 240 Cb -0.09 -0.08 -0.19 0.00 0.80 0.00 0.00 33.01 33.45 3hsy s GLN 240 CO 0.01 -0.18 0.52 0.44 -0.50 0.00 0.00 175.29 175.58 3hsy n ILE 241 N 4.41 0.00 -3.48 -2.34 -5.35 -1.17 -0.51 119.36 110.92 3hsy n ILE 241 Ca -0.22 -0.22 -0.41 0.00 -0.27 0.00 0.00 62.75 61.62 3hsy n ILE 241 Cb 0.53 0.69 -0.10 0.00 -1.74 0.00 0.00 39.64 39.02 3hsy n ILE 241 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 3hsy s VAL 242 N -2.64 5.25 -0.42 7.28 1.01 -1.26 -4.17 120.40 125.45 3hsy s VAL 242 Ca 0.02 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 3hsy s VAL 242 Cb 0.11 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.72 3hsy s VAL 242 CO 0.62 -0.13 0.31 -0.62 0.00 0.00 0.00 175.10 175.28 3hsy s ASP 243 N 1.72 6.04 0.00 3.32 -1.08 -1.26 -4.94 116.67 120.47 3hsy s ASP 243 Ca 0.07 -1.07 0.16 0.00 -0.52 0.00 0.00 52.55 51.19 3hsy s ASP 243 Cb -0.18 -2.14 0.72 0.00 -1.46 0.00 0.00 42.92 39.87 3hsy s ASP 243 CO 0.11 -0.50 1.48 -1.22 0.52 0.00 0.00 175.17 175.55 3hsy n TYR 244 N 5.14 0.00 0.20 -5.34 4.01 -1.26 -1.26 117.16 118.64 3hsy n TYR 244 Ca -0.11 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.74 3hsy n TYR 244 Cb 0.46 -0.41 0.14 0.00 -0.31 0.00 0.00 39.34 39.22 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 -2.77 7.72 3.32 -1.98 -3.37 116.42 119.34 3hsy h ASP 245 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 3hsy h ASP 245 Cb 0.21 0.00 0.06 0.00 0.22 0.00 0.00 39.33 39.82 3hsy h ASP 245 CO 0.00 0.03 0.97 -1.81 -1.72 0.00 0.00 179.24 176.71 3hsy s ASP 246 N -6.10 6.42 0.34 6.45 1.11 -0.39 -4.89 116.67 119.60 3hsy s ASP 246 Ca 0.06 2.83 0.03 0.00 0.18 0.00 0.00 52.55 55.65 3hsy s ASP 246 Cb 0.06 -2.60 0.64 0.00 1.07 0.00 0.00 42.92 42.08 3hsy s ASP 246 CO 0.69 -0.94 1.96 0.77 1.18 0.00 0.00 175.17 178.83 3hsy h SER 247 N 6.57 0.77 -0.80 0.27 4.64 -1.88 -0.17 113.55 122.95 3hsy h SER 247 Ca -0.43 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3hsy h SER 247 Cb 1.20 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 63.08 3hsy h SER 247 CO 0.93 0.52 0.52 0.25 -0.87 0.00 0.00 176.83 178.17 3hsy h LEU 248 N 0.88 0.93 -0.04 5.97 5.85 -1.94 -0.46 115.31 126.51 3hsy h LEU 248 Ca 0.31 -0.04 -0.16 0.00 0.84 0.00 0.00 57.88 58.83 3hsy h LEU 248 Cb 0.12 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 40.93 3hsy h LEU 248 CO -0.10 0.69 -0.60 0.58 -0.34 0.00 0.00 178.44 178.68 3hsy h VAL 249 N 1.09 1.39 -0.47 1.05 2.07 -1.57 -2.05 116.25 117.75 3hsy h VAL 249 Ca 0.29 -1.99 -0.07 0.00 0.82 0.00 0.00 66.70 65.75 3hsy h VAL 249 Cb -0.10 2.41 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 3hsy h VAL 249 CO -0.06 0.59 0.01 0.77 0.02 0.00 0.00 177.57 178.90 3hsy h SER 250 N 0.03 0.74 -0.47 0.57 4.64 -0.94 -0.05 113.55 118.07 3hsy h SER 250 Ca -0.06 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.06 3hsy h SER 250 Cb 1.28 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 3hsy h SER 250 CO 0.12 0.80 0.20 0.11 -0.87 0.00 0.00 176.83 177.18 3hsy h LYS 251 N 0.72 0.70 -0.29 4.77 1.79 -1.10 -0.43 116.57 122.73 3hsy h LYS 251 Ca 0.14 -0.12 0.04 0.00 -2.18 0.00 0.00 60.65 58.53 3hsy h LYS 251 Cb 0.43 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 30.93 3hsy h LYS 251 CO 0.02 0.62 0.07 0.35 -1.08 0.00 0.00 179.45 179.43 3hsy h PHE 252 N 0.62 0.12 -0.25 -1.35 3.57 -0.86 -2.59 116.94 116.20 3hsy h PHE 252 Ca 0.16 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 3hsy h PHE 252 Cb 0.18 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3hsy h PHE 252 CO 0.00 0.04 -0.17 0.82 -2.23 0.00 0.00 178.31 176.77 3hsy h ILE 253 N 0.18 1.23 -0.88 1.41 1.08 -0.78 0.16 117.51 119.92 3hsy h ILE 253 Ca 0.13 -1.07 0.03 0.00 -0.39 0.00 0.00 64.86 63.57 3hsy h ILE 253 Cb 0.13 1.23 -0.05 0.00 -3.07 0.00 0.00 36.82 35.06 3hsy h ILE 253 CO -0.16 0.34 0.58 -0.33 -0.69 0.00 0.00 178.15 177.89 3hsy h GLU 254 N 0.40 1.06 0.03 2.37 5.08 -0.70 0.06 114.58 122.88 3hsy h GLU 254 Ca 0.07 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.27 3hsy h GLU 254 Cb 0.53 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.55 3hsy h GLU 254 CO 0.03 0.70 -0.39 -0.09 -1.00 0.00 0.00 179.01 178.27 3hsy h ARG 255 N 1.10 0.22 -0.35 2.33 9.65 -1.07 -3.36 114.38 122.90 3hsy h ARG 255 Ca 0.35 -0.27 -0.03 0.00 -1.10 0.00 0.00 59.98 58.93 3hsy h ARG 255 Cb 0.02 0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.67 3hsy h ARG 255 CO -0.10 1.02 0.07 2.35 2.80 0.00 0.00 179.97 186.11 3hsy h TRP 256 N -0.47 0.52 0.00 2.20 2.91 -0.50 -2.98 115.95 117.63 3hsy h TRP 256 Ca -0.06 -0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.93 3hsy h TRP 256 Cb 1.18 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 29.67 3hsy h TRP 256 CO 0.19 0.46 0.00 -1.13 -1.03 0.00 0.00 178.44 176.93 3hsy n SER 257 N -4.34 0.26 -0.32 2.65 3.41 -0.01 -1.88 113.62 113.40 3hsy n SER 257 Ca 0.02 0.56 0.05 0.00 -0.26 0.00 0.00 58.87 59.25 3hsy n SER 257 Cb 0.19 -0.62 0.02 0.00 -0.26 0.00 0.00 64.21 63.54 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 -1.78 0.00 -1.90 6.66 -2.24 -1.13 -4.31 114.28 109.58 3hsy n THR 258 Ca 0.03 -0.43 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 3hsy n THR 258 Cb 0.19 1.16 -0.01 0.00 -2.10 0.00 0.00 70.33 69.57 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 -1.42 4.35 0.09 3.22 1.43 -1.01 -4.92 118.68 120.42 3hsy s LEU 259 Ca 0.10 2.94 -0.31 0.00 -1.03 0.00 0.00 54.13 55.84 3hsy s LEU 259 Cb 0.09 -3.66 -0.07 0.00 0.03 0.00 0.00 46.19 42.58 3hsy s LEU 259 CO 0.23 -0.77 1.28 -0.70 0.23 0.00 0.00 176.35 176.61 3hsy s GLU 260 N -1.96 4.39 0.36 1.70 -6.30 -1.26 -3.48 118.70 112.14 3hsy s GLU 260 Ca 0.52 1.90 0.15 0.00 -2.50 0.00 0.00 54.97 55.04 3hsy s GLU 260 Cb -0.45 -3.30 0.66 0.00 0.00 0.00 0.00 34.13 31.04 3hsy s GLU 260 CO 0.60 -0.33 1.75 1.49 0.02 0.00 0.00 175.26 178.79 3hsy h GLU 261 N 6.75 0.00 -0.19 4.30 4.22 -1.86 0.15 114.58 127.95 3hsy h GLU 261 Ca -0.42 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 58.96 3hsy h GLU 261 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 3hsy h GLU 261 CO 0.83 0.43 -0.10 0.87 -2.18 0.00 0.00 179.01 178.85 3hsy h LYS 262 N 0.00 0.41 -0.17 1.92 1.79 -1.97 -2.84 116.57 115.71 3hsy h LYS 262 Ca -0.00 -0.18 -0.16 0.00 -2.18 0.00 0.00 60.65 58.12 3hsy h LYS 262 Cb 0.84 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.48 3hsy h LYS 262 CO 0.06 0.71 -0.57 1.49 -1.08 0.00 0.00 179.45 180.06 3hsy h GLU 263 N 0.10 0.52 -2.85 3.15 4.57 -1.90 -3.36 114.58 114.80 3hsy h GLU 263 Ca 0.04 -0.33 -0.61 0.00 -1.18 0.00 0.00 59.36 57.28 3hsy h GLU 263 Cb 0.60 0.04 -0.41 0.00 -0.16 0.00 0.00 28.75 28.82 3hsy h GLU 263 CO 0.03 0.94 -0.68 0.66 -1.18 0.00 0.00 179.01 178.78 3hsy n TYR 264 N -3.94 2.22 -1.61 0.92 4.01 0.02 -5.05 117.16 113.72 3hsy n TYR 264 Ca -0.03 -4.05 -0.48 0.00 -0.16 0.00 0.00 57.90 53.17 3hsy n TYR 264 Cb 0.61 -0.40 -0.04 0.00 -0.31 0.00 0.00 39.34 39.20 3hsy n TYR 264 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 3hsy n PRO 265 N 2.10 1.47 -0.03 -0.72 -0.02 -1.07 -1.19 135.00 135.54 3hsy n PRO 265 Ca 0.23 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3hsy n PRO 265 Cb 0.39 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 3hsy n PRO 265 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hsy n GLY 266 N 2.25 1.78 0.00 -1.23 0.00 -1.26 -3.69 105.19 103.03 3hsy n GLY 266 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.76 0.00 -2.86 4.61 0.00 -0.33 -4.59 120.51 116.59 3hsy n ALA 267 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 3hsy n ALA 267 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 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 -0.78 -1.61 -4.42 0.00 -0.00 -0.79 -4.76 115.22 102.87 3hsy n HIS 268 Ca 0.00 0.41 -0.22 0.00 -0.00 0.00 0.00 57.72 57.91 3hsy n HIS 268 Cb 0.00 -3.98 -0.10 0.00 -0.00 0.00 0.00 29.99 25.91 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 -3.07 2.15 -1.36 3.57 -4.23 -1.26 -4.90 115.64 106.54 3hsy s THR 269 Ca 0.24 -2.31 0.26 0.00 -1.18 0.00 0.00 61.69 58.69 3hsy s THR 269 Cb -0.10 -2.22 0.17 0.00 1.34 0.00 0.00 72.50 71.69 3hsy s THR 269 CO 0.29 -0.47 1.55 0.00 -0.54 0.00 0.00 174.62 175.46 3hsy n ALA 270 N -0.53 3.22 -2.33 3.99 0.00 -1.26 -4.00 120.51 119.60 3hsy n ALA 270 Ca -0.06 -0.35 -0.17 0.00 0.00 0.00 0.00 53.44 52.86 3hsy n ALA 270 Cb 0.60 -1.17 -0.10 0.00 0.00 0.00 0.00 19.45 18.79 3hsy n ALA 270 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hsy s THR 271 N -2.75 1.27 -0.03 0.00 -4.23 -1.26 -5.01 115.64 103.63 3hsy s THR 271 Ca 0.18 -2.08 0.02 0.00 -1.18 0.00 0.00 61.69 58.64 3hsy s THR 271 Cb 0.19 -2.20 0.01 0.00 1.34 0.00 0.00 72.50 71.83 3hsy s THR 271 CO 0.60 -0.46 -0.09 0.27 -0.54 0.00 0.00 174.62 174.39 3hsy s ILE 272 N -3.27 0.80 0.45 2.99 -5.25 -1.26 -5.02 121.20 110.64 3hsy s ILE 272 Ca 0.25 -0.36 -0.25 0.00 -0.99 0.00 0.00 60.65 59.30 3hsy s ILE 272 Cb 0.04 -0.72 -0.08 0.00 2.95 0.00 0.00 42.46 44.65 3hsy s ILE 272 CO 0.07 0.25 1.39 -0.54 -1.79 0.00 0.00 174.94 174.32 3hsy s LYS 273 N 0.27 3.67 0.43 0.37 1.02 -1.26 -4.75 119.74 119.49 3hsy s LYS 273 Ca -0.04 2.33 0.12 0.00 0.02 0.00 0.00 55.97 58.40 3hsy s LYS 273 Cb -0.09 -2.62 1.00 0.00 -0.52 0.00 0.00 37.83 35.60 3hsy s LYS 273 CO 0.01 -0.80 2.01 0.10 -0.92 0.00 0.00 175.35 175.75 3hsy h TYR 274 N 2.27 0.43 -0.20 3.18 -0.00 -1.93 0.49 116.97 121.21 3hsy h TYR 274 Ca -0.51 0.01 -0.10 0.00 -0.00 0.00 0.00 58.73 58.14 3hsy h TYR 274 Cb 1.27 -0.14 -0.01 0.00 -0.00 0.00 0.00 36.73 37.84 3hsy h TYR 274 CO 0.50 0.22 -0.30 1.79 -0.00 0.00 0.00 178.16 180.38 3hsy h THR 275 N 0.42 1.27 -0.24 -0.90 1.35 -1.92 -0.18 112.91 112.70 3hsy h THR 275 Ca 0.23 -1.31 -0.19 0.00 -0.55 0.00 0.00 66.41 64.59 3hsy h THR 275 Cb 0.37 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 3hsy h THR 275 CO -0.06 0.41 -0.59 0.28 -0.25 0.00 0.00 175.52 175.30 3hsy h SER 276 N 0.34 0.90 -0.37 5.36 0.02 -1.33 -1.68 113.55 116.78 3hsy h SER 276 Ca 0.05 -0.50 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 3hsy h SER 276 Cb 0.70 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 3hsy h SER 276 CO 0.05 1.29 0.24 0.00 -1.14 0.00 0.00 176.83 177.27 3hsy h ALA 277 N 0.72 0.47 -0.10 3.77 0.00 -0.89 -1.41 119.26 121.83 3hsy h ALA 277 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3hsy h ALA 277 Cb 1.19 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 3hsy h ALA 277 CO 0.13 -0.05 -0.07 -0.07 0.00 0.00 0.00 179.25 179.19 3hsy h LEU 278 N 0.50 0.13 -0.12 0.00 3.38 -0.98 -0.30 115.31 117.92 3hsy h LEU 278 Ca 0.14 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 3hsy h LEU 278 Cb -0.04 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 3hsy h LEU 278 CO -0.03 0.22 -0.06 0.74 0.09 0.00 0.00 178.44 179.41 3hsy h THR 279 N 0.14 1.32 -0.56 0.22 2.02 -0.67 -0.21 112.91 115.16 3hsy h THR 279 Ca 0.03 -1.08 0.05 0.00 0.77 0.00 0.00 66.41 66.19 3hsy h THR 279 Cb 0.21 1.78 -0.05 0.00 -1.74 0.00 0.00 68.15 68.35 3hsy h THR 279 CO 0.01 0.31 0.28 0.22 0.37 0.00 0.00 175.52 176.72 3hsy h TYR 280 N -0.09 0.52 -0.46 3.16 3.20 -1.09 -2.26 116.97 119.95 3hsy h TYR 280 Ca 0.03 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 3hsy h TYR 280 Cb 0.51 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 3hsy h TYR 280 CO 0.07 0.24 0.13 -0.44 -1.64 0.00 0.00 178.16 176.51 3hsy h ASP 281 N 0.54 0.64 -0.55 -2.11 3.32 -0.96 -2.31 116.42 114.98 3hsy h ASP 281 Ca 0.25 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 3hsy h ASP 281 Cb 0.18 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3hsy h ASP 281 CO -0.18 0.62 0.31 0.00 -1.72 0.00 0.00 179.24 178.27 3hsy h ALA 282 N 1.47 1.45 -0.64 3.45 0.00 -0.46 -0.13 119.26 124.40 3hsy h ALA 282 Ca 0.16 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3hsy h ALA 282 Cb 0.23 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hsy h ALA 282 CO -0.01 0.45 0.16 0.28 0.00 0.00 0.00 179.25 180.14 3hsy h VAL 283 N 0.80 1.26 -0.34 0.00 2.07 -1.04 -0.58 116.25 118.42 3hsy h VAL 283 Ca 0.20 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.81 3hsy h VAL 283 Cb 0.04 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 3hsy h VAL 283 CO -0.03 0.35 0.20 -0.61 0.02 0.00 0.00 177.57 177.50 3hsy h GLN 284 N 0.95 0.39 -0.21 1.57 4.15 -1.14 -0.79 115.11 120.03 3hsy h GLN 284 Ca 0.20 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.61 3hsy h GLN 284 Cb 0.35 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 3hsy h GLN 284 CO 0.00 0.26 0.12 0.28 -1.93 0.00 0.00 178.83 177.57 3hsy h VAL 285 N 0.40 1.03 -0.82 2.39 2.07 -0.76 -0.42 116.25 120.14 3hsy h VAL 285 Ca 0.13 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 3hsy h VAL 285 Cb 0.00 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 3hsy h VAL 285 CO -0.06 0.05 0.38 0.24 0.02 0.00 0.00 177.57 178.20 3hsy h MET 286 N 0.26 1.18 -0.16 1.57 2.86 -1.00 -0.14 114.93 119.51 3hsy h MET 286 Ca 0.08 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 3hsy h MET 286 Cb -0.01 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 3hsy h MET 286 CO -0.04 0.92 0.09 1.15 1.06 0.00 0.00 176.91 180.09 3hsy h THR 287 N 1.16 1.09 -0.47 2.22 2.02 -0.81 -0.26 112.91 117.85 3hsy h THR 287 Ca 0.28 -0.23 -0.07 0.00 0.77 0.00 0.00 66.41 67.16 3hsy h THR 287 Cb 0.13 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 3hsy h THR 287 CO -0.03 0.08 0.00 -0.33 0.37 0.00 0.00 175.52 175.61 3hsy h GLU 288 N 0.16 0.77 -0.42 6.66 4.39 -0.86 -1.77 114.58 123.52 3hsy h GLU 288 Ca 0.06 -0.20 -0.11 0.00 0.34 0.00 0.00 59.36 59.44 3hsy h GLU 288 Cb 0.05 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 3hsy h GLU 288 CO -0.01 0.78 -0.18 0.00 -1.16 0.00 0.00 179.01 178.44 3hsy h ALA 289 N 1.28 0.59 0.00 3.43 0.00 -0.78 -3.35 119.26 120.43 3hsy h ALA 289 Ca 0.14 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3hsy h ALA 289 Cb 0.44 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3hsy h ALA 289 CO 0.02 0.54 -1.45 1.19 0.00 0.00 0.00 179.25 179.55 3hsy n PHE 290 N -4.23 0.69 0.33 0.00 3.72 -0.13 -4.24 117.46 113.61 3hsy n PHE 290 Ca -0.01 0.21 0.22 0.00 -0.05 0.00 0.00 57.45 57.83 3hsy n PHE 290 Cb 0.42 -0.90 1.16 0.00 -0.94 0.00 0.00 39.48 39.22 3hsy n PHE 290 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 3hsy h ARG 291 N 0.00 0.00 0.00 -1.08 0.11 -1.46 -1.32 114.38 110.63 3hsy h ARG 291 Ca -0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.99 3hsy h ARG 291 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 3hsy h ARG 291 CO 0.02 0.00 -0.99 0.09 0.10 0.00 0.00 179.97 179.19 3hsy n ASN 292 N -3.09 0.85 -4.74 0.08 5.03 -1.26 -5.00 115.26 107.14 3hsy n ASN 292 Ca -0.03 -0.84 -0.32 0.00 0.87 0.00 0.00 54.58 54.26 3hsy n ASN 292 Cb 0.10 1.09 0.10 0.00 -1.02 0.00 0.00 39.78 40.05 3hsy n ASN 292 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3hsy s LEU 293 N -3.03 3.09 0.25 3.41 1.43 -0.50 -4.92 118.68 118.41 3hsy s LEU 293 Ca 0.06 2.03 -0.31 0.00 -1.03 0.00 0.00 54.13 54.87 3hsy s LEU 293 Cb 0.14 -4.55 -0.13 0.00 0.03 0.00 0.00 46.19 41.68 3hsy s LEU 293 CO 0.77 -2.27 1.46 -2.11 0.23 0.00 0.00 176.35 174.43 3hsy n ARG 294 N -3.39 2.22 -2.54 1.70 1.85 -1.26 -4.88 116.66 110.35 3hsy n ARG 294 Ca 0.11 0.79 -0.41 0.00 -1.00 0.00 0.00 57.85 57.33 3hsy n ARG 294 Cb 0.52 -2.48 -0.01 0.00 -1.05 0.00 0.00 32.46 29.44 3hsy n ARG 294 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3hsy s LYS 295 N -0.38 3.79 0.65 2.89 1.02 -1.26 -4.99 119.74 121.47 3hsy s LYS 295 Ca 0.67 -1.71 -0.17 0.00 0.02 0.00 0.00 55.97 54.79 3hsy s LYS 295 Cb -0.61 -5.47 -0.03 0.00 -0.52 0.00 0.00 37.83 31.20 3hsy s LYS 295 CO 0.49 -2.35 0.86 0.00 -0.92 0.00 0.00 175.35 173.43 3hsy n GLN 296 N 8.53 0.65 -1.65 1.68 -0.00 -1.26 -4.81 117.38 120.51 3hsy n GLN 296 Ca 0.45 0.27 -0.50 0.00 -0.00 0.00 0.00 57.00 57.21 3hsy n GLN 296 Cb 0.47 -2.09 -0.05 0.00 -0.00 0.00 0.00 30.24 28.57 3hsy n GLN 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3hsy n ARG 297 N -1.16 1.72 -1.47 2.61 5.12 -1.26 -4.77 116.66 117.44 3hsy n ARG 297 Ca 0.13 0.62 -0.48 0.00 -1.93 0.00 0.00 57.85 56.19 3hsy n ARG 297 Cb 0.48 -2.36 -0.07 0.00 -1.16 0.00 0.00 32.46 29.36 3hsy n ARG 297 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 3hsy n ILE 298 N 3.59 0.16 -3.79 0.55 5.41 -1.26 -4.93 119.36 119.09 3hsy n ILE 298 Ca 0.20 -0.31 -0.23 0.00 1.00 0.00 0.00 62.75 63.40 3hsy n ILE 298 Cb 0.24 -1.76 -0.04 0.00 -0.71 0.00 0.00 39.64 37.37 3hsy n ILE 298 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 3hsy s GLU 299 N 6.63 2.38 0.01 0.38 1.03 -1.26 -5.11 118.70 122.76 3hsy s GLU 299 Ca 1.09 -1.73 -0.20 0.00 0.03 0.00 0.00 54.97 54.16 3hsy s GLU 299 Cb -0.77 -2.21 -0.06 0.00 -0.80 0.00 0.00 34.13 30.29 3hsy s GLU 299 CO 0.45 -0.27 0.59 0.42 -1.33 0.00 0.00 175.26 175.12 3hsy s ILE 300 N -2.58 4.88 -0.23 1.83 1.09 -1.26 -5.06 121.20 119.87 3hsy s ILE 300 Ca 0.43 1.24 -0.15 0.00 -1.10 0.00 0.00 60.65 61.06 3hsy s ILE 300 Cb -0.01 -3.92 -0.04 0.00 -1.06 0.00 0.00 42.46 37.43 3hsy s ILE 300 CO 0.25 0.44 0.39 -0.55 -0.10 0.00 0.00 174.94 175.37 3hsy s SER 301 N -0.37 6.37 0.01 3.58 0.15 -1.26 -5.07 113.70 117.12 3hsy s SER 301 Ca 0.31 0.43 0.07 0.00 0.70 0.00 0.00 55.95 57.46 3hsy s SER 301 Cb -0.18 -2.22 -0.02 0.00 -1.71 0.00 0.00 66.02 61.88 3hsy s SER 301 CO 0.17 -0.11 -0.21 -0.13 1.20 0.00 0.00 173.24 174.16 3hsy s ARG 302 N 1.57 1.56 0.22 5.44 0.52 -1.26 -5.10 118.95 121.90 3hsy s ARG 302 Ca 0.17 -0.86 -0.27 0.00 -0.52 0.00 0.00 55.73 54.26 3hsy s ARG 302 Cb -0.15 -1.60 -0.17 0.00 0.52 0.00 0.00 34.95 33.56 3hsy s ARG 302 CO 0.08 0.42 0.46 -2.13 0.02 0.00 0.00 175.30 174.16 3hsy n ARG 303 N 2.19 0.00 -3.11 3.54 3.00 -1.26 -4.52 116.66 116.50 3hsy n ARG 303 Ca -0.16 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.41 3hsy n ARG 303 Cb 0.53 -0.99 -0.02 0.00 0.00 0.00 0.00 32.46 31.97 3hsy n ARG 303 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 3hsy s GLY 304 N -0.99 1.76 -0.24 5.14 0.00 -1.26 -4.80 107.32 106.93 3hsy s GLY 304 Ca 0.63 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.85 3hsy s GLY 304 CO 0.56 -0.37 -0.11 -1.31 0.00 0.00 0.00 173.10 171.87 3hsy s ASN 305 N -3.42 4.07 0.50 1.64 -0.87 -1.26 -4.89 114.94 110.71 3hsy s ASN 305 Ca 0.46 -0.97 0.19 0.00 -1.57 0.00 0.00 52.86 50.97 3hsy s ASN 305 Cb -0.10 -1.59 1.24 0.00 -0.02 0.00 0.00 41.25 40.78 3hsy s ASN 305 CO 0.33 -0.12 2.03 0.00 -2.57 0.00 0.00 177.10 176.78 3hsy h ALA 306 N 7.93 2.22 0.00 0.60 0.00 -1.83 -0.49 119.26 127.68 3hsy h ALA 306 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3hsy h ALA 306 Cb 1.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3hsy h ALA 306 CO 0.56 -0.32 0.02 0.78 0.00 0.00 0.00 179.25 180.28 3hsy h GLY 307 N 0.13 0.00 2.00 0.00 0.00 -1.94 -1.44 103.07 101.82 3hsy h GLY 307 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3hsy h GLY 307 CO -0.02 0.00 0.00 -0.55 0.00 0.00 0.00 176.54 175.97 3hsy h ASP 308 N 0.00 0.00 -0.08 0.19 3.32 -1.39 -0.93 116.42 117.52 3hsy h ASP 308 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 3hsy h ASP 308 Cb 0.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 3hsy h ASP 308 CO 0.00 0.00 0.06 0.00 -1.72 0.00 0.00 179.24 177.58 3hsy n LEU 310 N -4.45 0.00 0.02 0.00 4.77 -0.45 -4.61 117.00 112.28 3hsy n LEU 310 Ca -0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.83 3hsy n LEU 310 Cb 0.17 0.08 -0.14 0.00 -2.33 0.00 0.00 43.42 41.20 3hsy n LEU 310 CO 0.34 0.08 -0.46 0.00 -1.33 0.00 0.00 177.39 176.02 3hsy h ALA 311 N 1.21 0.51 -3.14 -1.18 0.00 -1.16 -3.47 119.26 112.03 3hsy h ALA 311 Ca -0.08 -1.29 -0.63 0.00 0.00 0.00 0.00 54.91 52.91 3hsy h ALA 311 Cb 0.94 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 19.05 3hsy h ALA 311 CO 0.00 1.36 -0.60 -0.80 0.00 0.00 0.00 179.25 179.21 3hsy s ASN 312 N -6.62 5.49 0.71 0.00 0.01 -0.38 -5.04 114.94 109.10 3hsy s ASN 312 Ca -0.09 -0.04 -0.11 0.00 -0.71 0.00 0.00 52.86 51.91 3hsy s ASN 312 Cb 0.07 -1.46 0.02 0.00 0.41 0.00 0.00 41.25 40.30 3hsy s ASN 312 CO 0.82 0.16 1.07 -2.16 -1.51 0.00 0.00 177.10 175.48 3hsy s PRO 313 N -2.47 2.81 0.76 -0.60 0.04 -1.26 -4.78 135.00 129.50 3hsy s PRO 313 Ca 0.29 0.88 -0.14 0.00 0.04 0.00 0.00 61.00 62.07 3hsy s PRO 313 Cb -0.12 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.50 3hsy s PRO 313 CO 0.22 -1.17 1.22 0.00 0.04 0.00 0.00 177.00 177.31 3hsy s ALA 314 N -3.07 2.00 0.21 8.56 0.00 -1.26 -4.93 121.76 123.26 3hsy s ALA 314 Ca 0.58 0.92 -0.32 0.00 0.00 0.00 0.00 51.96 53.14 3hsy s ALA 314 Cb -0.14 -3.50 -0.12 0.00 0.00 0.00 0.00 23.12 19.36 3hsy s ALA 314 CO 0.55 -2.08 1.70 0.28 0.00 0.00 0.00 175.76 176.20 3hsy n VAL 315 N -2.93 0.07 -1.63 0.00 0.31 -0.52 -4.88 118.33 108.76 3hsy n VAL 315 Ca 0.14 -0.02 -0.47 0.00 -0.01 0.00 0.00 64.34 63.98 3hsy n VAL 315 Cb 0.50 -1.92 -0.03 0.00 -0.91 0.00 0.00 33.84 31.47 3hsy n VAL 315 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3hsy n PRO 316 N 3.77 1.68 -0.29 5.55 -0.02 -1.26 -4.64 135.00 139.78 3hsy n PRO 316 Ca 0.16 0.60 0.02 0.00 -2.02 0.00 0.00 63.50 62.26 3hsy n PRO 316 Cb 0.34 -2.20 0.16 0.00 -0.02 0.00 0.00 33.50 31.78 3hsy n PRO 316 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 3hsy h TRP 317 N 4.06 0.84 0.00 6.00 7.01 -1.94 0.40 115.95 132.32 3hsy h TRP 317 Ca -0.44 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 60.58 3hsy h TRP 317 Cb 1.30 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 28.10 3hsy h TRP 317 CO 0.56 0.35 -0.02 0.78 -2.79 0.00 0.00 178.44 177.32 3hsy h GLY 318 N 0.79 0.00 0.12 2.65 0.00 -2.00 0.47 103.07 105.10 3hsy h GLY 318 Ca 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.72 3hsy h GLY 318 CO -0.24 0.00 -0.01 1.46 0.00 0.00 0.00 176.54 177.75 3hsy h GLN 319 N 0.00 -0.04 -0.30 4.80 4.20 -1.30 -3.34 115.11 119.13 3hsy h GLN 319 Ca -0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 3hsy h GLN 319 Cb 0.04 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 3hsy h GLN 319 CO 0.00 0.63 -0.07 0.78 -0.67 0.00 0.00 178.83 179.50 3hsy h GLY 320 N -0.92 0.53 2.00 3.46 0.00 -1.02 -2.79 103.07 104.33 3hsy h GLY 320 Ca -0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 3hsy h GLY 320 CO 0.01 0.32 -0.22 -0.24 0.00 0.00 0.00 176.54 176.40 3hsy h VAL 321 N 0.46 0.81 -0.58 4.60 3.04 -1.07 -1.83 116.25 121.68 3hsy h VAL 321 Ca 0.09 -0.89 -0.06 0.00 -1.01 0.00 0.00 66.70 64.83 3hsy h VAL 321 Cb 0.42 1.54 -0.03 0.00 -2.01 0.00 0.00 31.29 31.21 3hsy h VAL 321 CO 0.02 0.22 0.13 -0.33 -1.01 0.00 0.00 177.57 176.60 3hsy h GLU 322 N 0.00 0.91 -0.13 4.17 5.08 -1.61 -0.08 114.58 122.91 3hsy h GLU 322 Ca -0.00 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.03 3hsy h GLU 322 Cb 0.52 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3hsy h GLU 322 CO 0.03 0.82 -0.42 0.82 -1.00 0.00 0.00 179.01 179.26 3hsy h ILE 323 N 0.87 1.36 -0.46 3.13 2.04 -1.46 -2.26 117.51 120.72 3hsy h ILE 323 Ca 0.19 -1.71 0.06 0.00 1.00 0.00 0.00 64.86 64.40 3hsy h ILE 323 Cb 0.33 2.08 -0.06 0.00 -0.74 0.00 0.00 36.82 38.44 3hsy h ILE 323 CO 0.00 0.52 0.15 -0.08 0.00 0.00 0.00 178.15 178.74 3hsy h GLU 324 N 0.13 0.30 -0.34 2.37 4.81 -1.24 -1.47 114.58 119.14 3hsy h GLU 324 Ca -0.01 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.09 3hsy h GLU 324 Cb 1.04 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 3hsy h GLU 324 CO 0.09 0.20 -0.25 0.00 -0.73 0.00 0.00 179.01 178.32 3hsy h ARG 325 N 0.31 0.67 -0.62 1.92 3.08 -1.02 -1.57 114.38 117.15 3hsy h ARG 325 Ca 0.22 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 3hsy h ARG 325 Cb 0.24 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 3hsy h ARG 325 CO -0.24 0.86 0.32 0.00 -1.07 0.00 0.00 179.97 179.84 3hsy h ALA 326 N 1.14 0.80 -0.28 0.04 0.00 -0.93 -1.12 119.26 118.91 3hsy h ALA 326 Ca 0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3hsy h ALA 326 Cb 0.74 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3hsy h ALA 326 CO 0.06 0.34 0.11 -0.07 0.00 0.00 0.00 179.25 179.68 3hsy h LEU 327 N 0.85 0.39 -1.37 0.00 3.38 -0.99 -3.02 115.31 114.54 3hsy h LEU 327 Ca 0.22 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3hsy h LEU 327 Cb 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3hsy h LEU 327 CO -0.03 0.46 0.00 0.11 0.09 0.00 0.00 178.44 179.07 3hsy h LYS 328 N 0.30 0.00 -0.00 1.13 1.57 -0.91 -2.68 116.57 115.97 3hsy h LYS 328 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3hsy h LYS 328 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3hsy h LYS 328 CO -0.01 0.00 -0.24 1.04 -0.57 0.00 0.00 179.45 179.68 3hsy n GLN 329 N -2.91 0.19 -1.98 3.15 6.02 -0.46 -4.14 117.38 117.26 3hsy n GLN 329 Ca 0.01 -0.08 -0.41 0.00 -0.01 0.00 0.00 57.00 56.51 3hsy n GLN 329 Cb 0.28 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.02 3hsy n GLN 329 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hsy s VAL 330 N -2.86 2.54 -0.23 5.09 1.01 -1.01 -5.00 120.40 119.95 3hsy s VAL 330 Ca 0.17 0.47 -0.02 0.00 0.00 0.00 0.00 61.98 62.60 3hsy s VAL 330 Cb 0.19 -3.30 0.07 0.00 0.00 0.00 0.00 36.38 33.33 3hsy s VAL 330 CO 0.59 0.08 0.03 -1.10 0.00 0.00 0.00 175.10 174.70 3hsy s GLN 331 N -0.73 0.87 0.14 2.72 -0.21 -1.26 -4.33 119.66 116.86 3hsy s GLN 331 Ca 0.58 -0.67 -0.02 0.00 0.02 0.00 0.00 55.36 55.26 3hsy s GLN 331 Cb -0.43 -2.19 -0.03 0.00 1.00 0.00 0.00 33.01 31.36 3hsy s GLN 331 CO 0.47 -0.70 0.10 0.14 -2.12 0.00 0.00 175.29 173.18 3hsy s VAL 332 N 1.71 0.09 -0.16 1.09 -7.23 -1.01 -5.02 120.40 109.88 3hsy s VAL 332 Ca 0.00 -1.82 -0.07 0.00 -1.81 0.00 0.00 61.98 58.28 3hsy s VAL 332 Cb -0.17 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 3hsy s VAL 332 CO -0.11 -0.41 0.08 -1.61 -0.31 0.00 0.00 175.10 172.74 3hsy s GLU 333 N -4.04 3.77 0.00 4.82 0.41 -1.26 -0.83 118.70 121.57 3hsy s GLU 333 Ca 0.24 -0.29 0.00 0.00 -0.41 0.00 0.00 54.97 54.50 3hsy s GLU 333 Cb 0.07 -3.18 0.00 0.00 -1.78 0.00 0.00 34.13 29.24 3hsy s GLU 333 CO 0.02 0.44 0.00 0.41 -0.49 0.00 0.00 175.26 175.63 3hsy n GLY 334 N 3.04 4.66 0.25 -1.39 0.00 -0.20 -4.98 105.19 106.57 3hsy n GLY 334 Ca -0.17 -1.71 0.06 0.00 0.00 0.00 0.00 46.02 44.19 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 0.06 -2.85 0.99 3.38 -1.94 -1.69 115.31 113.26 3hsy h LEU 335 Ca 0.00 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 3hsy h LEU 335 Cb 0.00 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.67 3hsy h LEU 335 CO 0.00 0.15 0.13 -1.54 0.09 0.00 0.00 178.44 177.26 3hsy n SER 336 N -4.41 3.91 0.00 -0.43 3.41 -1.26 -4.20 113.62 110.63 3hsy n SER 336 Ca -0.02 -2.74 0.00 0.00 -0.26 0.00 0.00 58.87 55.85 3hsy n SER 336 Cb 0.17 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 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 0.11 0.09 3.68 5.00 0.00 -0.64 -4.82 105.19 108.62 3hsy n GLY 337 Ca 0.24 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 3hsy n GLY 337 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hsy s ASN 338 N -4.00 6.93 -0.25 1.61 2.47 -1.26 -1.03 114.94 119.41 3hsy s ASN 338 Ca 0.00 1.95 -0.05 0.00 0.42 0.00 0.00 52.86 55.18 3hsy s ASN 338 Cb 0.00 -2.55 -0.00 0.00 -1.45 0.00 0.00 41.25 37.24 3hsy s ASN 338 CO 0.00 -0.69 -0.00 -0.63 -3.72 0.00 0.00 177.10 172.06 3hsy s ILE 339 N 2.57 3.54 -0.07 -5.21 1.01 -0.01 -4.52 121.20 118.51 3hsy s ILE 339 Ca 0.60 -0.60 -0.16 0.00 0.00 0.00 0.00 60.65 60.49 3hsy s ILE 339 Cb -0.28 -2.71 0.03 0.00 0.01 0.00 0.00 42.46 39.52 3hsy s ILE 339 CO 0.23 0.29 0.37 -0.75 0.00 0.00 0.00 174.94 175.08 3hsy s LYS 340 N 1.47 0.62 0.10 2.79 2.20 -1.26 -2.39 119.74 123.28 3hsy s LYS 340 Ca 0.04 0.13 0.10 0.00 -0.36 0.00 0.00 55.97 55.88 3hsy s LYS 340 Cb -0.15 0.29 -0.04 0.00 -1.51 0.00 0.00 37.83 36.42 3hsy s LYS 340 CO -0.01 -0.15 -0.26 -0.06 -0.36 0.00 0.00 175.35 174.51 3hsy s PHE 341 N -0.73 2.32 0.65 4.03 0.08 -1.26 -1.08 117.98 121.99 3hsy s PHE 341 Ca -0.08 -0.39 -0.07 0.00 0.12 0.00 0.00 56.93 56.51 3hsy s PHE 341 Cb -0.04 -1.31 0.14 0.00 -0.57 0.00 0.00 43.02 41.25 3hsy s PHE 341 CO 0.03 0.26 0.88 -0.40 -0.10 0.00 0.00 175.22 175.90 3hsy n ASP 342 N 1.22 0.44 0.03 1.36 5.68 -0.12 -4.86 116.55 120.31 3hsy n ASP 342 Ca -0.18 -1.55 0.06 0.00 -0.50 0.00 0.00 54.79 52.63 3hsy n ASP 342 Cb 0.53 -0.64 0.28 0.00 -1.14 0.00 0.00 41.12 40.15 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 -2.79 0.04 -0.41 0.11 10.64 -1.26 -1.65 117.38 122.05 3hsy n GLN 343 Ca 0.12 0.35 0.08 0.00 -1.83 0.00 0.00 57.00 55.72 3hsy n GLN 343 Cb 0.43 -1.58 0.26 0.00 -0.86 0.00 0.00 30.24 28.49 3hsy n GLN 343 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3hsy n ASN 344 N -1.65 3.88 -0.14 2.61 3.02 -1.26 -4.96 115.26 116.77 3hsy n ASN 344 Ca 0.02 -2.45 -0.02 0.00 -0.03 0.00 0.00 54.58 52.10 3hsy n ASN 344 Cb 0.14 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 38.85 3hsy n ASN 344 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hsy n GLY 345 N 0.46 0.54 3.84 7.41 0.00 -0.66 -4.69 105.19 112.09 3hsy n GLY 345 Ca 0.20 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.37 3.90 0.26 1.61 -0.14 -1.26 -0.61 119.74 122.14 3hsy s LYS 346 Ca 0.00 0.39 -0.30 0.00 -1.36 0.00 0.00 55.97 54.69 3hsy s LYS 346 Cb 0.00 -3.17 -0.11 0.00 -1.68 0.00 0.00 37.83 32.87 3hsy s LYS 346 CO 0.00 0.66 1.60 1.03 -0.76 0.00 0.00 175.35 177.87 3hsy s ARG 347 N -1.27 4.15 0.23 1.68 1.81 -1.25 -0.94 118.95 123.36 3hsy s ARG 347 Ca 0.26 2.53 0.04 0.00 -1.72 0.00 0.00 55.73 56.84 3hsy s ARG 347 Cb -0.16 -3.05 -0.05 0.00 -0.45 0.00 0.00 34.95 31.23 3hsy s ARG 347 CO 0.15 -0.63 -0.01 0.96 -0.68 0.00 0.00 175.30 175.09 3hsy s ILE 348 N 0.30 1.10 -1.54 1.52 -4.36 -0.25 -4.82 121.20 113.16 3hsy s ILE 348 Ca 0.65 -2.04 -0.01 0.00 -0.26 0.00 0.00 60.65 58.99 3hsy s ILE 348 Cb -0.47 -2.33 0.00 0.00 1.25 0.00 0.00 42.46 40.91 3hsy s ILE 348 CO 0.43 -0.34 0.06 0.59 0.24 0.00 0.00 174.94 175.92 3hsy n ASN 349 N -0.42 -5.28 -4.97 4.36 4.13 -1.26 -4.05 115.26 107.76 3hsy n ASN 349 Ca -0.05 0.01 -0.20 0.00 1.68 0.00 0.00 54.58 56.02 3hsy n ASN 349 Cb 0.64 -4.40 0.03 0.00 -1.54 0.00 0.00 39.78 34.51 3hsy n ASN 349 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 3hsy s TYR 350 N -2.92 2.77 -0.03 3.10 -0.85 -1.26 -4.78 117.35 113.38 3hsy s TYR 350 Ca 0.04 -0.12 0.02 0.00 -0.52 0.00 0.00 57.07 56.49 3hsy s TYR 350 Cb -0.02 -2.67 0.00 0.00 0.38 0.00 0.00 41.96 39.66 3hsy s TYR 350 CO 0.04 -0.81 -0.09 0.99 -1.52 0.00 0.00 175.55 174.17 3hsy s THR 351 N -2.68 0.76 -0.20 -3.49 2.01 -1.26 -1.42 115.64 109.36 3hsy s THR 351 Ca 0.57 -0.34 -0.05 0.00 0.31 0.00 0.00 61.69 62.19 3hsy s THR 351 Cb -0.10 -0.69 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 3hsy s THR 351 CO 0.37 0.24 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.90 3hsy s ILE 352 N 0.26 3.76 0.25 1.82 1.01 0.48 -4.81 121.20 123.97 3hsy s ILE 352 Ca -0.04 -0.37 -0.30 0.00 0.00 0.00 0.00 60.65 59.94 3hsy s ILE 352 Cb -0.09 -2.70 -0.09 0.00 0.01 0.00 0.00 42.46 39.59 3hsy s ILE 352 CO 0.01 0.43 1.04 0.20 0.00 0.00 0.00 174.94 176.61 3hsy s ASN 353 N 1.13 7.40 -0.22 3.58 0.01 0.34 -0.37 114.94 126.80 3hsy s ASN 353 Ca 0.02 2.14 -0.09 0.00 -0.71 0.00 0.00 52.86 54.22 3hsy s ASN 353 Cb -0.14 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 38.85 3hsy s ASN 353 CO 0.01 -0.04 0.13 -0.63 -1.51 0.00 0.00 177.10 175.05 3hsy s ILE 354 N -1.07 5.14 0.15 0.60 -1.09 0.28 -1.22 121.20 123.99 3hsy s ILE 354 Ca 0.44 0.10 0.11 0.00 -2.23 0.00 0.00 60.65 59.06 3hsy s ILE 354 Cb -0.30 -3.38 -0.04 0.00 -1.58 0.00 0.00 42.46 37.17 3hsy s ILE 354 CO 0.37 0.38 -0.23 -0.04 -1.23 0.00 0.00 174.94 174.19 3hsy s MET 355 N 0.89 1.55 0.06 2.79 -1.94 -0.01 -0.85 119.30 121.79 3hsy s MET 355 Ca 0.06 -1.37 0.04 0.00 -1.71 0.00 0.00 55.69 52.72 3hsy s MET 355 Cb -0.13 -1.94 -0.03 0.00 2.01 0.00 0.00 34.83 34.74 3hsy s MET 355 CO 0.03 0.44 -0.12 -1.21 -0.01 0.00 0.00 175.02 174.14 3hsy s GLU 356 N -2.32 0.75 -0.42 2.03 2.02 -0.28 -1.14 118.70 119.32 3hsy s GLU 356 Ca 0.18 -0.88 -0.24 0.00 0.02 0.00 0.00 54.97 54.04 3hsy s GLU 356 Cb -0.09 -0.69 0.02 0.00 0.10 0.00 0.00 34.13 33.47 3hsy s GLU 356 CO 0.09 0.15 0.86 -1.17 0.02 0.00 0.00 175.26 175.21 3hsy s LEU 357 N -1.63 4.09 0.00 1.80 2.96 -0.26 -0.52 118.68 125.12 3hsy s LEU 357 Ca -0.04 0.17 0.07 0.00 -0.22 0.00 0.00 54.13 54.11 3hsy s LEU 357 Cb -0.10 -3.11 0.07 0.00 0.50 0.00 0.00 46.19 43.55 3hsy s LEU 357 CO 0.02 -0.92 0.55 0.29 -1.32 0.00 0.00 176.35 174.97 3hsy n LYS 358 N 6.83 0.69 -0.12 1.98 4.76 -0.05 -4.65 118.16 127.61 3hsy n LYS 358 Ca 0.05 -3.05 -0.07 0.00 -2.87 0.00 0.00 58.31 52.37 3hsy n LYS 358 Cb 0.48 0.07 -0.01 0.00 -1.84 0.00 0.00 35.03 33.74 3hsy n LYS 358 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3hsy h THR 359 N 0.38 0.27 -0.02 -0.18 2.02 -2.00 -1.09 112.91 112.30 3hsy h THR 359 Ca -0.29 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3hsy h THR 359 Cb 1.17 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 3hsy h THR 359 CO 0.44 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.92 3hsy n ASN 360 N -5.41 0.41 0.00 4.18 3.02 -1.26 -5.01 115.26 111.18 3hsy n ASN 360 Ca 0.01 -1.24 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 3hsy n ASN 360 Cb 0.33 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 3hsy n ASN 360 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hsy n GLY 361 N 0.99 0.46 3.77 7.41 0.00 -0.42 -5.06 105.19 112.35 3hsy n GLY 361 Ca 0.20 -2.25 -0.41 0.00 0.00 0.00 0.00 46.02 43.57 3hsy n GLY 361 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hsy s PRO 362 N -0.48 4.25 0.01 1.61 0.02 -1.26 -0.87 135.00 138.28 3hsy s PRO 362 Ca 0.00 2.37 0.01 0.00 0.02 0.00 0.00 61.00 63.40 3hsy s PRO 362 Cb 0.00 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.48 3hsy s PRO 362 CO 0.00 -0.35 -0.04 1.03 -0.33 0.00 0.00 177.00 177.31 3hsy s ARG 363 N -1.75 0.30 -0.22 5.54 1.81 0.32 -4.85 118.95 120.11 3hsy s ARG 363 Ca 0.52 -0.33 -0.29 0.00 -1.72 0.00 0.00 55.73 53.91 3hsy s ARG 363 Cb -0.43 -0.17 0.01 0.00 -0.45 0.00 0.00 34.95 33.90 3hsy s ARG 363 CO 0.56 0.04 1.08 0.21 -0.68 0.00 0.00 175.30 176.51 3hsy s LYS 364 N -0.63 4.26 -0.00 3.54 2.20 -1.26 -1.13 119.74 126.71 3hsy s LYS 364 Ca -0.04 1.42 0.17 0.00 -0.36 0.00 0.00 55.97 57.15 3hsy s LYS 364 Cb -0.05 -3.66 -0.19 0.00 -1.51 0.00 0.00 37.83 32.42 3hsy s LYS 364 CO -0.00 -0.64 0.71 0.44 -0.36 0.00 0.00 175.35 175.50 3hsy n ILE 365 N 5.31 0.00 -3.13 5.43 -6.64 -0.03 -4.93 119.36 115.38 3hsy n ILE 365 Ca 0.12 -0.11 0.00 0.00 -1.77 0.00 0.00 62.75 60.99 3hsy n ILE 365 Cb 0.46 0.95 0.00 0.00 -1.44 0.00 0.00 39.64 39.61 3hsy n ILE 365 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3hsy n GLY 366 N 1.41 -1.12 3.39 3.28 0.00 -1.12 -1.01 105.19 110.03 3hsy n GLY 366 Ca 0.03 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 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 -3.00 -0.02 -0.14 1.61 -0.85 -0.32 -0.56 117.35 114.08 3hsy s TYR 367 Ca 0.00 -0.33 -0.00 0.00 -0.52 0.00 0.00 57.07 56.22 3hsy s TYR 367 Cb 0.00 0.22 0.03 0.00 0.38 0.00 0.00 41.96 42.59 3hsy s TYR 367 CO 0.00 -0.78 -0.09 -0.46 -1.52 0.00 0.00 175.55 172.70 3hsy s TRP 368 N -3.87 1.73 -0.08 -3.49 -0.00 0.50 -0.77 118.94 112.96 3hsy s TRP 368 Ca 0.09 -0.97 -0.05 0.00 -0.00 0.00 0.00 56.10 55.17 3hsy s TRP 368 Cb 0.01 -1.35 -0.04 0.00 -0.00 0.00 0.00 33.47 32.09 3hsy s TRP 368 CO -0.06 -0.58 0.12 -1.54 -0.00 0.00 0.00 176.95 174.89 3hsy s SER 369 N 1.63 6.10 0.45 5.86 1.04 -1.26 -0.39 113.70 127.12 3hsy s SER 369 Ca 0.04 0.35 0.13 0.00 0.48 0.00 0.00 55.95 56.95 3hsy s SER 369 Cb -0.13 -1.90 1.00 0.00 0.10 0.00 0.00 66.02 65.09 3hsy s SER 369 CO -0.09 0.36 2.01 -0.08 0.98 0.00 0.00 173.24 176.43 3hsy h GLU 370 N 4.70 0.09 -0.13 4.02 4.22 -1.58 0.24 114.58 126.13 3hsy h GLU 370 Ca -0.52 -0.02 -0.14 0.00 0.08 0.00 0.00 59.36 58.76 3hsy h GLU 370 Cb 1.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 3hsy h GLU 370 CO 0.60 0.20 -0.51 -0.39 -2.18 0.00 0.00 179.01 176.73 3hsy h VAL 371 N 0.09 1.34 0.00 0.32 -1.51 -1.93 -3.36 116.25 111.20 3hsy h VAL 371 Ca 0.02 -1.75 -0.32 0.00 -1.23 0.00 0.00 66.70 63.42 3hsy h VAL 371 Cb 0.24 1.79 -0.06 0.00 -2.13 0.00 0.00 31.29 31.13 3hsy h VAL 371 CO 0.01 0.53 -2.20 0.47 -1.23 0.00 0.00 177.57 175.16 3hsy n ASP 372 N -3.96 1.11 -3.04 4.19 8.00 -1.02 -5.03 116.55 116.80 3hsy n ASP 372 Ca -0.02 -0.03 -0.21 0.00 0.71 0.00 0.00 54.79 55.24 3hsy n ASP 372 Cb 0.56 0.63 0.06 0.00 -0.02 0.00 0.00 41.12 42.35 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 -2.75 -6.14 -4.05 -1.24 5.02 0.80 -5.01 118.16 104.79 3hsy n LYS 373 Ca -0.30 0.75 -0.08 0.00 -2.02 0.00 0.00 58.31 56.66 3hsy n LYS 373 Cb 1.03 -5.47 -0.10 0.00 -0.02 0.00 0.00 35.03 30.47 3hsy n LYS 373 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3hsy s MET 374 N -5.96 0.50 -0.11 1.97 -1.94 -1.26 -4.92 119.30 107.58 3hsy s MET 374 Ca 0.43 -0.96 -0.30 0.00 -1.71 0.00 0.00 55.69 53.16 3hsy s MET 374 Cb -0.19 0.11 -0.02 0.00 2.01 0.00 0.00 34.83 36.74 3hsy s MET 374 CO 0.54 -0.07 1.16 0.08 -0.01 0.00 0.00 175.02 176.72 3hsy s VAL 375 N -2.79 4.41 -0.16 -6.03 1.01 -1.26 -4.21 120.40 111.36 3hsy s VAL 375 Ca -0.03 1.71 -0.05 0.00 0.00 0.00 0.00 61.98 63.61 3hsy s VAL 375 Cb -0.00 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 3hsy s VAL 375 CO -0.06 -0.06 0.01 -0.69 0.00 0.00 0.00 175.10 174.30 3hsy s VAL 376 N 2.63 4.29 0.06 2.92 1.01 0.05 -4.96 120.40 126.40 3hsy s VAL 376 Ca 0.53 -0.22 -0.23 0.00 0.00 0.00 0.00 61.98 62.06 3hsy s VAL 376 Cb -0.22 -2.90 -0.06 0.00 0.00 0.00 0.00 36.38 33.21 3hsy s VAL 376 CO 0.17 0.49 0.68 -0.89 0.00 0.00 0.00 175.10 175.56 3hsy s THR 377 N 0.25 4.71 0.03 3.92 2.01 -1.26 -1.17 115.64 124.12 3hsy s THR 377 Ca 0.00 1.46 0.00 0.00 0.31 0.00 0.00 61.69 63.47 3hsy s THR 377 Cb -0.13 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 3hsy s THR 377 CO 0.02 0.44 0.11 -0.76 -0.69 0.00 0.00 174.62 173.74 3hsy s LEU 378 N -0.49 3.97 0.00 4.42 1.43 -0.18 -4.94 118.68 122.89 3hsy s LEU 378 Ca 0.34 0.13 0.27 0.00 -1.03 0.00 0.00 54.13 53.85 3hsy s LEU 378 Cb -0.20 -2.46 1.63 0.00 0.03 0.00 0.00 46.19 45.19 3hsy s LEU 378 CO 0.21 0.23 1.97 0.35 0.23 0.00 0.00 176.35 179.34