#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hg0 s ASP 2 N 0.00 5.55 0.00 0.00 -1.08 -1.26 -4.69 116.67 115.19 1hg0 s ASP 2 Ca 0.00 -1.25 0.00 0.00 -0.52 0.00 0.00 52.55 50.78 1hg0 s ASP 2 Cb 0.00 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 1hg0 s ASP 2 CO 0.00 -2.43 0.00 2.29 0.52 0.00 0.00 175.17 175.55 1hg0 n LYS 3 N 8.67 0.00 -1.53 4.34 2.85 -1.26 -5.15 118.16 126.08 1hg0 n LYS 3 Ca 0.41 0.00 -0.52 0.00 -1.05 0.00 0.00 58.31 57.15 1hg0 n LYS 3 Cb 0.48 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.80 1hg0 n LYS 3 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1hg0 n LEU 4 N 0.00 0.63 -4.88 -5.58 4.32 -1.26 -5.00 117.00 105.22 1hg0 n LEU 4 Ca 0.00 1.14 -0.30 0.00 -0.02 0.00 0.00 56.01 56.83 1hg0 n LEU 4 Cb 0.00 -1.08 0.01 0.00 -1.62 0.00 0.00 43.42 40.73 1hg0 n LEU 4 CO 0.00 -1.74 0.70 -2.16 -1.22 0.00 0.00 177.39 172.96 1hg0 s PRO 5 N -0.31 3.49 -0.34 3.23 0.04 -1.26 -4.71 135.00 135.14 1hg0 s PRO 5 Ca 0.77 0.65 -0.14 0.00 0.04 0.00 0.00 61.00 62.33 1hg0 s PRO 5 Cb -0.99 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 31.43 1hg0 s PRO 5 CO 0.54 -0.60 0.28 -0.80 0.04 0.00 0.00 177.00 176.46 1hg0 s ASN 6 N -4.20 6.10 -0.05 6.66 -0.87 -1.26 -1.01 114.94 120.30 1hg0 s ASN 6 Ca 0.55 -0.35 0.06 0.00 -1.57 0.00 0.00 52.86 51.55 1hg0 s ASN 6 Cb -0.11 -2.16 -0.01 0.00 -0.02 0.00 0.00 41.25 38.95 1hg0 s ASN 6 CO 0.53 -0.27 -0.24 -0.63 -2.57 0.00 0.00 177.10 173.92 1hg0 s ILE 7 N 1.82 1.97 -0.16 0.60 -1.09 -0.72 -0.63 121.20 123.00 1hg0 s ILE 7 Ca 0.08 -1.02 -0.06 0.00 -2.23 0.00 0.00 60.65 57.42 1hg0 s ILE 7 Cb -0.17 -1.66 -0.04 0.00 -1.58 0.00 0.00 42.46 39.01 1hg0 s ILE 7 CO 0.11 0.55 0.03 -0.69 -1.23 0.00 0.00 174.94 173.71 1hg0 s VAL 8 N -0.16 4.55 -0.36 2.92 1.01 -1.02 -1.59 120.40 125.75 1hg0 s VAL 8 Ca -0.03 -0.13 -0.09 0.00 0.00 0.00 0.00 61.98 61.74 1hg0 s VAL 8 Cb -0.13 -3.01 0.04 0.00 0.00 0.00 0.00 36.38 33.27 1hg0 s VAL 8 CO 0.03 0.50 0.17 -0.63 0.00 0.00 0.00 175.10 175.17 1hg0 s ILE 9 N 0.07 4.16 -0.35 2.22 1.01 0.46 -1.01 121.20 127.75 1hg0 s ILE 9 Ca 0.04 -1.06 -0.18 0.00 0.00 0.00 0.00 60.65 59.44 1hg0 s ILE 9 Cb -0.13 -3.37 -0.00 0.00 0.01 0.00 0.00 42.46 38.97 1hg0 s ILE 9 CO 0.01 -0.25 0.52 -0.76 0.00 0.00 0.00 174.94 174.47 1hg0 s LEU 10 N 1.47 4.34 -0.14 2.97 1.43 0.11 -1.29 118.68 127.56 1hg0 s LEU 10 Ca 0.00 -0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.93 1hg0 s LEU 10 Cb -0.20 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.37 1hg0 s LEU 10 CO 0.04 -0.49 0.38 0.00 0.23 0.00 0.00 176.35 176.51 1hg0 s ALA 11 N 2.42 3.54 -0.06 4.21 0.00 -0.19 -1.44 121.76 130.24 1hg0 s ALA 11 Ca 0.19 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.84 1hg0 s ALA 11 Cb -0.15 -2.51 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 1hg0 s ALA 11 CO 0.13 0.03 0.09 0.25 0.00 0.00 0.00 175.76 176.27 1hg0 n THR 12 N 3.66 0.00 0.00 0.00 -2.24 -1.00 -0.99 114.28 113.71 1hg0 n THR 12 Ca -0.10 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1hg0 n THR 12 Cb 0.52 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 1hg0 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hg0 n GLY 13 N 1.80 0.44 0.00 3.38 0.00 -1.23 -0.75 105.19 108.82 1hg0 n GLY 13 Ca -0.00 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1hg0 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hg0 n GLY 14 N 0.00 1.72 0.37 -0.02 0.00 -1.00 -3.72 105.19 102.53 1hg0 n GLY 14 Ca 0.00 -1.93 0.19 0.00 0.00 0.00 0.00 46.02 44.28 1hg0 n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hg0 h THR 15 N 0.00 0.76 0.00 2.61 2.02 -1.85 0.34 112.91 116.80 1hg0 h THR 15 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1hg0 h THR 15 Cb 0.00 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1hg0 h THR 15 CO 0.00 0.00 0.09 -0.29 0.37 0.00 0.00 175.52 175.69 1hg0 h ILE 16 N 0.00 0.00 -0.03 3.11 2.10 -1.80 1.18 117.51 122.07 1hg0 h ILE 16 Ca 0.22 0.00 0.00 0.00 1.08 0.00 0.00 64.86 66.16 1hg0 h ILE 16 Cb 0.88 0.90 0.00 0.00 -1.09 0.00 0.00 36.82 37.50 1hg0 h ILE 16 CO -0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.07 1hg0 n ALA 17 N -2.02 2.28 -2.32 0.18 0.00 0.11 -4.48 120.51 114.27 1hg0 n ALA 17 Ca -0.03 -2.33 -0.30 0.00 0.00 0.00 0.00 53.44 50.78 1hg0 n ALA 17 Cb 0.16 -0.35 -0.04 0.00 0.00 0.00 0.00 19.45 19.22 1hg0 n ALA 17 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1hg0 s GLY 18 N -2.49 2.03 0.01 0.00 0.00 0.41 -0.61 107.32 106.67 1hg0 s GLY 18 Ca 0.28 -0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.72 1hg0 s GLY 18 CO 0.03 -0.13 -0.03 -0.56 0.00 0.00 0.00 173.10 172.41 1hg0 s SER 19 N -2.90 0.34 0.41 1.64 0.01 -0.97 -1.42 113.70 110.81 1hg0 s SER 19 Ca 0.49 -0.20 0.04 0.00 1.31 0.00 0.00 55.95 57.58 1hg0 s SER 19 Cb -0.11 0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.09 1hg0 s SER 19 CO 0.27 -0.07 0.07 0.00 0.41 0.00 0.00 173.24 173.92 1hg0 s ALA 20 N -0.52 3.08 0.03 1.44 0.00 -1.26 -2.04 121.76 122.49 1hg0 s ALA 20 Ca -0.04 -1.38 -0.29 0.00 0.00 0.00 0.00 51.96 50.25 1hg0 s ALA 20 Cb -0.04 0.49 -0.16 0.00 0.00 0.00 0.00 23.12 23.41 1hg0 s ALA 20 CO -0.00 -0.23 1.27 0.00 0.00 0.00 0.00 175.76 176.79 1hg0 h ALA 21 N 1.77 -1.12 -1.14 0.00 0.00 -1.94 -3.47 119.26 113.37 1hg0 h ALA 21 Ca -0.40 -0.23 -0.59 0.00 0.00 0.00 0.00 54.91 53.69 1hg0 h ALA 21 Cb 1.27 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 19.38 1hg0 h ALA 21 CO 0.67 -1.04 -0.46 0.95 0.00 0.00 0.00 179.25 179.37 1hg0 s THR 22 N -5.02 1.95 -0.56 0.00 -4.23 -1.26 -5.02 115.64 101.50 1hg0 s THR 22 Ca -0.15 -1.71 0.26 0.00 -1.18 0.00 0.00 61.69 58.90 1hg0 s THR 22 Cb 0.02 -2.66 0.29 0.00 1.34 0.00 0.00 72.50 71.49 1hg0 s THR 22 CO 0.45 0.00 1.76 1.23 -0.54 0.00 0.00 174.62 177.52 1hg0 h GLY 23 N 1.27 0.00 2.00 3.99 0.00 -1.89 -2.93 103.07 105.51 1hg0 h GLY 23 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1hg0 h GLY 23 CO 0.68 0.00 0.00 2.41 0.00 0.00 0.00 176.54 179.63 1hg0 n THR 24 N -2.40 0.70 -3.02 4.70 -1.04 -1.26 -0.85 114.28 111.11 1hg0 n THR 24 Ca 0.04 0.05 -0.41 0.00 -2.04 0.00 0.00 64.05 61.68 1hg0 n THR 24 Cb 0.36 -0.90 -0.06 0.00 -1.82 0.00 0.00 70.33 67.92 1hg0 n THR 24 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1hg0 s GLN 25 N -3.18 4.10 0.00 -2.82 -0.21 -1.11 -4.86 119.66 111.58 1hg0 s GLN 25 Ca 0.07 0.66 0.01 0.00 0.02 0.00 0.00 55.36 56.13 1hg0 s GLN 25 Cb 0.11 -3.66 0.01 0.00 1.00 0.00 0.00 33.01 30.46 1hg0 s GLN 25 CO 0.45 -0.49 0.48 0.25 -2.12 0.00 0.00 175.29 173.87 1hg0 n THR 26 N 5.27 0.00 -3.82 -0.19 -2.24 -1.26 -4.52 114.28 107.52 1hg0 n THR 26 Ca 0.02 -0.50 -0.12 0.00 -2.27 0.00 0.00 64.05 61.18 1hg0 n THR 26 Cb 0.48 1.02 -0.10 0.00 -2.10 0.00 0.00 70.33 69.64 1hg0 n THR 26 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1hg0 s THR 27 N -0.22 0.06 0.00 4.28 -4.23 -1.26 -4.67 115.64 109.60 1hg0 s THR 27 Ca 0.01 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 1hg0 s THR 27 Cb 0.01 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.38 1hg0 s THR 27 CO 0.02 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1hg0 n GLY 28 N 1.73 0.70 2.07 3.99 0.00 -1.26 -5.07 105.19 107.35 1hg0 n GLY 28 Ca -0.20 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.04 1hg0 n GLY 28 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1hg0 n TYR 29 N -2.73 -2.76 -4.07 1.61 0.18 -1.26 -4.93 117.16 103.20 1hg0 n TYR 29 Ca 0.00 -1.07 -0.33 0.00 1.88 0.00 0.00 57.90 58.38 1hg0 n TYR 29 Cb 0.09 -0.32 -0.15 0.00 -0.38 0.00 0.00 39.34 38.58 1hg0 n TYR 29 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 1hg0 s LYS 30 N -3.51 2.66 0.64 -3.48 2.20 -0.87 -4.93 119.74 112.45 1hg0 s LYS 30 Ca 0.33 -1.06 -0.15 0.00 -0.36 0.00 0.00 55.97 54.72 1hg0 s LYS 30 Cb -0.02 -2.77 -0.01 0.00 -1.51 0.00 0.00 37.83 33.52 1hg0 s LYS 30 CO 0.21 -0.39 1.10 0.00 -0.36 0.00 0.00 175.35 175.91 1hg0 s ALA 31 N 1.22 2.54 -1.31 3.13 0.00 -1.26 -2.28 121.76 123.80 1hg0 s ALA 31 Ca -0.01 0.51 -0.02 0.00 0.00 0.00 0.00 51.96 52.43 1hg0 s ALA 31 Cb -0.16 -3.30 0.01 0.00 0.00 0.00 0.00 23.12 19.67 1hg0 s ALA 31 CO -0.08 -1.16 0.86 0.41 0.00 0.00 0.00 175.76 175.79 1hg0 n GLY 32 N -0.64 -0.36 0.06 0.00 0.00 -0.81 -4.53 105.19 98.91 1hg0 n GLY 32 Ca 0.10 0.14 -0.04 0.00 0.00 0.00 0.00 46.02 46.21 1hg0 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hg0 n ALA 33 N -4.34 1.82 -2.85 4.61 0.00 -0.07 -4.63 120.51 115.05 1hg0 n ALA 33 Ca -0.23 -0.85 -0.32 0.00 0.00 0.00 0.00 53.44 52.03 1hg0 n ALA 33 Cb 0.65 -0.15 -0.04 0.00 0.00 0.00 0.00 19.45 19.90 1hg0 n ALA 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1hg0 s LEU 34 N -4.89 4.35 0.65 0.00 1.43 0.22 -5.02 118.68 115.42 1hg0 s LEU 34 Ca -0.07 0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 53.31 1hg0 s LEU 34 Cb 0.05 -2.90 -0.02 0.00 0.03 0.00 0.00 46.19 43.36 1hg0 s LEU 34 CO 0.61 0.18 1.04 -0.83 0.23 0.00 0.00 176.35 177.59 1hg0 s GLY 35 N -2.25 1.64 0.16 -3.19 0.00 -1.26 -4.91 107.32 97.51 1hg0 s GLY 35 Ca 0.33 -0.22 -0.14 0.00 0.00 0.00 0.00 44.72 44.69 1hg0 s GLY 35 CO 0.24 0.08 1.77 -0.24 0.00 0.00 0.00 173.10 174.95 1hg0 h VAL 36 N -0.42 1.18 0.00 1.40 3.04 -1.97 -2.28 116.25 117.20 1hg0 h VAL 36 Ca -0.45 -0.46 -0.03 0.00 -1.01 0.00 0.00 66.70 64.75 1hg0 h VAL 36 Cb 1.22 0.53 -0.00 0.00 -2.01 0.00 0.00 31.29 31.02 1hg0 h VAL 36 CO 0.63 0.19 -0.15 0.44 -1.01 0.00 0.00 177.57 177.67 1hg0 h ASP 37 N 0.70 0.00 -0.26 3.17 3.32 -1.94 -1.38 116.42 120.03 1hg0 h ASP 37 Ca 0.18 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.11 1hg0 h ASP 37 Cb 0.05 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1hg0 h ASP 37 CO -0.03 0.15 -0.26 0.74 -1.72 0.00 0.00 179.24 178.12 1hg0 h THR 38 N 0.00 1.27 -0.31 0.35 2.02 -1.81 -0.46 112.91 113.98 1hg0 h THR 38 Ca -0.00 -1.38 -0.12 0.00 0.77 0.00 0.00 66.41 65.68 1hg0 h THR 38 Cb 0.27 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 1hg0 h THR 38 CO 0.02 0.46 -0.31 -0.07 0.37 0.00 0.00 175.52 175.99 1hg0 h LEU 39 N 0.65 0.67 -0.11 2.58 3.38 -0.88 -1.92 115.31 119.69 1hg0 h LEU 39 Ca 0.08 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1hg0 h LEU 39 Cb 0.77 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 1hg0 h LEU 39 CO 0.06 0.94 -0.14 0.40 0.09 0.00 0.00 178.44 179.79 1hg0 h ILE 40 N 0.56 1.37 0.00 1.22 2.04 -1.09 -2.98 117.51 118.63 1hg0 h ILE 40 Ca 0.07 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.57 1hg0 h ILE 40 Cb 0.80 2.02 -0.00 0.00 -0.74 0.00 0.00 36.82 38.90 1hg0 h ILE 40 CO 0.07 0.39 -0.04 0.78 0.00 0.00 0.00 178.15 179.35 1hg0 h ASN 41 N -0.14 0.00 0.44 1.72 2.35 -1.08 -2.32 115.58 116.56 1hg0 h ASN 41 Ca 0.01 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.63 1hg0 h ASN 41 Cb 0.68 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 1hg0 h ASN 41 CO 0.03 0.04 -0.59 0.00 -1.65 0.00 0.00 177.43 175.26 1hg0 h ALA 42 N 1.96 0.93 -2.19 -0.83 0.00 -1.20 -3.32 119.26 114.61 1hg0 h ALA 42 Ca -0.00 -0.53 -0.57 0.00 0.00 0.00 0.00 54.91 53.81 1hg0 h ALA 42 Cb 0.39 -0.09 -0.41 0.00 0.00 0.00 0.00 17.79 17.68 1hg0 h ALA 42 CO 0.00 0.72 -0.78 0.28 0.00 0.00 0.00 179.25 179.48 1hg0 n VAL 43 N -3.87 2.03 -0.22 0.00 0.31 -0.88 -4.94 118.33 110.76 1hg0 n VAL 43 Ca -0.02 -5.22 0.31 0.00 -0.01 0.00 0.00 64.34 59.41 1hg0 n VAL 43 Cb 0.60 -1.29 0.72 0.00 -0.91 0.00 0.00 33.84 32.96 1hg0 n VAL 43 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1hg0 h PRO 44 N 3.23 0.00 -0.44 5.55 0.13 -1.63 0.12 132.00 138.96 1hg0 h PRO 44 Ca 0.13 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.39 1hg0 h PRO 44 Cb 0.65 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.76 1hg0 h PRO 44 CO 0.73 0.00 0.37 0.93 -0.23 0.00 0.00 178.00 179.80 1hg0 h GLU 45 N 0.00 0.00 -0.27 0.86 3.07 -1.92 0.17 114.58 116.50 1hg0 h GLU 45 Ca 0.47 0.00 0.07 0.00 -0.50 0.00 0.00 59.36 59.41 1hg0 h GLU 45 Cb 2.03 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.93 1hg0 h GLU 45 CO -0.00 0.00 0.19 -0.24 -1.40 0.00 0.00 179.01 177.56 1hg0 h VAL 46 N 0.00 0.88 0.00 3.13 3.04 -1.31 -0.01 116.25 121.98 1hg0 h VAL 46 Ca 0.21 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.89 1hg0 h VAL 46 Cb 0.95 0.85 0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1hg0 h VAL 46 CO -0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 176.85 1hg0 n LYS 47 N -4.46 0.64 0.00 4.17 5.02 0.61 -1.85 118.16 122.28 1hg0 n LYS 47 Ca 0.03 0.01 0.09 0.00 -2.02 0.00 0.00 58.31 56.43 1hg0 n LYS 47 Cb 0.33 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.85 1hg0 n LYS 47 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1hg0 n LYS 48 N -1.05 1.55 -0.03 1.97 2.85 -0.02 -4.23 118.16 119.20 1hg0 n LYS 48 Ca 0.16 -0.96 0.04 0.00 -1.05 0.00 0.00 58.31 56.49 1hg0 n LYS 48 Cb 0.09 -1.34 -0.15 0.00 -0.65 0.00 0.00 35.03 32.98 1hg0 n LYS 48 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1hg0 n LEU 49 N 0.05 0.00 -3.77 -5.58 4.77 -0.77 -5.05 117.00 106.65 1hg0 n LEU 49 Ca 0.08 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.05 1hg0 n LEU 49 Cb 0.39 0.14 -0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1hg0 n LEU 49 CO 0.22 0.14 0.89 0.00 -1.33 0.00 0.00 177.39 177.31 1hg0 s ALA 50 N -3.08 -1.92 -0.58 -1.18 0.00 -1.13 -4.48 121.76 109.40 1hg0 s ALA 50 Ca -0.08 0.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.87 1hg0 s ALA 50 Cb 0.10 0.61 0.09 0.00 0.00 0.00 0.00 23.12 23.92 1hg0 s ALA 50 CO 0.79 -1.07 0.73 -0.80 0.00 0.00 0.00 175.76 175.42 1hg0 s ASN 51 N -3.16 6.19 0.01 0.00 0.02 -0.18 -4.43 114.94 113.39 1hg0 s ASN 51 Ca 0.17 -1.23 -0.08 0.00 -1.02 0.00 0.00 52.86 50.70 1hg0 s ASN 51 Cb 0.00 -2.32 -0.05 0.00 0.02 0.00 0.00 41.25 38.90 1hg0 s ASN 51 CO 0.01 -1.12 0.30 0.68 0.02 0.00 0.00 177.10 176.99 1hg0 s VAL 52 N 2.92 5.24 -0.07 1.60 -7.23 -1.26 -1.75 120.40 119.86 1hg0 s VAL 52 Ca 0.14 0.31 0.03 0.00 -1.81 0.00 0.00 61.98 60.66 1hg0 s VAL 52 Cb -0.22 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.14 1hg0 s VAL 52 CO 0.08 0.39 -0.17 -0.54 -0.31 0.00 0.00 175.10 174.56 1hg0 s LYS 53 N -1.65 2.04 -0.05 4.82 1.02 -0.62 -4.99 119.74 120.31 1hg0 s LYS 53 Ca 0.27 -0.59 -0.04 0.00 0.02 0.00 0.00 55.97 55.63 1hg0 s LYS 53 Cb -0.14 -1.66 -0.04 0.00 -0.52 0.00 0.00 37.83 35.47 1hg0 s LYS 53 CO 0.15 0.14 0.15 0.20 -0.92 0.00 0.00 175.35 175.07 1hg0 s GLY 54 N 0.37 2.14 -0.03 -3.33 0.00 -1.26 -0.41 107.32 104.80 1hg0 s GLY 54 Ca -0.12 -0.74 -0.01 0.00 0.00 0.00 0.00 44.72 43.86 1hg0 s GLY 54 CO 0.04 -0.57 0.04 1.85 0.00 0.00 0.00 173.10 174.47 1hg0 s GLU 55 N -1.57 -0.02 -0.73 2.90 2.12 -0.41 -4.93 118.70 116.05 1hg0 s GLU 55 Ca 0.22 0.26 -0.20 0.00 0.36 0.00 0.00 54.97 55.61 1hg0 s GLU 55 Cb -0.12 -0.39 0.10 0.00 0.26 0.00 0.00 34.13 33.98 1hg0 s GLU 55 CO 0.13 -0.24 0.96 -1.14 -0.54 0.00 0.00 175.26 174.43 1hg0 s GLN 56 N 1.56 3.26 0.11 4.30 2.00 -1.26 -1.03 119.66 128.60 1hg0 s GLN 56 Ca -0.03 -1.25 -0.05 0.00 -2.00 0.00 0.00 55.36 52.03 1hg0 s GLN 56 Cb -0.13 -4.46 -0.16 0.00 0.80 0.00 0.00 33.01 29.07 1hg0 s GLN 56 CO -0.03 -1.74 1.24 0.35 -0.50 0.00 0.00 175.29 174.61 1hg0 h PHE 57 N 9.23 0.61 -2.13 1.67 3.57 -1.42 -3.48 116.94 124.99 1hg0 h PHE 57 Ca -0.14 -0.37 0.30 0.00 3.53 0.00 0.00 57.97 61.29 1hg0 h PHE 57 Cb 1.06 -0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.68 1hg0 h PHE 57 CO 1.01 1.21 0.82 -1.54 -2.23 0.00 0.00 178.31 177.58 1hg0 s SER 58 N -7.13 -0.01 -0.47 0.41 1.04 -0.67 -4.99 113.70 101.89 1hg0 s SER 58 Ca -0.06 -0.30 0.06 0.00 0.48 0.00 0.00 55.95 56.13 1hg0 s SER 58 Cb 0.08 0.23 0.18 0.00 0.10 0.00 0.00 66.02 66.61 1hg0 s SER 58 CO 0.88 -0.46 0.59 0.21 0.98 0.00 0.00 173.24 175.44 1hg0 s ASN 59 N -3.60 -0.50 0.08 7.02 3.84 -0.98 -3.40 114.94 117.40 1hg0 s ASN 59 Ca 0.25 -2.02 -0.00 0.00 0.21 0.00 0.00 52.86 51.30 1hg0 s ASN 59 Cb -0.00 1.18 -0.04 0.00 -0.55 0.00 0.00 41.25 41.84 1hg0 s ASN 59 CO 0.00 -0.11 -0.02 0.00 -2.79 0.00 0.00 177.10 174.18 1hg0 s MET 60 N 0.76 0.74 0.20 0.43 0.23 0.07 -4.77 119.30 116.97 1hg0 s MET 60 Ca 0.29 -1.30 -0.30 0.00 -1.03 0.00 0.00 55.69 53.35 1hg0 s MET 60 Cb -0.00 0.08 -0.08 0.00 -1.53 0.00 0.00 34.83 33.29 1hg0 s MET 60 CO -0.09 -0.11 1.21 0.00 -2.03 0.00 0.00 175.02 174.00 1hg0 s ALA 61 N -3.85 3.45 0.63 3.16 0.00 -1.26 -2.39 121.76 121.51 1hg0 s ALA 61 Ca 0.12 0.98 0.37 0.00 0.00 0.00 0.00 51.96 53.43 1hg0 s ALA 61 Cb 0.07 -3.42 2.10 0.00 0.00 0.00 0.00 23.12 21.87 1hg0 s ALA 61 CO -0.06 -0.38 2.28 0.66 0.00 0.00 0.00 175.76 178.25 1hg0 h SER 62 N 5.06 0.00 0.37 0.00 4.64 -1.93 -0.79 113.55 120.90 1hg0 h SER 62 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1hg0 h SER 62 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1hg0 h SER 62 CO 0.74 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.75 1hg0 h GLU 63 N 0.00 0.00 -0.32 4.77 9.09 -1.94 -0.72 114.58 125.45 1hg0 h GLU 63 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 1hg0 h GLU 63 Cb 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1hg0 h GLU 63 CO -0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 1hg0 n ASN 64 N -2.53 3.21 -4.75 3.06 3.02 -0.30 -4.96 115.26 112.01 1hg0 n ASN 64 Ca -0.00 -1.93 -0.41 0.00 -0.03 0.00 0.00 54.58 52.21 1hg0 n ASN 64 Cb 0.14 -0.21 -0.03 0.00 -0.61 0.00 0.00 39.78 39.08 1hg0 n ASN 64 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1hg0 s MET 65 N -1.38 4.34 0.25 3.52 1.75 -0.28 -5.01 119.30 122.49 1hg0 s MET 65 Ca 0.33 2.18 0.10 0.00 -1.25 0.00 0.00 55.69 57.05 1hg0 s MET 65 Cb 0.20 -3.13 -0.05 0.00 2.84 0.00 0.00 34.83 34.69 1hg0 s MET 65 CO 0.28 -0.28 -0.16 0.95 -0.65 0.00 0.00 175.02 175.15 1hg0 s THR 66 N -0.30 2.09 0.23 10.11 -4.23 -1.26 -5.03 115.64 117.26 1hg0 s THR 66 Ca 0.55 -2.30 -0.06 0.00 -1.18 0.00 0.00 61.69 58.70 1hg0 s THR 66 Cb -0.39 -2.19 0.20 0.00 1.34 0.00 0.00 72.50 71.45 1hg0 s THR 66 CO 0.44 -0.48 1.73 1.23 -0.54 0.00 0.00 174.62 177.00 1hg0 h GLY 67 N 2.40 1.04 1.73 3.99 0.00 -1.98 0.12 103.07 110.36 1hg0 h GLY 67 Ca -0.39 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 1hg0 h GLY 67 CO 0.62 -0.08 0.00 1.29 0.00 0.00 0.00 176.54 178.36 1hg0 h ASP 68 N 0.41 0.32 0.03 0.19 3.04 -1.96 0.23 116.42 118.67 1hg0 h ASP 68 Ca 0.38 -0.04 -0.18 0.00 -3.24 0.00 0.00 57.03 53.94 1hg0 h ASP 68 Cb 0.56 -0.08 0.02 0.00 -1.04 0.00 0.00 39.33 38.78 1hg0 h ASP 68 CO -0.39 0.38 -0.74 0.58 -2.04 0.00 0.00 179.24 177.03 1hg0 h VAL 69 N 0.34 1.41 -0.78 4.15 2.07 -1.50 -2.70 116.25 119.24 1hg0 h VAL 69 Ca 0.08 -2.19 -0.00 0.00 0.82 0.00 0.00 66.70 65.41 1hg0 h VAL 69 Cb 0.23 2.65 -0.04 0.00 -1.52 0.00 0.00 31.29 32.61 1hg0 h VAL 69 CO 0.00 0.64 0.47 0.58 0.02 0.00 0.00 177.57 179.29 1hg0 h VAL 70 N -0.04 1.22 -0.17 2.57 2.07 -0.52 0.02 116.25 121.39 1hg0 h VAL 70 Ca -0.10 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 66.95 1hg0 h VAL 70 Cb 1.45 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1hg0 h VAL 70 CO 0.14 0.23 0.08 0.25 0.02 0.00 0.00 177.57 178.30 1hg0 h LEU 71 N 1.08 0.13 -1.08 2.57 5.85 -0.54 -0.76 115.31 122.56 1hg0 h LEU 71 Ca 0.28 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 1hg0 h LEU 71 Cb -0.04 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1hg0 h LEU 71 CO -0.05 0.10 0.05 0.11 -0.34 0.00 0.00 178.44 178.31 1hg0 h LYS 72 N 0.18 0.71 -0.77 1.25 1.57 -1.07 -1.93 116.57 116.50 1hg0 h LYS 72 Ca 0.07 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 1hg0 h LYS 72 Cb 0.02 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 1hg0 h LYS 72 CO -0.05 0.69 0.37 1.25 -0.57 0.00 0.00 179.45 181.14 1hg0 h LEU 73 N 0.68 1.02 -0.26 2.94 5.85 -0.41 -0.10 115.31 125.02 1hg0 h LEU 73 Ca 0.14 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 1hg0 h LEU 73 Cb 0.34 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1hg0 h LEU 73 CO 0.01 0.87 0.10 -1.28 -0.34 0.00 0.00 178.44 177.80 1hg0 h SER 74 N 1.09 0.36 -0.69 1.25 0.87 -0.70 -1.29 113.55 114.45 1hg0 h SER 74 Ca 0.27 -0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.62 1hg0 h SER 74 Cb 0.12 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 61.96 1hg0 h SER 74 CO -0.03 0.43 0.30 1.56 -0.53 0.00 0.00 176.83 178.55 1hg0 h GLN 75 N 0.27 1.01 -0.67 2.24 4.20 -1.07 -1.37 115.11 119.72 1hg0 h GLN 75 Ca 0.09 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 1hg0 h GLN 75 Cb 0.18 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1hg0 h GLN 75 CO -0.01 0.82 0.14 -0.09 -0.67 0.00 0.00 178.83 179.03 1hg0 h ARG 76 N 0.97 1.09 -0.31 1.46 9.65 -0.86 -2.19 114.38 124.17 1hg0 h ARG 76 Ca 0.23 -0.27 -0.09 0.00 -1.10 0.00 0.00 59.98 58.75 1hg0 h ARG 76 Cb 0.17 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.60 1hg0 h ARG 76 CO -0.02 0.98 -0.19 0.28 2.80 0.00 0.00 179.97 183.81 1hg0 h VAL 77 N 1.01 1.26 -0.56 0.20 2.07 -0.96 -1.63 116.25 117.63 1hg0 h VAL 77 Ca 0.21 -1.20 -0.08 0.00 0.82 0.00 0.00 66.70 66.44 1hg0 h VAL 77 Cb 0.40 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 1hg0 h VAL 77 CO 0.01 0.39 0.04 0.78 0.02 0.00 0.00 177.57 178.81 1hg0 h ASN 78 N 0.51 0.91 -0.26 0.57 2.35 -0.90 -0.71 115.58 118.05 1hg0 h ASN 78 Ca 0.08 -0.22 -0.07 0.00 -0.55 0.00 0.00 56.30 55.54 1hg0 h ASN 78 Cb 0.62 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 1hg0 h ASN 78 CO 0.04 0.94 -0.12 -0.33 -1.65 0.00 0.00 177.43 176.31 1hg0 h GLU 79 N 0.88 0.54 -0.25 0.81 5.08 -1.14 -2.83 114.58 117.66 1hg0 h GLU 79 Ca 0.17 -0.23 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1hg0 h GLU 79 Cb 0.46 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 1hg0 h GLU 79 CO 0.02 0.79 0.15 1.25 -1.00 0.00 0.00 179.01 180.22 1hg0 h LEU 80 N 0.26 0.24 -0.43 1.33 5.85 -1.11 -2.59 115.31 118.85 1hg0 h LEU 80 Ca 0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1hg0 h LEU 80 Cb 0.63 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1hg0 h LEU 80 CO 0.04 0.18 0.00 0.18 -0.34 0.00 0.00 178.44 178.50 1hg0 n LEU 81 N -4.94 0.50 0.23 2.25 4.77 -0.29 -2.57 117.00 116.95 1hg0 n LEU 81 Ca -0.02 0.61 0.13 0.00 -0.03 0.00 0.00 56.01 56.70 1hg0 n LEU 81 Cb 0.04 -0.53 0.29 0.00 -2.33 0.00 0.00 43.42 40.90 1hg0 n LEU 81 CO 0.33 -0.43 0.85 0.00 -1.33 0.00 0.00 177.39 176.81 1hg0 h ALA 82 N 2.38 1.00 -2.59 -1.18 0.00 -1.20 -3.45 119.26 114.21 1hg0 h ALA 82 Ca 0.00 -0.01 -0.49 0.00 0.00 0.00 0.00 54.91 54.41 1hg0 h ALA 82 Cb 0.38 -0.00 0.04 0.00 0.00 0.00 0.00 17.79 18.20 1hg0 h ALA 82 CO 0.00 0.01 0.45 1.03 0.00 0.00 0.00 179.25 180.73 1hg0 s ARG 83 N -3.32 4.04 0.31 0.00 0.52 -1.06 -4.94 118.95 114.50 1hg0 s ARG 83 Ca 0.06 1.63 0.26 0.00 -0.52 0.00 0.00 55.73 57.16 1hg0 s ARG 83 Cb 0.06 -2.53 0.82 0.00 0.52 0.00 0.00 34.95 33.82 1hg0 s ARG 83 CO 0.64 -0.27 1.75 -0.44 0.02 0.00 0.00 175.30 177.00 1hg0 h ASP 84 N 2.41 0.00 -0.61 0.23 3.32 -1.89 -3.18 116.42 116.70 1hg0 h ASP 84 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1hg0 h ASP 84 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1hg0 h ASP 84 CO 0.62 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.24 1hg0 n ASP 85 N -2.52 4.42 -4.01 6.45 5.75 -1.26 -4.81 116.55 120.57 1hg0 n ASP 85 Ca 0.04 -2.40 -0.30 0.00 -0.01 0.00 0.00 54.79 52.12 1hg0 n ASP 85 Cb 0.39 -0.56 -0.16 0.00 -1.03 0.00 0.00 41.12 39.76 1hg0 n ASP 85 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1hg0 s VAL 86 N -1.81 1.55 -0.14 2.12 1.01 -1.20 -4.72 120.40 117.21 1hg0 s VAL 86 Ca 0.47 -0.70 0.21 0.00 0.00 0.00 0.00 61.98 61.96 1hg0 s VAL 86 Cb 0.30 -1.50 -0.16 0.00 0.00 0.00 0.00 36.38 35.02 1hg0 s VAL 86 CO 0.23 0.38 0.72 0.47 0.00 0.00 0.00 175.10 176.91 1hg0 n ASP 87 N 4.76 0.50 -3.62 3.32 8.00 0.20 -4.85 116.55 124.86 1hg0 n ASP 87 Ca -0.16 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.55 1hg0 n ASP 87 Cb 0.49 0.94 -0.01 0.00 -0.02 0.00 0.00 41.12 42.53 1hg0 n ASP 87 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1hg0 s GLY 88 N -4.61 -0.39 -0.00 0.44 0.00 -1.15 -4.09 107.32 97.51 1hg0 s GLY 88 Ca -0.04 0.80 0.03 0.00 0.00 0.00 0.00 44.72 45.51 1hg0 s GLY 88 CO 0.84 0.17 -0.11 0.14 0.00 0.00 0.00 173.10 174.14 1hg0 s VAL 89 N -2.47 0.85 -0.10 1.40 1.01 -0.01 -2.44 120.40 118.64 1hg0 s VAL 89 Ca 0.13 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1hg0 s VAL 89 Cb 0.04 -0.72 -0.00 0.00 0.00 0.00 0.00 36.38 35.69 1hg0 s VAL 89 CO -0.04 0.20 -0.21 -0.69 0.00 0.00 0.00 175.10 174.36 1hg0 s VAL 90 N -0.32 2.30 -0.21 2.92 1.01 -0.18 -0.81 120.40 125.11 1hg0 s VAL 90 Ca 0.04 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1hg0 s VAL 90 Cb -0.04 -1.90 0.04 0.00 0.00 0.00 0.00 36.38 34.47 1hg0 s VAL 90 CO -0.00 0.55 -0.16 -0.63 0.00 0.00 0.00 175.10 174.86 1hg0 s ILE 91 N 0.28 2.08 0.17 2.22 1.01 0.60 0.04 121.20 127.60 1hg0 s ILE 91 Ca -0.15 -1.24 -0.30 0.00 0.00 0.00 0.00 60.65 58.96 1hg0 s ILE 91 Cb -0.17 -2.03 -0.07 0.00 0.01 0.00 0.00 42.46 40.20 1hg0 s ILE 91 CO 0.08 0.28 0.94 0.42 0.00 0.00 0.00 174.94 176.65 1hg0 s THR 92 N 1.22 4.31 0.06 2.92 -4.23 -0.52 -0.83 115.64 118.57 1hg0 s THR 92 Ca -0.01 2.05 -0.18 0.00 -1.18 0.00 0.00 61.69 62.37 1hg0 s THR 92 Cb -0.16 -4.31 0.04 0.00 1.34 0.00 0.00 72.50 69.40 1hg0 s THR 92 CO -0.09 0.41 0.41 -2.28 -0.54 0.00 0.00 174.62 172.52 1hg0 s HIS 93 N -0.57 -0.25 0.66 3.99 5.04 -0.48 -2.36 115.29 121.31 1hg0 s HIS 93 Ca 0.44 0.16 -0.15 0.00 -1.54 0.00 0.00 55.06 53.97 1hg0 s HIS 93 Cb -0.24 0.23 -0.00 0.00 0.04 0.00 0.00 32.58 32.60 1hg0 s HIS 93 CO 0.30 -0.60 1.11 0.20 -2.34 0.00 0.00 174.74 173.42 1hg0 s GLY 94 N -2.15 2.17 0.23 1.59 0.00 -1.25 -4.29 107.32 103.62 1hg0 s GLY 94 Ca -0.04 0.56 0.12 0.00 0.00 0.00 0.00 44.72 45.36 1hg0 s GLY 94 CO -0.04 0.92 1.46 -0.91 0.00 0.00 0.00 173.10 174.52 1hg0 h THR 95 N 0.06 1.32 -0.63 0.90 1.35 -1.95 -3.23 112.91 110.73 1hg0 h THR 95 Ca -0.47 -2.58 0.11 0.00 -0.55 0.00 0.00 66.41 62.93 1hg0 h THR 95 Cb 1.25 2.47 -0.08 0.00 -1.73 0.00 0.00 68.15 70.05 1hg0 h THR 95 CO 0.54 0.69 0.19 0.44 -0.25 0.00 0.00 175.52 177.13 1hg0 h ASP 96 N 0.00 0.11 0.00 5.36 3.32 -1.93 -3.19 116.42 120.09 1hg0 h ASP 96 Ca -0.01 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1hg0 h ASP 96 Cb 1.41 0.12 -0.04 0.00 0.22 0.00 0.00 39.33 41.03 1hg0 h ASP 96 CO 0.09 0.06 -0.33 0.35 -1.72 0.00 0.00 179.24 177.69 1hg0 n THR 97 N -5.07 1.41 0.09 0.35 -2.24 -1.26 -4.78 114.28 102.78 1hg0 n THR 97 Ca 0.10 -1.95 0.02 0.00 -2.27 0.00 0.00 64.05 59.95 1hg0 n THR 97 Cb 0.33 0.03 0.38 0.00 -2.10 0.00 0.00 70.33 68.97 1hg0 n THR 97 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1hg0 h VAL 98 N 2.34 1.17 0.00 2.28 3.04 -1.56 -1.98 116.25 121.55 1hg0 h VAL 98 Ca -0.02 -0.73 -0.02 0.00 -1.01 0.00 0.00 66.70 64.91 1hg0 h VAL 98 Cb 1.17 1.10 -0.00 0.00 -2.01 0.00 0.00 31.29 31.56 1hg0 h VAL 98 CO 0.01 0.24 -0.09 1.05 -1.01 0.00 0.00 177.57 177.77 1hg0 h GLU 99 N 0.30 0.00 0.00 4.17 4.11 -1.86 0.42 114.58 121.72 1hg0 h GLU 99 Ca 0.06 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.49 1hg0 h GLU 99 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1hg0 h GLU 99 CO 0.02 0.09 -0.00 0.93 0.07 0.00 0.00 179.01 180.12 1hg0 h GLU 100 N 0.00 -0.00 -0.55 1.06 5.08 -1.71 -2.66 114.58 115.79 1hg0 h GLU 100 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1hg0 h GLU 100 Cb 0.23 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1hg0 h GLU 100 CO 0.01 0.99 0.27 0.77 -1.00 0.00 0.00 179.01 180.05 1hg0 h SER 101 N -0.99 0.72 -0.70 1.42 0.02 -1.18 -1.67 113.55 111.16 1hg0 h SER 101 Ca -0.00 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1hg0 h SER 101 Cb 0.99 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.31 1hg0 h SER 101 CO 0.00 0.64 0.36 0.00 -1.14 0.00 0.00 176.83 176.69 1hg0 h ALA 102 N 1.11 0.89 -0.13 3.77 0.00 -0.29 -2.21 119.26 122.39 1hg0 h ALA 102 Ca 0.19 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1hg0 h ALA 102 Cb 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1hg0 h ALA 102 CO -0.02 0.43 -0.42 -0.92 0.00 0.00 0.00 179.25 178.32 1hg0 h TYR 103 N 0.96 0.36 -0.26 0.00 3.20 -1.26 -1.33 116.97 118.64 1hg0 h TYR 103 Ca 0.24 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1hg0 h TYR 103 Cb 0.08 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 1hg0 h TYR 103 CO 0.00 0.68 0.14 0.35 -1.64 0.00 0.00 178.16 177.69 1hg0 h PHE 104 N 0.25 0.36 -0.00 -3.82 3.04 -0.89 -2.42 116.94 113.46 1hg0 h PHE 104 Ca 0.02 -0.01 -0.09 0.00 3.98 0.00 0.00 57.97 61.87 1hg0 h PHE 104 Cb 0.85 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 39.23 1hg0 h PHE 104 CO 0.02 0.31 -0.45 -0.07 -2.02 0.00 0.00 178.31 176.10 1hg0 h LEU 105 N 0.30 0.00 -1.71 0.59 4.07 -1.24 -2.40 115.31 114.92 1hg0 h LEU 105 Ca 0.09 -0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.11 1hg0 h LEU 105 Cb 0.07 -0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.79 1hg0 h LEU 105 CO -0.01 0.45 0.31 -0.74 -1.08 0.00 0.00 178.44 177.36 1hg0 h HIS 106 N 0.00 0.35 0.00 1.13 2.76 -0.78 0.33 115.15 118.95 1hg0 h HIS 106 Ca -0.00 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1hg0 h HIS 106 Cb 0.80 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 29.64 1hg0 h HIS 106 CO 0.00 0.19 -1.20 1.28 -1.30 0.00 0.00 177.93 176.90 1hg0 n LEU 107 N -4.47 0.60 -0.00 0.26 4.77 -0.99 -0.33 117.00 116.84 1hg0 n LEU 107 Ca 0.06 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1hg0 n LEU 107 Cb 0.27 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1hg0 n LEU 107 CO 0.35 0.09 -0.02 0.35 -1.33 0.00 0.00 177.39 176.83 1hg0 n THR 108 N -1.88 0.00 -2.68 -5.08 -2.24 -0.89 -4.34 114.28 97.16 1hg0 n THR 108 Ca 0.01 -0.48 -0.43 0.00 -2.27 0.00 0.00 64.05 60.89 1hg0 n THR 108 Cb 0.43 0.98 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 1hg0 n THR 108 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1hg0 s VAL 109 N -1.06 4.49 -1.23 2.28 1.01 0.06 -4.78 120.40 121.17 1hg0 s VAL 109 Ca 0.00 1.53 -0.08 0.00 0.00 0.00 0.00 61.98 63.43 1hg0 s VAL 109 Cb 0.00 -4.42 0.21 0.00 0.00 0.00 0.00 36.38 32.17 1hg0 s VAL 109 CO 0.01 -0.56 1.78 0.29 0.00 0.00 0.00 175.10 176.61 1hg0 n LYS 110 N 6.97 3.87 -3.52 2.72 4.76 -1.26 -3.82 118.16 127.87 1hg0 n LYS 110 Ca 0.11 -3.80 -0.12 0.00 -2.87 0.00 0.00 58.31 51.62 1hg0 n LYS 110 Cb 0.48 -2.81 -0.04 0.00 -1.84 0.00 0.00 35.03 30.81 1hg0 n LYS 110 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1hg0 s SER 111 N 0.12 -0.48 0.00 4.39 0.15 -1.26 -4.88 113.70 111.74 1hg0 s SER 111 Ca 0.37 0.35 0.24 0.00 0.70 0.00 0.00 55.95 57.61 1hg0 s SER 111 Cb 0.09 0.43 0.29 0.00 -1.71 0.00 0.00 66.02 65.12 1hg0 s SER 111 CO 0.03 -0.57 1.27 0.47 1.20 0.00 0.00 173.24 175.63 1hg0 n ASP 112 N 0.40 0.64 -4.76 5.45 8.00 -1.26 -4.42 116.55 120.60 1hg0 n ASP 112 Ca -0.13 -0.46 -0.38 0.00 0.71 0.00 0.00 54.79 54.53 1hg0 n ASP 112 Cb 0.60 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 42.17 1hg0 n ASP 112 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1hg0 s LYS 113 N -3.00 3.65 0.20 -1.24 1.02 -1.26 -0.69 119.74 118.42 1hg0 s LYS 113 Ca 0.10 1.97 -0.32 0.00 0.02 0.00 0.00 55.97 57.74 1hg0 s LYS 113 Cb 0.17 -2.45 -0.12 0.00 -0.52 0.00 0.00 37.83 34.91 1hg0 s LYS 113 CO 0.75 -0.70 1.74 -2.30 -0.92 0.00 0.00 175.35 173.92 1hg0 n PRO 114 N -0.48 2.77 -4.02 -1.68 -0.02 -1.26 -4.83 135.00 125.49 1hg0 n PRO 114 Ca 0.07 1.00 -0.31 0.00 -2.02 0.00 0.00 63.50 62.24 1hg0 n PRO 114 Cb 0.46 -2.85 -0.15 0.00 -0.02 0.00 0.00 33.50 30.94 1hg0 n PRO 114 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1hg0 s VAL 115 N 1.33 1.96 -0.20 -1.45 1.01 -1.26 -0.83 120.40 120.96 1hg0 s VAL 115 Ca 0.76 -1.60 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1hg0 s VAL 115 Cb -0.51 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 33.72 1hg0 s VAL 115 CO 0.33 -0.14 -0.13 -0.69 0.00 0.00 0.00 175.10 174.47 1hg0 s VAL 116 N 1.18 2.55 0.02 2.92 1.01 0.01 -1.75 120.40 126.34 1hg0 s VAL 116 Ca -0.05 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 60.91 1hg0 s VAL 116 Cb -0.19 -2.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.98 1hg0 s VAL 116 CO -0.06 0.45 0.53 -0.36 0.00 0.00 0.00 175.10 175.66 1hg0 s PHE 117 N 1.35 3.74 0.05 5.22 0.40 0.62 -0.30 117.98 129.06 1hg0 s PHE 117 Ca 0.04 1.16 0.03 0.00 -0.60 0.00 0.00 56.93 57.56 1hg0 s PHE 117 Cb -0.14 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 40.88 1hg0 s PHE 117 CO -0.09 0.51 -0.09 0.54 0.70 0.00 0.00 175.22 176.79 1hg0 s VAL 118 N -0.75 0.70 0.26 -0.44 0.11 -0.01 -0.59 120.40 119.69 1hg0 s VAL 118 Ca 0.28 -1.18 -0.05 0.00 -2.93 0.00 0.00 61.98 58.10 1hg0 s VAL 118 Cb -0.18 -0.78 0.02 0.00 -1.53 0.00 0.00 36.38 33.91 1hg0 s VAL 118 CO 0.17 -0.37 0.43 0.00 -3.33 0.00 0.00 175.10 172.00 1hg0 n ALA 119 N 1.34 -0.61 -3.23 1.54 0.00 -1.26 -1.38 120.51 116.91 1hg0 n ALA 119 Ca -0.22 -1.08 -0.13 0.00 0.00 0.00 0.00 53.44 52.02 1hg0 n ALA 119 Cb 0.55 0.87 -0.12 0.00 0.00 0.00 0.00 19.45 20.74 1hg0 n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hg0 s ALA 120 N -2.20 -0.53 -0.23 0.00 0.00 -1.26 -4.74 121.76 112.80 1hg0 s ALA 120 Ca 0.18 0.68 0.19 0.00 0.00 0.00 0.00 51.96 53.00 1hg0 s ALA 120 Cb -0.02 -0.41 0.07 0.00 0.00 0.00 0.00 23.12 22.76 1hg0 s ALA 120 CO 0.13 -0.12 1.26 0.52 0.00 0.00 0.00 175.76 177.55 1hg0 h MET 121 N 6.09 0.00 -6.44 0.00 2.86 -1.92 -3.37 114.93 112.15 1hg0 h MET 121 Ca -0.29 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.69 1hg0 h MET 121 Cb 1.19 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.69 1hg0 h MET 121 CO 0.37 0.25 -0.71 1.03 1.06 0.00 0.00 176.91 178.91 1hg0 s ARG 122 N -3.08 2.34 0.63 1.72 0.52 -1.26 -5.01 118.95 114.80 1hg0 s ARG 122 Ca 0.02 -0.90 -0.16 0.00 -0.52 0.00 0.00 55.73 54.17 1hg0 s ARG 122 Cb 0.08 -2.41 -0.02 0.00 0.52 0.00 0.00 34.95 33.12 1hg0 s ARG 122 CO 0.75 0.54 1.12 -1.25 0.02 0.00 0.00 175.30 176.49 1hg0 s PRO 123 N -1.98 2.93 0.60 3.54 0.04 -1.26 -4.54 135.00 134.32 1hg0 s PRO 123 Ca 0.21 1.48 0.29 0.00 0.04 0.00 0.00 61.00 63.02 1hg0 s PRO 123 Cb -0.11 -1.96 1.62 0.00 0.04 0.00 0.00 34.50 34.09 1hg0 s PRO 123 CO 0.13 -1.16 2.04 0.00 0.04 0.00 0.00 177.00 178.04 1hg0 h ALA 124 N 0.36 1.86 -0.23 8.56 0.00 -1.30 -0.48 119.26 128.03 1hg0 h ALA 124 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1hg0 h ALA 124 Cb 1.25 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1hg0 h ALA 124 CO 0.55 -0.41 0.00 0.25 0.00 0.00 0.00 179.25 179.64 1hg0 n THR 125 N -3.69 0.29 -3.27 0.00 -2.24 -1.26 -4.90 114.28 99.21 1hg0 n THR 125 Ca 0.03 -0.43 -0.31 0.00 -2.27 0.00 0.00 64.05 61.07 1hg0 n THR 125 Cb 0.42 0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 69.06 1hg0 n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hg0 s ALA 126 N -1.71 3.50 0.20 6.98 0.00 -0.19 -3.27 121.76 127.28 1hg0 s ALA 126 Ca 0.32 -0.26 -0.31 0.00 0.00 0.00 0.00 51.96 51.71 1hg0 s ALA 126 Cb 0.18 -2.50 -0.10 0.00 0.00 0.00 0.00 23.12 20.70 1hg0 s ALA 126 CO 0.26 0.35 1.48 0.42 0.00 0.00 0.00 175.76 178.28 1hg0 s ILE 127 N -1.98 2.73 -1.22 0.00 1.01 -0.03 -2.31 121.20 119.39 1hg0 s ILE 127 Ca 0.48 0.56 -0.06 0.00 0.00 0.00 0.00 60.65 61.64 1hg0 s ILE 127 Cb -0.11 -3.36 0.01 0.00 0.01 0.00 0.00 42.46 39.01 1hg0 s ILE 127 CO 0.24 0.07 1.05 -1.20 0.00 0.00 0.00 174.94 175.10 1hg0 n SER 128 N 3.16 -4.83 -4.77 3.58 7.64 -1.26 -4.95 113.62 112.19 1hg0 n SER 128 Ca 0.10 -0.53 -0.39 0.00 1.01 0.00 0.00 58.87 59.06 1hg0 n SER 128 Cb 0.40 -4.76 -0.01 0.00 -1.01 0.00 0.00 64.21 58.83 1hg0 n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hg0 s ALA 129 N -3.31 3.22 -0.63 -0.43 0.00 -0.98 -4.94 121.76 114.68 1hg0 s ALA 129 Ca 0.38 1.15 0.23 0.00 0.00 0.00 0.00 51.96 53.73 1hg0 s ALA 129 Cb -0.17 -3.46 0.18 0.00 0.00 0.00 0.00 23.12 19.68 1hg0 s ALA 129 CO 0.68 -0.75 1.16 -0.40 0.00 0.00 0.00 175.76 176.45 1hg0 n ASP 130 N 0.09 0.64 0.02 0.00 5.75 -1.26 -4.54 116.55 117.25 1hg0 n ASP 130 Ca 0.04 -0.07 -0.13 0.00 -0.01 0.00 0.00 54.79 54.62 1hg0 n ASP 130 Cb 0.44 0.52 -0.07 0.00 -1.03 0.00 0.00 41.12 40.99 1hg0 n ASP 130 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1hg0 h GLY 131 N 4.54 -0.76 -0.38 6.12 0.00 -1.85 -1.79 103.07 108.94 1hg0 h GLY 131 Ca 0.00 0.53 0.10 0.00 0.00 0.00 0.00 47.33 47.96 1hg0 h GLY 131 CO 0.00 -0.23 -0.35 -2.55 0.00 0.00 0.00 176.54 173.41 1hg0 h PRO 132 N -0.53 -0.19 -0.38 4.80 0.11 -1.94 0.12 132.00 133.99 1hg0 h PRO 132 Ca 0.06 0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.09 1hg0 h PRO 132 Cb 0.64 0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 1hg0 h PRO 132 CO -0.38 -0.12 -0.16 1.98 -0.21 0.00 0.00 178.00 179.10 1hg0 h MET 133 N -0.19 0.70 -0.30 1.05 1.85 -1.84 -1.47 114.93 114.72 1hg0 h MET 133 Ca 0.21 -0.25 -0.00 0.00 -0.61 0.00 0.00 59.70 59.05 1hg0 h MET 133 Cb 0.55 -0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.52 1hg0 h MET 133 CO -0.65 0.82 0.17 -0.91 -0.40 0.00 0.00 176.91 175.94 1hg0 h ASN 134 N 0.63 0.37 -0.68 1.39 2.35 -0.37 -1.14 115.58 118.11 1hg0 h ASN 134 Ca 0.10 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1hg0 h ASN 134 Cb 0.63 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 1hg0 h ASN 134 CO 0.04 0.34 0.26 0.25 -1.65 0.00 0.00 177.43 176.67 1hg0 h LEU 135 N 0.36 0.95 -0.67 1.61 5.85 -0.61 -0.67 115.31 122.14 1hg0 h LEU 135 Ca 0.10 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1hg0 h LEU 135 Cb 0.05 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1hg0 h LEU 135 CO -0.02 0.87 0.41 0.25 -0.34 0.00 0.00 178.44 179.61 1hg0 h LEU 136 N 0.97 0.80 -0.65 2.25 5.85 -1.05 -1.66 115.31 121.82 1hg0 h LEU 136 Ca 0.23 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.75 1hg0 h LEU 136 Cb 0.23 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1hg0 h LEU 136 CO -0.02 0.62 -0.38 -0.33 -0.34 0.00 0.00 178.44 178.00 1hg0 h GLU 137 N 0.91 0.63 -0.65 1.25 5.08 -0.94 -2.30 114.58 118.56 1hg0 h GLU 137 Ca 0.24 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1hg0 h GLU 137 Cb -0.03 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1hg0 h GLU 137 CO -0.05 0.90 0.19 0.00 -1.00 0.00 0.00 179.01 179.06 1hg0 h ALA 138 N 1.06 0.85 -0.49 3.43 0.00 -0.71 -0.15 119.26 123.25 1hg0 h ALA 138 Ca 0.05 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1hg0 h ALA 138 Cb 0.89 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1hg0 h ALA 138 CO 0.08 0.54 -0.18 0.28 0.00 0.00 0.00 179.25 179.96 1hg0 h VAL 139 N 0.94 1.27 -0.61 0.00 2.07 -1.26 -0.04 116.25 118.62 1hg0 h VAL 139 Ca 0.21 -1.33 -0.08 0.00 0.82 0.00 0.00 66.70 66.31 1hg0 h VAL 139 Cb 0.32 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1hg0 h VAL 139 CO -0.00 0.46 0.08 -0.09 0.02 0.00 0.00 177.57 178.04 1hg0 h ARG 140 N 0.84 1.03 -0.06 1.57 2.43 -1.10 -0.84 114.38 118.25 1hg0 h ARG 140 Ca 0.12 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1hg0 h ARG 140 Cb 0.74 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1hg0 h ARG 140 CO 0.06 0.97 0.01 0.28 -1.51 0.00 0.00 179.97 179.78 1hg0 h VAL 141 N 0.94 1.19 -0.19 0.20 2.07 -0.80 -2.39 116.25 117.26 1hg0 h VAL 141 Ca 0.18 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1hg0 h VAL 141 Cb 0.45 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1hg0 h VAL 141 CO 0.02 0.16 0.04 0.00 0.02 0.00 0.00 177.57 177.81 1hg0 h ALA 142 N 0.79 1.71 -0.00 1.67 0.00 -0.89 -2.53 119.26 120.02 1hg0 h ALA 142 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1hg0 h ALA 142 Cb 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1hg0 h ALA 142 CO 0.00 0.23 -0.32 0.41 0.00 0.00 0.00 179.25 179.56 1hg0 n GLY 143 N -1.26 -1.28 3.75 0.00 0.00 -0.33 -4.58 105.19 101.49 1hg0 n GLY 143 Ca -0.00 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 1hg0 n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hg0 s ASP 144 N -2.95 7.51 0.40 1.61 -1.08 -0.91 -4.87 116.67 116.37 1hg0 s ASP 144 Ca 0.13 1.79 0.15 0.00 -0.52 0.00 0.00 52.55 54.10 1hg0 s ASP 144 Cb 0.18 -2.56 0.84 0.00 -1.46 0.00 0.00 42.92 39.92 1hg0 s ASP 144 CO 0.63 0.12 1.87 0.07 0.52 0.00 0.00 175.17 178.38 1hg0 h LYS 145 N 4.62 0.00 0.00 4.34 -0.00 -1.89 -2.47 116.57 121.17 1hg0 h LYS 145 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.20 1hg0 h LYS 145 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.43 1hg0 h LYS 145 CO 0.68 0.32 0.00 1.96 -0.00 0.00 0.00 179.45 182.41 1hg0 h GLN 146 N 0.00 0.00 0.00 0.07 4.20 -1.93 -3.01 115.11 114.44 1hg0 h GLN 146 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1hg0 h GLN 146 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 1hg0 h GLN 146 CO 0.04 0.00 -0.02 0.43 -0.67 0.00 0.00 178.83 178.61 1hg0 n SER 147 N -2.37 0.20 -4.75 1.46 7.64 -0.93 -4.91 113.62 109.96 1hg0 n SER 147 Ca 0.01 0.49 -0.36 0.00 1.01 0.00 0.00 58.87 60.01 1hg0 n SER 147 Cb 0.19 -0.53 0.03 0.00 -1.01 0.00 0.00 64.21 62.89 1hg0 n SER 147 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hg0 s ARG 148 N -3.02 2.99 -1.48 1.43 0.52 -1.14 -3.67 118.95 114.57 1hg0 s ARG 148 Ca 0.13 1.87 -0.05 0.00 -0.52 0.00 0.00 55.73 57.16 1hg0 s ARG 148 Cb 0.17 -1.97 0.02 0.00 0.52 0.00 0.00 34.95 33.70 1hg0 s ARG 148 CO 0.55 -1.20 0.45 0.41 0.02 0.00 0.00 175.30 175.53 1hg0 n GLY 149 N 0.55 -0.51 0.50 -3.53 0.00 0.14 -4.88 105.19 97.46 1hg0 n GLY 149 Ca 0.13 0.09 0.05 0.00 0.00 0.00 0.00 46.02 46.30 1hg0 n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hg0 n ARG 150 N -3.72 1.30 0.00 1.61 1.74 -1.24 -5.06 116.66 111.29 1hg0 n ARG 150 Ca -0.11 -1.45 0.00 0.00 -0.77 0.00 0.00 57.85 55.52 1hg0 n ARG 150 Cb 0.61 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.82 1hg0 n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hg0 n GLY 151 N 0.58 -0.44 3.76 -0.13 0.00 -1.26 -4.78 105.19 102.92 1hg0 n GLY 151 Ca 0.08 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1hg0 n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hg0 s VAL 152 N -1.46 3.05 0.21 1.61 1.01 -1.26 -4.69 120.40 118.87 1hg0 s VAL 152 Ca 0.00 1.03 0.11 0.00 0.00 0.00 0.00 61.98 63.12 1hg0 s VAL 152 Cb 0.00 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.68 1hg0 s VAL 152 CO 0.00 0.23 -0.22 -0.04 0.00 0.00 0.00 175.10 175.07 1hg0 s MET 153 N -1.42 1.52 -0.18 2.72 1.00 -0.72 -2.09 119.30 120.12 1hg0 s MET 153 Ca 0.49 -1.56 0.01 0.00 0.00 0.00 0.00 55.69 54.62 1hg0 s MET 153 Cb -0.37 -1.76 0.03 0.00 0.00 0.00 0.00 34.83 32.73 1hg0 s MET 153 CO 0.47 0.37 -0.17 0.08 0.00 0.00 0.00 175.02 175.76 1hg0 s VAL 154 N -1.90 1.94 -0.18 -6.03 1.01 0.15 -0.28 120.40 115.12 1hg0 s VAL 154 Ca 0.22 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1hg0 s VAL 154 Cb -0.07 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 1hg0 s VAL 154 CO 0.10 0.43 -0.02 -0.69 0.00 0.00 0.00 175.10 174.93 1hg0 s VAL 155 N 1.32 3.87 -0.25 2.92 1.01 0.25 -1.38 120.40 128.14 1hg0 s VAL 155 Ca 0.03 -0.35 -0.27 0.00 0.00 0.00 0.00 61.98 61.39 1hg0 s VAL 155 Cb -0.14 -2.73 0.15 0.00 0.00 0.00 0.00 36.38 33.66 1hg0 s VAL 155 CO -0.11 0.45 1.17 -0.51 0.00 0.00 0.00 175.10 176.10 1hg0 s ILE 156 N 0.77 0.00 -1.40 2.22 2.07 -0.96 -4.05 121.20 119.85 1hg0 s ILE 156 Ca -0.01 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.16 1hg0 s ILE 156 Cb -0.14 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.49 1hg0 s ILE 156 CO 0.02 0.00 0.92 -3.20 -1.91 0.00 0.00 174.94 170.77 1hg0 n ASN 157 N 1.32 -3.56 0.00 4.50 4.05 -1.26 -1.54 115.26 118.76 1hg0 n ASN 157 Ca -0.09 -0.75 0.00 0.00 0.45 0.00 0.00 54.58 54.19 1hg0 n ASN 157 Cb 0.57 -4.21 0.00 0.00 1.23 0.00 0.00 39.78 37.38 1hg0 n ASN 157 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1hg0 n ASP 158 N -2.96 -1.63 -4.63 1.20 8.00 -1.26 -4.98 116.55 110.29 1hg0 n ASP 158 Ca -0.11 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.08 1hg0 n ASP 158 Cb 0.59 -1.97 -0.09 0.00 -0.02 0.00 0.00 41.12 39.63 1hg0 n ASP 158 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hg0 s ARG 159 N -0.90 2.47 -0.25 -1.24 1.81 -0.59 -0.39 118.95 119.85 1hg0 s ARG 159 Ca 0.00 -0.83 -0.02 0.00 -1.72 0.00 0.00 55.73 53.16 1hg0 s ARG 159 Cb 0.00 -2.48 0.02 0.00 -0.45 0.00 0.00 34.95 32.04 1hg0 s ARG 159 CO 0.00 0.56 -0.04 0.42 -0.68 0.00 0.00 175.30 175.56 1hg0 s ILE 160 N -1.17 3.04 0.11 1.52 1.01 -0.16 -2.26 121.20 123.29 1hg0 s ILE 160 Ca 0.21 -0.97 0.10 0.00 0.00 0.00 0.00 60.65 60.00 1hg0 s ILE 160 Cb -0.11 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 1hg0 s ILE 160 CO 0.13 0.19 -0.25 -0.83 0.00 0.00 0.00 174.94 174.18 1hg0 s GLY 161 N 1.35 1.56 0.18 6.18 0.00 -0.48 -0.07 107.32 116.05 1hg0 s GLY 161 Ca 0.01 -1.40 -0.30 0.00 0.00 0.00 0.00 44.72 43.02 1hg0 s GLY 161 CO -0.03 -1.36 1.08 -0.45 0.00 0.00 0.00 173.10 172.33 1hg0 s SER 162 N -1.89 7.31 0.58 1.64 0.15 -1.26 -0.67 113.70 119.56 1hg0 s SER 162 Ca 0.14 2.06 0.28 0.00 0.70 0.00 0.00 55.95 59.14 1hg0 s SER 162 Cb -0.10 -2.60 1.67 0.00 -1.71 0.00 0.00 66.02 63.28 1hg0 s SER 162 CO 0.06 -0.18 2.15 0.00 1.20 0.00 0.00 173.24 176.48 1hg0 h ALA 163 N 5.00 1.75 -0.05 5.45 0.00 -1.76 0.16 119.26 129.81 1hg0 h ALA 163 Ca -0.44 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 1hg0 h ALA 163 Cb 1.21 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1hg0 h ALA 163 CO 0.72 -0.18 -0.68 -0.09 0.00 0.00 0.00 179.25 179.01 1hg0 h ARG 164 N 0.00 0.21 0.00 0.00 9.65 -1.91 -3.38 114.38 118.95 1hg0 h ARG 164 Ca 0.06 -0.17 -0.18 0.00 -1.10 0.00 0.00 59.98 58.58 1hg0 h ARG 164 Cb 0.30 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.88 1hg0 h ARG 164 CO -0.00 0.81 -1.77 0.66 2.80 0.00 0.00 179.97 182.47 1hg0 n TYR 165 N -3.81 0.00 -2.15 2.20 4.01 -0.72 -4.96 117.16 111.74 1hg0 n TYR 165 Ca -0.03 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.35 1hg0 n TYR 165 Cb 0.67 -0.54 0.01 0.00 -0.31 0.00 0.00 39.34 39.17 1hg0 n TYR 165 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 1hg0 s ILE 166 N -2.37 2.90 -0.01 -0.72 1.10 0.47 -4.60 121.20 117.97 1hg0 s ILE 166 Ca -0.06 0.63 -0.29 0.00 -0.51 0.00 0.00 60.65 60.42 1hg0 s ILE 166 Cb 0.04 -3.30 0.07 0.00 0.15 0.00 0.00 42.46 39.42 1hg0 s ILE 166 CO 0.49 -0.05 0.66 0.28 -2.11 0.00 0.00 174.94 174.21 1hg0 s THR 167 N -1.56 0.00 -0.42 4.00 -1.32 -1.18 -4.89 115.64 110.27 1hg0 s THR 167 Ca 0.68 -0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.87 1hg0 s THR 167 Cb -0.30 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.72 1hg0 s THR 167 CO 0.35 -0.00 1.22 -0.75 -2.21 0.00 0.00 174.62 173.22 1hg0 s LYS 168 N -1.66 3.75 0.03 7.08 2.20 -1.26 -2.58 119.74 127.29 1hg0 s LYS 168 Ca -0.09 0.79 0.22 0.00 -0.36 0.00 0.00 55.97 56.53 1hg0 s LYS 168 Cb -0.00 -3.91 -0.12 0.00 -1.51 0.00 0.00 37.83 32.28 1hg0 s LYS 168 CO 0.06 -1.35 0.84 0.25 -0.36 0.00 0.00 175.35 174.79 1hg0 n THR 169 N 6.72 0.12 -4.68 3.43 -2.24 -0.42 -4.92 114.28 112.29 1hg0 n THR 169 Ca 0.13 -0.30 -0.23 0.00 -2.27 0.00 0.00 64.05 61.39 1hg0 n THR 169 Cb 0.48 0.25 -0.15 0.00 -2.10 0.00 0.00 70.33 68.82 1hg0 n THR 169 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1hg0 s ASN 170 N -4.04 1.77 0.34 3.42 3.84 -1.25 -5.05 114.94 113.97 1hg0 s ASN 170 Ca 0.01 -0.29 0.09 0.00 0.21 0.00 0.00 52.86 52.89 1hg0 s ASN 170 Cb 0.14 -0.19 0.63 0.00 -0.55 0.00 0.00 41.25 41.28 1hg0 s ASN 170 CO 0.85 0.18 1.80 0.00 -2.79 0.00 0.00 177.10 177.13 1hg0 h ALA 171 N 5.71 1.30 0.00 1.71 0.00 -1.97 -3.40 119.26 122.62 1hg0 h ALA 171 Ca -0.35 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1hg0 h ALA 171 Cb 1.16 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1hg0 h ALA 171 CO 0.48 0.49 0.00 0.43 0.00 0.00 0.00 179.25 180.65 1hg0 n SER 172 N -4.11 0.22 -4.92 0.00 7.64 -1.26 -5.11 113.62 106.07 1hg0 n SER 172 Ca -0.01 -0.96 -0.26 0.00 1.01 0.00 0.00 58.87 58.65 1hg0 n SER 172 Cb 0.40 0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.61 1hg0 n SER 172 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1hg0 s THR 173 N -0.01 5.00 0.29 0.44 -4.23 -1.26 -5.00 115.64 110.87 1hg0 s THR 173 Ca 0.00 -0.13 0.14 0.00 -1.18 0.00 0.00 61.69 60.52 1hg0 s THR 173 Cb 0.00 -3.86 0.08 0.00 1.34 0.00 0.00 72.50 70.05 1hg0 s THR 173 CO 0.00 -0.70 1.75 -0.07 -0.54 0.00 0.00 174.62 175.05 1hg0 h LEU 174 N 0.49 0.00 -3.81 4.79 3.38 -1.97 -3.10 115.31 115.09 1hg0 h LEU 174 Ca -0.48 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.01 1hg0 h LEU 174 Cb 1.21 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.68 1hg0 h LEU 174 CO 0.61 0.44 0.61 -0.90 0.09 0.00 0.00 178.44 179.29 1hg0 n ASP 175 N -3.83 3.99 -0.16 -0.43 5.75 -1.26 -4.62 116.55 116.00 1hg0 n ASP 175 Ca -0.01 -3.46 -0.05 0.00 -0.01 0.00 0.00 54.79 51.25 1hg0 n ASP 175 Cb 0.49 -0.82 0.13 0.00 -1.03 0.00 0.00 41.12 39.89 1hg0 n ASP 175 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1hg0 h THR 176 N 0.91 1.24 -3.25 2.12 1.03 -1.86 -3.42 112.91 109.68 1hg0 h THR 176 Ca 0.57 -0.95 -0.57 0.00 -0.01 0.00 0.00 66.41 65.46 1hg0 h THR 176 Cb 2.53 0.72 -0.05 0.00 -1.07 0.00 0.00 68.15 70.28 1hg0 h THR 176 CO 1.03 0.35 1.04 -0.36 -0.01 0.00 0.00 175.52 177.57 1hg0 s PHE 177 N -5.14 2.48 0.09 0.00 0.08 -1.26 -1.30 117.98 112.93 1hg0 s PHE 177 Ca -0.10 0.72 -0.07 0.00 0.12 0.00 0.00 56.93 57.60 1hg0 s PHE 177 Cb 0.15 -4.20 -0.01 0.00 -0.57 0.00 0.00 43.02 38.39 1hg0 s PHE 177 CO 0.82 -1.90 0.15 1.03 -0.10 0.00 0.00 175.22 175.22 1hg0 s ARG 178 N 4.70 0.84 -0.50 0.44 0.52 -1.06 -4.95 118.95 118.95 1hg0 s ARG 178 Ca 0.60 -1.05 0.03 0.00 -0.52 0.00 0.00 55.73 54.79 1hg0 s ARG 178 Cb -0.14 0.32 0.16 0.00 0.52 0.00 0.00 34.95 35.80 1hg0 s ARG 178 CO 0.30 -0.25 0.34 0.00 0.02 0.00 0.00 175.30 175.70 1hg0 s ALA 179 N -3.89 2.27 0.22 2.13 0.00 -1.26 -3.08 121.76 118.14 1hg0 s ALA 179 Ca 0.08 -2.84 -0.15 0.00 0.00 0.00 0.00 51.96 49.05 1hg0 s ALA 179 Cb 0.05 -1.85 0.24 0.00 0.00 0.00 0.00 23.12 21.57 1hg0 s ALA 179 CO -0.09 -2.04 1.60 -0.91 0.00 0.00 0.00 175.76 174.32 1hg0 h ASN 180 N 6.02 -0.80 0.85 0.00 2.35 -1.92 0.11 115.58 122.19 1hg0 h ASN 180 Ca 0.13 0.22 -0.17 0.00 -0.55 0.00 0.00 56.30 55.93 1hg0 h ASN 180 Cb 0.88 0.48 -0.03 0.00 0.05 0.00 0.00 38.32 39.70 1hg0 h ASN 180 CO 0.49 -0.25 -1.24 -0.33 -1.65 0.00 0.00 177.43 174.45 1hg0 h GLU 181 N -0.04 0.00 -0.00 0.81 4.39 -1.97 -3.39 114.58 114.38 1hg0 h GLU 181 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 1hg0 h GLU 181 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1hg0 h GLU 181 CO -0.72 0.39 -0.66 0.39 -1.16 0.00 0.00 179.01 177.25 1hg0 n GLU 182 N -3.00 1.37 -0.48 2.33 4.71 -1.04 -5.10 120.64 119.43 1hg0 n GLU 182 Ca -0.08 -0.32 0.07 0.00 -0.01 0.00 0.00 57.16 56.82 1hg0 n GLU 182 Cb 0.85 -1.33 -0.02 0.00 -1.01 0.00 0.00 31.44 29.93 1hg0 n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1hg0 n GLY 183 N 1.35 -1.55 3.94 0.62 0.00 0.34 -4.89 105.19 105.01 1hg0 n GLY 183 Ca 0.05 -1.16 -0.26 0.00 0.00 0.00 0.00 46.02 44.65 1hg0 n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hg0 s TYR 184 N -0.84 3.48 0.31 1.61 2.02 -1.26 -4.63 117.35 118.04 1hg0 s TYR 184 Ca 0.00 0.22 0.11 0.00 -0.37 0.00 0.00 57.07 57.03 1hg0 s TYR 184 Cb 0.00 -1.76 0.49 0.00 -0.40 0.00 0.00 41.96 40.29 1hg0 s TYR 184 CO 0.00 0.40 1.69 -0.07 -1.57 0.00 0.00 175.55 176.01 1hg0 h LEU 185 N 1.81 0.01 0.00 -1.29 3.38 -0.78 -3.39 115.31 115.05 1hg0 h LEU 185 Ca -0.49 -0.00 0.20 0.00 0.09 0.00 0.00 57.88 57.68 1hg0 h LEU 185 Cb 1.20 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 1hg0 h LEU 185 CO 0.67 0.53 0.49 0.61 0.09 0.00 0.00 178.44 180.83 1hg0 n GLY 186 N -0.03 0.30 3.10 0.83 0.00 -1.13 0.10 105.19 108.36 1hg0 n GLY 186 Ca -0.01 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 45.00 1hg0 n GLY 186 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hg0 s VAL 187 N -2.03 0.16 -0.26 1.61 -7.23 -0.25 -0.99 120.40 111.41 1hg0 s VAL 187 Ca 0.16 -1.35 -0.02 0.00 -1.81 0.00 0.00 61.98 58.97 1hg0 s VAL 187 Cb -0.00 -1.10 0.03 0.00 0.56 0.00 0.00 36.38 35.88 1hg0 s VAL 187 CO -0.01 -0.74 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.36 1hg0 s ILE 188 N -3.09 2.91 -0.06 -0.62 1.01 0.47 -0.35 121.20 121.47 1hg0 s ILE 188 Ca -0.01 -1.14 0.01 0.00 0.00 0.00 0.00 60.65 59.51 1hg0 s ILE 188 Cb 0.02 -2.54 0.02 0.00 0.01 0.00 0.00 42.46 39.97 1hg0 s ILE 188 CO -0.07 0.10 -0.05 -0.63 0.00 0.00 0.00 174.94 174.29 1hg0 s ILE 189 N 1.30 0.64 -1.30 2.92 -1.09 -0.58 -4.74 121.20 118.34 1hg0 s ILE 189 Ca -0.02 -0.15 -0.05 0.00 -2.23 0.00 0.00 60.65 58.20 1hg0 s ILE 189 Cb -0.18 -0.66 0.01 0.00 -1.58 0.00 0.00 42.46 40.05 1hg0 s ILE 189 CO -0.03 0.26 1.06 0.61 -1.23 0.00 0.00 174.94 175.61 1hg0 n GLY 190 N 4.26 -0.45 2.42 6.18 0.00 -1.26 -2.35 105.19 113.99 1hg0 n GLY 190 Ca -0.21 0.18 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 1hg0 n GLY 190 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hg0 n ASN 191 N -3.05 -5.53 -3.98 1.61 3.02 -1.26 -4.98 115.26 101.08 1hg0 n ASN 191 Ca -0.13 0.07 -0.18 0.00 -0.03 0.00 0.00 54.58 54.31 1hg0 n ASN 191 Cb 0.61 -4.64 -0.15 0.00 -0.61 0.00 0.00 39.78 34.99 1hg0 n ASN 191 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1hg0 s ARG 192 N -4.90 0.63 -0.13 3.52 3.52 -0.99 -5.14 118.95 115.46 1hg0 s ARG 192 Ca 0.00 -0.25 -0.17 0.00 -0.13 0.00 0.00 55.73 55.19 1hg0 s ARG 192 Cb 0.00 -0.62 -0.04 0.00 -1.56 0.00 0.00 34.95 32.73 1hg0 s ARG 192 CO 0.00 0.13 0.42 0.42 -0.81 0.00 0.00 175.30 175.46 1hg0 s ILE 193 N -0.04 5.23 -0.37 4.11 1.01 -1.26 -1.53 121.20 128.34 1hg0 s ILE 193 Ca 0.01 0.82 0.03 0.00 0.00 0.00 0.00 60.65 61.51 1hg0 s ILE 193 Cb -0.04 -3.76 0.10 0.00 0.01 0.00 0.00 42.46 38.77 1hg0 s ILE 193 CO -0.00 0.34 0.10 -0.31 0.00 0.00 0.00 174.94 175.07 1hg0 s TYR 194 N 0.59 3.70 0.08 3.97 1.51 0.53 -4.99 117.35 122.74 1hg0 s TYR 194 Ca 0.23 -2.92 -0.27 0.00 -1.01 0.00 0.00 57.07 53.10 1hg0 s TYR 194 Cb -0.14 -2.98 -0.06 0.00 -0.11 0.00 0.00 41.96 38.67 1hg0 s TYR 194 CO 0.08 -0.94 0.85 0.71 -1.11 0.00 0.00 175.55 175.14 1hg0 s TYR 195 N 0.85 3.77 -0.08 2.71 2.02 -1.26 -1.09 117.35 124.28 1hg0 s TYR 195 Ca 0.11 1.62 0.01 0.00 -0.37 0.00 0.00 57.07 58.44 1hg0 s TYR 195 Cb -0.20 -2.92 -0.05 0.00 -0.40 0.00 0.00 41.96 38.39 1hg0 s TYR 195 CO -0.07 0.25 -0.06 1.04 -1.57 0.00 0.00 175.55 175.14 1hg0 n GLN 196 N 2.75 0.46 -4.26 -0.62 6.02 0.28 -4.94 117.38 117.08 1hg0 n GLN 196 Ca -0.01 0.04 -0.14 0.00 -0.01 0.00 0.00 57.00 56.88 1hg0 n GLN 196 Cb 0.50 -1.16 -0.10 0.00 1.02 0.00 0.00 30.24 30.50 1hg0 n GLN 196 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1hg0 s ASN 197 N -4.68 1.38 -0.07 1.08 0.01 -0.69 -5.03 114.94 106.95 1hg0 s ASN 197 Ca -0.10 -1.16 0.01 0.00 -0.71 0.00 0.00 52.86 50.90 1hg0 s ASN 197 Cb 0.03 0.08 0.02 0.00 0.41 0.00 0.00 41.25 41.79 1hg0 s ASN 197 CO 0.19 -0.53 -0.08 -0.13 -1.51 0.00 0.00 177.10 175.04 1hg0 s ARG 198 N -3.89 1.30 0.45 -0.60 0.52 -1.26 -4.75 118.95 110.71 1hg0 s ARG 198 Ca 0.24 -0.24 -0.23 0.00 -0.52 0.00 0.00 55.73 54.97 1hg0 s ARG 198 Cb 0.06 -1.22 -0.08 0.00 0.52 0.00 0.00 34.95 34.23 1hg0 s ARG 198 CO 0.04 -0.09 1.17 0.96 0.02 0.00 0.00 175.30 177.41 1hg0 s ILE 199 N 1.05 3.08 -0.99 1.52 -4.36 -1.26 -4.93 121.20 115.31 1hg0 s ILE 199 Ca -0.08 0.84 -0.01 0.00 -0.26 0.00 0.00 60.65 61.14 1hg0 s ILE 199 Cb -0.14 -3.44 0.32 0.00 1.25 0.00 0.00 42.46 40.45 1hg0 s ILE 199 CO -0.00 0.01 1.81 -0.67 0.24 0.00 0.00 174.94 176.33 1hg0 n ASP 200 N -0.36 7.27 -3.92 4.36 -0.08 -1.26 -4.93 116.55 117.62 1hg0 n ASP 200 Ca 0.07 -3.71 -0.09 0.00 -1.51 0.00 0.00 54.79 49.55 1hg0 n ASP 200 Cb 0.47 -1.13 -0.09 0.00 2.34 0.00 0.00 41.12 42.71 1hg0 n ASP 200 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1hg0 s LYS 201 N -4.27 0.66 0.46 -0.67 -0.14 -1.26 -5.04 119.74 109.47 1hg0 s LYS 201 Ca 0.41 -0.84 -0.21 0.00 -1.36 0.00 0.00 55.97 53.97 1hg0 s LYS 201 Cb 0.22 0.26 -0.09 0.00 -1.68 0.00 0.00 37.83 36.54 1hg0 s LYS 201 CO -0.16 -0.17 1.03 -0.51 -0.76 0.00 0.00 175.35 174.77 1hg0 s LEU 202 N -2.38 3.92 0.09 3.17 1.43 -0.31 -5.01 118.68 119.58 1hg0 s LEU 202 Ca -0.01 1.91 -0.27 0.00 -1.03 0.00 0.00 54.13 54.73 1hg0 s LEU 202 Cb 0.01 -4.49 0.09 0.00 0.03 0.00 0.00 46.19 41.83 1hg0 s LEU 202 CO -0.07 -0.67 1.09 -1.38 0.23 0.00 0.00 176.35 175.56 1hg0 s HIS 203 N -1.95 -0.09 0.00 0.29 -3.43 -1.26 -4.66 115.29 104.19 1hg0 s HIS 203 Ca 0.65 -0.13 0.00 0.00 -0.80 0.00 0.00 55.06 54.77 1hg0 s HIS 203 Cb -0.16 0.60 0.00 0.00 -1.43 0.00 0.00 32.58 31.59 1hg0 s HIS 203 CO 0.20 -0.60 0.00 0.25 -2.00 0.00 0.00 174.74 172.59 1hg0 n THR 204 N -0.48 0.00 0.27 -5.38 -2.24 0.56 -1.22 114.28 105.78 1hg0 n THR 204 Ca -0.07 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.86 1hg0 n THR 204 Cb 0.62 0.00 0.73 0.00 -2.10 0.00 0.00 70.33 69.57 1hg0 n THR 204 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1hg0 h THR 205 N 0.00 0.00 -0.37 4.28 1.35 -1.77 -1.96 112.91 114.44 1hg0 h THR 205 Ca 0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1hg0 h THR 205 Cb 0.00 0.83 0.00 0.00 -1.73 0.00 0.00 68.15 67.25 1hg0 h THR 205 CO 0.00 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.81 1hg0 n ARG 206 N -2.54 2.36 -3.26 4.72 5.12 -0.36 -4.98 116.66 117.71 1hg0 n ARG 206 Ca -0.01 -2.09 -0.36 0.00 -1.93 0.00 0.00 57.85 53.46 1hg0 n ARG 206 Cb 0.12 -1.39 -0.06 0.00 -1.16 0.00 0.00 32.46 29.97 1hg0 n ARG 206 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1hg0 s SER 207 N -1.14 6.96 0.04 0.55 0.15 -0.74 -4.68 113.70 114.85 1hg0 s SER 207 Ca 0.31 1.23 0.26 0.00 0.70 0.00 0.00 55.95 58.44 1hg0 s SER 207 Cb 0.17 -2.34 0.68 0.00 -1.71 0.00 0.00 66.02 62.82 1hg0 s SER 207 CO 0.24 0.13 1.55 1.33 1.20 0.00 0.00 173.24 177.69 1hg0 n VAL 208 N 1.03 0.12 -2.38 4.45 0.24 -1.26 -4.86 118.33 115.68 1hg0 n VAL 208 Ca -0.06 -0.08 -0.43 0.00 -2.04 0.00 0.00 64.34 61.73 1hg0 n VAL 208 Cb 0.51 -0.09 -0.02 0.00 -1.47 0.00 0.00 33.84 32.77 1hg0 n VAL 208 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1hg0 s PHE 209 N -3.04 2.65 -0.20 6.34 0.08 -1.26 -4.99 117.98 117.55 1hg0 s PHE 209 Ca 0.11 0.86 0.02 0.00 0.12 0.00 0.00 56.93 58.03 1hg0 s PHE 209 Cb 0.17 -3.79 0.03 0.00 -0.57 0.00 0.00 43.02 38.86 1hg0 s PHE 209 CO 0.65 -1.90 -0.16 0.34 -0.10 0.00 0.00 175.22 174.06 1hg0 s ASP 210 N 2.72 3.53 0.00 1.36 -1.08 -1.26 -4.56 116.67 117.38 1hg0 s ASP 210 Ca 0.58 -0.89 0.21 0.00 -0.52 0.00 0.00 52.55 51.93 1hg0 s ASP 210 Cb -0.19 -1.46 0.15 0.00 -1.46 0.00 0.00 42.92 39.96 1hg0 s ASP 210 CO 0.21 -0.08 1.15 1.33 0.52 0.00 0.00 175.17 178.30 1hg0 n VAL 211 N 4.58 0.00 -1.98 1.11 0.24 -1.26 -4.88 118.33 116.14 1hg0 n VAL 211 Ca -0.18 -0.48 -0.42 0.00 -2.04 0.00 0.00 64.34 61.22 1hg0 n VAL 211 Cb 0.47 1.42 -0.03 0.00 -1.47 0.00 0.00 33.84 34.23 1hg0 n VAL 211 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1hg0 s ARG 212 N -1.79 4.23 0.00 7.34 3.00 -1.26 -1.21 118.95 129.26 1hg0 s ARG 212 Ca 0.24 2.29 0.00 0.00 0.00 0.00 0.00 55.73 58.26 1hg0 s ARG 212 Cb 0.17 -3.30 0.00 0.00 0.00 0.00 0.00 34.95 31.82 1hg0 s ARG 212 CO 0.28 -0.61 0.00 0.41 0.00 0.00 0.00 175.30 175.38 1hg0 n GLY 213 N 3.77 3.46 3.80 -3.53 0.00 -1.26 -5.05 105.19 106.38 1hg0 n GLY 213 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 1hg0 n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hg0 s LEU 214 N 0.00 4.31 0.00 0.99 1.43 -0.35 -4.97 118.68 120.09 1hg0 s LEU 214 Ca 0.00 1.67 0.00 0.00 -1.03 0.00 0.00 54.13 54.77 1hg0 s LEU 214 Cb 0.00 -3.91 0.00 0.00 0.03 0.00 0.00 46.19 42.31 1hg0 s LEU 214 CO 0.00 -0.06 0.00 0.35 0.23 0.00 0.00 176.35 176.87 1hg0 n THR 215 N 0.51 0.00 -4.12 5.49 -2.24 -1.26 -5.00 114.28 107.65 1hg0 n THR 215 Ca 0.01 -0.13 -0.08 0.00 -2.27 0.00 0.00 64.05 61.58 1hg0 n THR 215 Cb 0.51 0.59 -0.10 0.00 -2.10 0.00 0.00 70.33 69.23 1hg0 n THR 215 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hg0 s SER 216 N -1.34 0.39 0.11 3.42 1.04 -1.26 -4.92 113.70 111.14 1hg0 s SER 216 Ca 0.00 -1.11 0.07 0.00 0.48 0.00 0.00 55.95 55.39 1hg0 s SER 216 Cb 0.00 0.25 -0.03 0.00 0.10 0.00 0.00 66.02 66.34 1hg0 s SER 216 CO 0.00 -0.67 -0.17 -0.76 0.98 0.00 0.00 173.24 172.62 1hg0 s LEU 217 N -2.99 2.33 0.45 2.42 1.43 -1.26 -5.11 118.68 115.95 1hg0 s LEU 217 Ca 0.16 -0.71 -0.25 0.00 -1.03 0.00 0.00 54.13 52.30 1hg0 s LEU 217 Cb 0.08 -0.71 -0.08 0.00 0.03 0.00 0.00 46.19 45.50 1hg0 s LEU 217 CO -0.04 -0.03 1.38 -2.84 0.23 0.00 0.00 176.35 175.05 1hg0 s PRO 218 N -2.13 3.72 -0.08 1.29 0.02 -1.26 -4.94 135.00 131.63 1hg0 s PRO 218 Ca 0.06 2.31 -0.30 0.00 0.02 0.00 0.00 61.00 63.09 1hg0 s PRO 218 Cb -0.08 -2.64 -0.02 0.00 0.02 0.00 0.00 34.50 31.77 1hg0 s PRO 218 CO 0.04 -0.75 1.14 0.21 -0.33 0.00 0.00 177.00 177.31 1hg0 s LYS 219 N -2.43 4.37 -0.05 5.54 2.20 -1.26 -4.87 119.74 123.24 1hg0 s LYS 219 Ca 0.61 1.58 -0.00 0.00 -0.36 0.00 0.00 55.97 57.79 1hg0 s LYS 219 Cb -0.41 -3.56 0.03 0.00 -1.51 0.00 0.00 37.83 32.38 1hg0 s LYS 219 CO 0.53 -0.41 -0.01 0.08 -0.36 0.00 0.00 175.35 175.18 1hg0 s VAL 220 N 2.19 0.32 0.33 4.02 1.01 -1.26 -0.58 120.40 126.43 1hg0 s VAL 220 Ca 0.53 0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.67 1hg0 s VAL 220 Cb -0.22 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1hg0 s VAL 220 CO 0.20 0.21 0.10 -1.81 0.00 0.00 0.00 175.10 173.81 1hg0 s ASP 221 N 1.44 4.58 -0.10 3.32 1.01 -1.09 -4.97 116.67 120.86 1hg0 s ASP 221 Ca -0.03 -0.79 0.04 0.00 0.71 0.00 0.00 52.55 52.47 1hg0 s ASP 221 Cb -0.13 -0.71 0.00 0.00 1.01 0.00 0.00 42.92 43.09 1hg0 s ASP 221 CO -0.03 -0.25 -0.22 -0.63 0.21 0.00 0.00 175.17 174.25 1hg0 s ILE 222 N -2.43 1.92 -0.04 0.77 1.01 -1.26 -0.46 121.20 120.71 1hg0 s ILE 222 Ca 0.36 -0.93 0.05 0.00 0.00 0.00 0.00 60.65 60.14 1hg0 s ILE 222 Cb -0.03 -1.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.75 1hg0 s ILE 222 CO 0.22 0.53 -0.20 -0.76 0.00 0.00 0.00 174.94 174.73 1hg0 s LEU 223 N 0.46 2.42 0.42 2.97 1.43 -0.55 -4.97 118.68 120.85 1hg0 s LEU 223 Ca -0.17 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.49 1hg0 s LEU 223 Cb -0.17 -1.46 -0.07 0.00 0.03 0.00 0.00 46.19 44.52 1hg0 s LEU 223 CO 0.07 0.32 0.79 -0.47 0.23 0.00 0.00 176.35 177.29 1hg0 s TYR 224 N -0.62 3.47 -0.13 0.29 5.04 -1.26 -1.19 117.35 122.95 1hg0 s TYR 224 Ca 0.09 1.09 0.01 0.00 -2.44 0.00 0.00 57.07 55.82 1hg0 s TYR 224 Cb -0.11 -2.48 -0.01 0.00 0.35 0.00 0.00 41.96 39.71 1hg0 s TYR 224 CO 0.00 -0.13 -0.15 0.20 -1.34 0.00 0.00 175.55 174.12 1hg0 s GLY 225 N -3.14 1.49 0.15 8.97 0.00 -0.41 -4.87 107.32 109.51 1hg0 s GLY 225 Ca 0.52 -0.93 -0.25 0.00 0.00 0.00 0.00 44.72 44.06 1hg0 s GLY 225 CO 0.31 -0.19 0.94 -2.52 0.00 0.00 0.00 173.10 171.64 1hg0 s TYR 226 N 0.41 -0.15 0.25 1.90 1.13 -1.26 -4.33 117.35 115.30 1hg0 s TYR 226 Ca -0.12 -0.15 -0.31 0.00 -1.41 0.00 0.00 57.07 55.08 1hg0 s TYR 226 Cb -0.16 0.64 -0.13 0.00 -1.10 0.00 0.00 41.96 41.21 1hg0 s TYR 226 CO 0.06 -0.83 1.51 1.04 -2.51 0.00 0.00 175.55 174.82 1hg0 n GLN 227 N -0.45 2.35 -1.68 -3.49 6.02 -1.26 -1.52 117.38 117.35 1hg0 n GLN 227 Ca -0.06 0.84 -0.13 0.00 -0.01 0.00 0.00 57.00 57.64 1hg0 n GLN 227 Cb 0.61 -2.56 -0.04 0.00 1.02 0.00 0.00 30.24 29.26 1hg0 n GLN 227 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1hg0 n ASP 228 N 2.38 -4.38 -4.75 1.08 8.00 -1.26 -4.96 116.55 112.66 1hg0 n ASP 228 Ca 0.11 0.20 -0.41 0.00 0.71 0.00 0.00 54.79 55.40 1hg0 n ASP 228 Cb 0.33 -3.22 -0.01 0.00 -0.02 0.00 0.00 41.12 38.20 1hg0 n ASP 228 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1hg0 s ASP 229 N -2.71 6.36 0.28 -2.24 -4.77 -0.57 -4.94 116.67 108.08 1hg0 s ASP 229 Ca 0.00 2.97 -0.29 0.00 -3.30 0.00 0.00 52.55 51.93 1hg0 s ASP 229 Cb 0.00 -2.64 -0.09 0.00 -1.09 0.00 0.00 42.92 39.10 1hg0 s ASP 229 CO 0.00 -0.92 1.04 -2.16 0.70 0.00 0.00 175.17 173.83 1hg0 s PRO 230 N -0.55 4.65 0.19 2.11 0.04 -1.26 -4.66 135.00 135.53 1hg0 s PRO 230 Ca 0.63 1.67 0.06 0.00 0.04 0.00 0.00 61.00 63.40 1hg0 s PRO 230 Cb -0.48 -3.14 0.08 0.00 0.04 0.00 0.00 34.50 31.00 1hg0 s PRO 230 CO 0.49 0.27 1.44 1.49 0.04 0.00 0.00 177.00 180.72 1hg0 h GLU 231 N 3.76 0.11 -0.01 4.56 4.81 -1.92 -3.25 114.58 122.63 1hg0 h GLU 231 Ca -0.46 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 1hg0 h GLU 231 Cb 1.21 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 1hg0 h GLU 231 CO 0.67 0.86 0.02 0.10 -0.73 0.00 0.00 179.01 179.92 1hg0 h TYR 232 N 0.07 0.00 -0.15 0.92 -0.00 -1.94 -0.68 116.97 115.19 1hg0 h TYR 232 Ca -0.02 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 58.62 1hg0 h TYR 232 Cb 1.41 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.12 1hg0 h TYR 232 CO 0.02 0.00 -0.28 -0.07 -0.00 0.00 0.00 178.16 177.83 1hg0 h LEU 233 N 0.00 0.28 -0.24 0.10 3.38 -1.99 -1.04 115.31 115.80 1hg0 h LEU 233 Ca 0.01 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.77 1hg0 h LEU 233 Cb 0.05 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1hg0 h LEU 233 CO -0.00 0.56 -0.30 1.88 0.09 0.00 0.00 178.44 180.67 1hg0 h TYR 234 N 0.25 0.77 -0.96 1.13 -1.99 -1.33 -2.40 116.97 112.43 1hg0 h TYR 234 Ca 0.04 -0.25 0.03 0.00 2.00 0.00 0.00 58.73 60.55 1hg0 h TYR 234 Cb 0.63 -0.16 -0.05 0.00 2.00 0.00 0.00 36.73 39.15 1hg0 h TYR 234 CO 0.01 0.98 0.63 -0.44 -0.00 0.00 0.00 178.16 179.35 1hg0 h ASP 235 N 0.34 1.07 -0.51 3.88 3.32 -1.33 -1.03 116.42 122.17 1hg0 h ASP 235 Ca 0.03 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1hg0 h ASP 235 Cb 0.88 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 1hg0 h ASP 235 CO 0.07 0.75 0.12 0.00 -1.72 0.00 0.00 179.24 178.47 1hg0 h ALA 236 N 1.38 0.67 -0.42 3.45 0.00 -1.12 -0.57 119.26 122.64 1hg0 h ALA 236 Ca 0.37 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1hg0 h ALA 236 Cb -0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1hg0 h ALA 236 CO -0.10 0.36 0.15 0.00 0.00 0.00 0.00 179.25 179.65 1hg0 h ALA 237 N 1.00 0.55 -0.24 0.00 0.00 -0.92 -2.14 119.26 117.51 1hg0 h ALA 237 Ca 0.16 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1hg0 h ALA 237 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1hg0 h ALA 237 CO 0.00 0.18 0.13 0.82 0.00 0.00 0.00 179.25 180.38 1hg0 h ILE 238 N 0.53 1.12 -0.05 0.00 2.04 -1.06 -2.46 117.51 117.63 1hg0 h ILE 238 Ca 0.14 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.69 1hg0 h ILE 238 Cb 0.23 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1hg0 h ILE 238 CO -0.01 0.12 0.04 1.56 0.00 0.00 0.00 178.15 179.86 1hg0 h GLN 239 N 0.28 0.00 -0.71 2.37 7.50 -0.95 -1.80 115.11 121.80 1hg0 h GLN 239 Ca 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.22 1hg0 h GLN 239 Cb 0.07 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.59 1hg0 h GLN 239 CO -0.01 0.00 0.02 0.72 -1.50 0.00 0.00 178.83 178.06 1hg0 n HIS 240 N -4.20 1.55 -2.94 2.96 8.25 -0.82 -4.95 115.22 115.07 1hg0 n HIS 240 Ca -0.02 -0.57 -0.17 0.00 -0.26 0.00 0.00 57.72 56.70 1hg0 n HIS 240 Cb 0.14 -0.42 0.03 0.00 1.12 0.00 0.00 29.99 30.86 1hg0 n HIS 240 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hg0 n GLY 241 N 0.40 -0.23 3.79 -1.41 0.00 -0.68 -5.01 105.19 102.04 1hg0 n GLY 241 Ca 0.21 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1hg0 n GLY 241 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hg0 s VAL 242 N -3.08 3.53 -0.10 1.61 -7.23 -1.14 -4.78 120.40 109.22 1hg0 s VAL 242 Ca 0.28 0.94 0.21 0.00 -1.81 0.00 0.00 61.98 61.60 1hg0 s VAL 242 Cb -0.12 -3.38 -0.26 0.00 0.56 0.00 0.00 36.38 33.18 1hg0 s VAL 242 CO 0.34 -0.22 0.49 0.29 -0.31 0.00 0.00 175.10 175.70 1hg0 n LYS 243 N -1.16 0.66 -3.77 4.82 4.76 0.25 -4.80 118.16 118.92 1hg0 n LYS 243 Ca 0.10 -0.08 -0.11 0.00 -2.87 0.00 0.00 58.31 55.35 1hg0 n LYS 243 Cb 0.52 -1.58 -0.07 0.00 -1.84 0.00 0.00 35.03 32.05 1hg0 n LYS 243 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1hg0 s GLY 244 N -4.73 -0.09 -0.09 0.72 0.00 -1.15 -1.39 107.32 100.59 1hg0 s GLY 244 Ca -0.07 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.59 1hg0 s GLY 244 CO 0.87 -0.27 -0.10 -0.42 0.00 0.00 0.00 173.10 173.18 1hg0 s ILE 245 N -2.61 1.07 -0.22 0.90 1.01 0.03 -2.67 121.20 118.71 1hg0 s ILE 245 Ca -0.05 -0.37 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1hg0 s ILE 245 Cb -0.01 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 41.38 1hg0 s ILE 245 CO -0.04 0.36 0.19 -0.69 0.00 0.00 0.00 174.94 174.77 1hg0 s VAL 246 N 1.26 5.35 -0.36 2.92 1.01 0.39 -0.80 120.40 130.16 1hg0 s VAL 246 Ca -0.03 0.28 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 1hg0 s VAL 246 Cb -0.14 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.73 1hg0 s VAL 246 CO -0.03 0.36 0.19 -0.47 0.00 0.00 0.00 175.10 175.15 1hg0 s TYR 247 N 0.88 3.24 -1.27 5.22 5.04 0.63 -1.48 117.35 129.60 1hg0 s TYR 247 Ca 0.10 -0.95 -0.17 0.00 -2.44 0.00 0.00 57.07 53.61 1hg0 s TYR 247 Cb -0.13 -2.42 0.10 0.00 0.35 0.00 0.00 41.96 39.87 1hg0 s TYR 247 CO 0.03 -0.63 1.63 0.00 -1.34 0.00 0.00 175.55 175.25 1hg0 s ALA 248 N 1.55 3.55 0.82 3.97 0.00 -0.34 0.29 121.76 131.61 1hg0 s ALA 248 Ca 0.02 -3.07 -0.12 0.00 0.00 0.00 0.00 51.96 48.79 1hg0 s ALA 248 Cb -0.19 -4.47 0.09 0.00 0.00 0.00 0.00 23.12 18.55 1hg0 s ALA 248 CO 0.06 -3.12 1.14 0.20 0.00 0.00 0.00 175.76 174.04 1hg0 s GLY 249 N 3.75 1.60 0.20 0.00 0.00 -0.97 -1.28 107.32 110.62 1hg0 s GLY 249 Ca 0.50 -0.50 -0.30 0.00 0.00 0.00 0.00 44.72 44.42 1hg0 s GLY 249 CO 0.05 -0.01 1.10 1.06 0.00 0.00 0.00 173.10 175.30 1hg0 s MET 250 N -5.39 4.60 4.50 2.90 -1.94 -1.23 0.04 119.30 122.78 1hg0 s MET 250 Ca 0.62 1.74 0.00 0.00 -1.71 0.00 0.00 55.69 56.34 1hg0 s MET 250 Cb -0.13 -3.26 0.00 0.00 2.01 0.00 0.00 34.83 33.45 1hg0 s MET 250 CO 0.52 0.10 0.00 0.41 -0.01 0.00 0.00 175.02 176.04 1hg0 n GLY 251 N 1.88 2.75 2.41 -0.03 0.00 -1.26 -0.65 105.19 110.29 1hg0 n GLY 251 Ca 0.02 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1hg0 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hg0 n ALA 252 N 8.72 7.15 -2.04 4.61 0.00 -1.26 -4.53 120.51 133.16 1hg0 n ALA 252 Ca 0.00 -3.71 -0.16 0.00 0.00 0.00 0.00 53.44 49.57 1hg0 n ALA 252 Cb 0.00 -3.25 -0.03 0.00 0.00 0.00 0.00 19.45 16.17 1hg0 n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hg0 n GLY 253 N 3.20 0.31 3.77 0.00 0.00 -1.11 -4.73 105.19 106.62 1hg0 n GLY 253 Ca 0.72 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 46.14 1hg0 n GLY 253 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hg0 s SER 254 N -2.44 6.12 0.04 1.61 0.01 0.18 -4.83 113.70 114.38 1hg0 s SER 254 Ca 0.00 2.49 0.07 0.00 1.31 0.00 0.00 55.95 59.83 1hg0 s SER 254 Cb 0.00 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 63.58 1hg0 s SER 254 CO 0.00 -0.97 -0.21 -0.69 0.41 0.00 0.00 173.24 171.78 1hg0 s VAL 255 N -1.40 1.69 0.79 3.43 1.01 -1.26 -3.56 120.40 121.10 1hg0 s VAL 255 Ca 0.62 -1.19 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1hg0 s VAL 255 Cb -0.34 -1.46 0.12 0.00 0.00 0.00 0.00 36.38 34.70 1hg0 s VAL 255 CO 0.42 0.23 1.10 -0.94 0.00 0.00 0.00 175.10 175.91 1hg0 s SER 256 N -1.13 4.18 0.49 3.32 1.04 -1.26 -4.84 113.70 115.51 1hg0 s SER 256 Ca 0.08 0.17 0.19 0.00 0.48 0.00 0.00 55.95 56.87 1hg0 s SER 256 Cb -0.09 -0.57 1.24 0.00 0.10 0.00 0.00 66.02 66.71 1hg0 s SER 256 CO 0.02 -2.01 2.07 -0.37 0.98 0.00 0.00 173.24 173.93 1hg0 h VAL 257 N -0.89 0.92 0.16 5.02 -1.51 -1.99 -0.72 116.25 117.24 1hg0 h VAL 257 Ca -0.42 -0.42 -0.31 0.00 -1.23 0.00 0.00 66.70 64.32 1hg0 h VAL 257 Cb 1.28 1.24 0.03 0.00 -2.13 0.00 0.00 31.29 31.70 1hg0 h VAL 257 CO 0.48 0.11 -1.31 0.03 -1.23 0.00 0.00 177.57 175.65 1hg0 h ARG 258 N 0.00 0.53 -0.32 5.19 3.08 -1.93 -2.89 114.38 118.05 1hg0 h ARG 258 Ca -0.00 -0.79 -0.11 0.00 0.07 0.00 0.00 59.98 59.15 1hg0 h ARG 258 Cb 0.23 0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 1hg0 h ARG 258 CO 0.02 1.36 -0.27 0.78 -1.07 0.00 0.00 179.97 180.79 1hg0 h GLY 259 N 0.51 0.69 0.95 0.04 0.00 -1.72 -1.81 103.07 101.73 1hg0 h GLY 259 Ca -0.20 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.51 1hg0 h GLY 259 CO 0.24 0.55 0.18 -2.22 0.00 0.00 0.00 176.54 175.29 1hg0 h ILE 260 N 0.55 1.19 -0.79 2.60 2.04 -1.20 0.17 117.51 122.09 1hg0 h ILE 260 Ca 0.07 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 1hg0 h ILE 260 Cb 0.75 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 1hg0 h ILE 260 CO 0.06 0.22 0.42 0.00 0.00 0.00 0.00 178.15 178.85 1hg0 h ALA 261 N 1.02 1.26 -0.18 1.87 0.00 -1.36 -0.67 119.26 121.20 1hg0 h ALA 261 Ca 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1hg0 h ALA 261 Cb 0.17 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1hg0 h ALA 261 CO -0.01 0.59 0.03 0.78 0.00 0.00 0.00 179.25 180.64 1hg0 h GLY 262 N 1.13 0.31 1.52 0.00 0.00 -0.75 -2.35 103.07 102.93 1hg0 h GLY 262 Ca 0.28 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 1hg0 h GLY 262 CO -0.04 0.19 0.08 -0.33 0.00 0.00 0.00 176.54 176.43 1hg0 h MET 263 N 0.08 0.61 -0.21 4.80 2.07 -0.29 -1.80 114.93 120.19 1hg0 h MET 263 Ca 0.05 -0.11 -0.11 0.00 -2.07 0.00 0.00 59.70 57.46 1hg0 h MET 263 Cb 0.30 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 29.91 1hg0 h MET 263 CO 0.00 0.58 -0.33 0.00 1.07 0.00 0.00 176.91 178.23 1hg0 h ARG 264 N 0.60 0.44 -0.42 1.72 3.08 -1.02 -0.15 114.38 118.63 1hg0 h ARG 264 Ca 0.13 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 1hg0 h ARG 264 Cb 0.26 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1hg0 h ARG 264 CO 0.00 0.72 -0.04 0.87 -1.07 0.00 0.00 179.97 180.46 1hg0 h LYS 265 N 0.38 0.77 0.03 0.04 1.57 -0.95 -1.12 116.57 117.29 1hg0 h LYS 265 Ca 0.05 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1hg0 h LYS 265 Cb 0.77 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1hg0 h LYS 265 CO 0.06 0.86 -0.10 0.00 -0.57 0.00 0.00 179.45 179.70 1hg0 h ALA 266 N 0.88 -0.13 -0.60 3.86 0.00 -0.98 -1.81 119.26 120.47 1hg0 h ALA 266 Ca 0.11 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1hg0 h ALA 266 Cb 0.54 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1hg0 h ALA 266 CO 0.03 -0.60 0.34 -0.07 0.00 0.00 0.00 179.25 178.94 1hg0 h LEU 267 N -0.19 0.75 -2.23 0.00 3.38 -0.96 -0.49 115.31 115.57 1hg0 h LEU 267 Ca 0.03 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1hg0 h LEU 267 Cb 0.22 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1hg0 h LEU 267 CO -0.08 0.62 -0.04 -0.08 0.09 0.00 0.00 178.44 178.95 1hg0 h GLU 268 N 0.82 0.00 -0.64 1.13 4.81 -1.00 -1.62 114.58 118.08 1hg0 h GLU 268 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1hg0 h GLU 268 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1hg0 h GLU 268 CO -0.04 0.04 0.00 1.63 -0.73 0.00 0.00 179.01 179.91 1hg0 n LYS 269 N -3.96 3.26 -0.74 1.92 4.76 -0.66 -4.93 118.16 117.82 1hg0 n LYS 269 Ca -0.03 -2.45 0.00 0.00 -2.87 0.00 0.00 58.31 52.96 1hg0 n LYS 269 Cb 0.12 -1.78 0.00 0.00 -1.84 0.00 0.00 35.03 31.54 1hg0 n LYS 269 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hg0 n GLY 270 N 1.09 0.72 3.77 0.72 0.00 -0.61 -5.04 105.19 105.85 1hg0 n GLY 270 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 1hg0 n GLY 270 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hg0 s VAL 271 N -2.57 4.61 -0.14 1.61 1.01 -0.28 -4.97 120.40 119.66 1hg0 s VAL 271 Ca 0.00 1.53 -0.24 0.00 0.00 0.00 0.00 61.98 63.27 1hg0 s VAL 271 Cb 0.00 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1hg0 s VAL 271 CO 0.00 0.48 0.75 -0.69 0.00 0.00 0.00 175.10 175.64 1hg0 s VAL 272 N -0.73 4.96 -0.20 2.92 1.01 -0.49 -3.93 120.40 123.94 1hg0 s VAL 272 Ca 0.34 1.49 -0.07 0.00 0.00 0.00 0.00 61.98 63.74 1hg0 s VAL 272 Cb -0.21 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 1hg0 s VAL 272 CO 0.23 0.11 0.07 -0.69 0.00 0.00 0.00 175.10 174.81 1hg0 s VAL 273 N 1.69 4.68 -0.19 2.92 1.01 -1.26 -0.79 120.40 128.46 1hg0 s VAL 273 Ca 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1hg0 s VAL 273 Cb -0.17 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.10 1hg0 s VAL 273 CO 0.14 0.43 -0.18 -0.32 0.00 0.00 0.00 175.10 175.17 1hg0 s MET 274 N 0.69 3.01 -0.39 2.72 -2.45 0.02 -0.85 119.30 122.05 1hg0 s MET 274 Ca 0.03 -0.83 -0.19 0.00 -1.25 0.00 0.00 55.69 53.46 1hg0 s MET 274 Cb -0.13 -2.64 0.01 0.00 1.25 0.00 0.00 34.83 33.32 1hg0 s MET 274 CO 0.02 -0.22 0.53 1.03 1.05 0.00 0.00 175.02 177.43 1hg0 s ARG 275 N 1.31 3.42 0.00 4.11 0.52 0.66 -0.27 118.95 128.70 1hg0 s ARG 275 Ca 0.05 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 54.92 1hg0 s ARG 275 Cb -0.13 -3.88 0.00 0.00 0.52 0.00 0.00 34.95 31.46 1hg0 s ARG 275 CO -0.12 -0.78 0.00 0.45 0.02 0.00 0.00 175.30 174.87 1hg0 n SER 276 N 5.85 0.78 -3.98 0.23 2.88 0.15 -1.95 113.62 117.58 1hg0 n SER 276 Ca -0.04 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.39 1hg0 n SER 276 Cb 0.48 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.83 1hg0 n SER 276 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1hg0 s THR 277 N 1.75 0.20 -0.96 2.46 -1.32 -1.25 -2.28 115.64 114.23 1hg0 s THR 277 Ca 0.00 -0.82 0.24 0.00 -1.21 0.00 0.00 61.69 59.90 1hg0 s THR 277 Cb 0.00 -0.31 -0.03 0.00 -1.51 0.00 0.00 72.50 70.65 1hg0 s THR 277 CO 0.00 -0.40 1.32 -2.11 -2.21 0.00 0.00 174.62 171.22 1hg0 n ARG 278 N 1.78 0.03 -0.35 7.08 1.85 0.11 -4.33 116.66 122.83 1hg0 n ARG 278 Ca -0.22 0.00 0.02 0.00 -1.00 0.00 0.00 57.85 56.65 1hg0 n ARG 278 Cb 0.56 -1.51 0.18 0.00 -1.05 0.00 0.00 32.46 30.63 1hg0 n ARG 278 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1hg0 h THR 279 N 0.00 1.12 0.00 8.89 1.35 -1.85 -3.47 112.91 118.95 1hg0 h THR 279 Ca 0.00 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1hg0 h THR 279 Cb 0.53 -0.16 0.00 0.00 -1.73 0.00 0.00 68.15 66.79 1hg0 h THR 279 CO 0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 1hg0 n GLY 280 N -1.38 1.59 3.38 5.82 0.00 -1.26 -5.09 105.19 108.25 1hg0 n GLY 280 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 1hg0 n GLY 280 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hg0 s ASN 281 N -1.47 -0.04 0.00 1.61 0.01 -1.26 -4.97 114.94 108.82 1hg0 s ASN 281 Ca 0.00 -0.75 0.00 0.00 -0.71 0.00 0.00 52.86 51.40 1hg0 s ASN 281 Cb 0.00 0.47 0.00 0.00 0.41 0.00 0.00 41.25 42.13 1hg0 s ASN 281 CO 0.00 -0.93 0.00 0.61 -1.51 0.00 0.00 177.10 175.27 1hg0 n GLY 282 N -0.24 -3.99 3.69 0.66 0.00 -1.26 -4.99 105.19 99.06 1hg0 n GLY 282 Ca -0.08 -2.05 -0.36 0.00 0.00 0.00 0.00 46.02 43.53 1hg0 n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hg0 s ILE 283 N -0.92 5.34 -0.44 -0.61 -1.09 -1.26 -4.06 121.20 118.16 1hg0 s ILE 283 Ca 0.00 0.17 -0.17 0.00 -2.23 0.00 0.00 60.65 58.42 1hg0 s ILE 283 Cb 0.00 -3.46 0.04 0.00 -1.58 0.00 0.00 42.46 37.46 1hg0 s ILE 283 CO 0.00 0.40 0.47 -0.69 -1.23 0.00 0.00 174.94 173.89 1hg0 s VAL 284 N 0.64 5.07 0.57 2.92 1.01 -0.62 -4.92 120.40 125.07 1hg0 s VAL 284 Ca 0.07 -0.48 -0.15 0.00 0.00 0.00 0.00 61.98 61.42 1hg0 s VAL 284 Cb -0.12 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1hg0 s VAL 284 CO 0.01 -0.52 1.02 -2.16 0.00 0.00 0.00 175.10 173.45 1hg0 s PRO 285 N 2.16 3.60 0.51 2.72 0.04 -1.26 -3.74 135.00 139.02 1hg0 s PRO 285 Ca 0.11 1.03 -0.23 0.00 0.04 0.00 0.00 61.00 61.95 1hg0 s PRO 285 Cb -0.18 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.21 1hg0 s PRO 285 CO 0.12 -0.57 1.39 -2.14 0.04 0.00 0.00 177.00 175.85 1hg0 s PRO 286 N -4.24 3.36 -0.26 0.56 0.02 -1.26 -4.94 135.00 128.24 1hg0 s PRO 286 Ca 0.60 2.32 -0.02 0.00 0.02 0.00 0.00 61.00 63.92 1hg0 s PRO 286 Cb -0.13 -2.42 0.12 0.00 0.02 0.00 0.00 34.50 32.09 1hg0 s PRO 286 CO 0.37 -1.04 0.27 0.34 -0.33 0.00 0.00 177.00 176.61 1hg0 s ASP 287 N -0.76 1.64 0.49 2.53 -1.08 -1.26 -5.02 116.67 113.21 1hg0 s ASP 287 Ca 0.67 -0.58 0.30 0.00 -0.52 0.00 0.00 52.55 52.42 1hg0 s ASP 287 Cb -0.42 0.45 1.63 0.00 -1.46 0.00 0.00 42.92 43.11 1hg0 s ASP 287 CO 0.51 -0.37 1.90 1.05 0.52 0.00 0.00 175.17 178.79 1hg0 h GLU 288 N 8.28 0.00 0.00 4.34 9.09 -1.98 -1.94 114.58 132.38 1hg0 h GLU 288 Ca -0.15 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.26 1hg0 h GLU 288 Cb 1.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.20 1hg0 h GLU 288 CO 0.32 0.00 -0.75 0.39 0.05 0.00 0.00 179.01 179.02 1hg0 n GLU 289 N -2.60 0.26 -4.15 1.06 1.02 -1.26 -4.91 120.64 110.06 1hg0 n GLU 289 Ca -0.02 0.05 -0.31 0.00 -0.02 0.00 0.00 57.16 56.86 1hg0 n GLU 289 Cb 0.12 -1.64 -0.08 0.00 -0.02 0.00 0.00 31.44 29.83 1hg0 n GLU 289 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1hg0 s LEU 290 N -4.01 3.55 0.81 -4.62 1.43 -0.73 -5.12 118.68 109.99 1hg0 s LEU 290 Ca 0.06 -0.10 -0.11 0.00 -1.03 0.00 0.00 54.13 52.94 1hg0 s LEU 290 Cb 0.14 -2.22 0.08 0.00 0.03 0.00 0.00 46.19 44.22 1hg0 s LEU 290 CO 0.75 0.20 1.10 -2.16 0.23 0.00 0.00 176.35 176.46 1hg0 s PRO 291 N -2.15 1.97 0.00 1.29 0.04 -1.26 -4.88 135.00 130.00 1hg0 s PRO 291 Ca 0.25 0.68 0.00 0.00 0.04 0.00 0.00 61.00 61.97 1hg0 s PRO 291 Cb -0.12 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1hg0 s PRO 291 CO 0.17 -1.71 0.00 0.41 0.04 0.00 0.00 177.00 175.91 1hg0 n GLY 292 N -1.94 -1.49 4.00 0.56 0.00 -1.26 -4.90 105.19 100.16 1hg0 n GLY 292 Ca 0.07 -1.54 -0.19 0.00 0.00 0.00 0.00 46.02 44.36 1hg0 n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hg0 s LEU 293 N -3.32 3.47 0.09 0.99 1.43 -0.03 -4.91 118.68 116.41 1hg0 s LEU 293 Ca 0.00 -0.36 0.08 0.00 -1.03 0.00 0.00 54.13 52.82 1hg0 s LEU 293 Cb 0.00 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.60 1hg0 s LEU 293 CO 0.00 -0.97 -0.14 0.68 0.23 0.00 0.00 176.35 176.15 1hg0 s VAL 294 N -2.52 3.11 -2.06 -1.59 -7.23 -1.26 -0.24 120.40 108.61 1hg0 s VAL 294 Ca 0.57 -1.32 0.14 0.00 -1.81 0.00 0.00 61.98 59.56 1hg0 s VAL 294 Cb -0.09 -2.42 0.38 0.00 0.56 0.00 0.00 36.38 34.80 1hg0 s VAL 294 CO 0.35 0.15 1.34 -1.54 -0.31 0.00 0.00 175.10 175.10 1hg0 n SER 295 N 0.90 2.13 0.00 4.85 3.41 -0.82 -4.84 113.62 119.24 1hg0 n SER 295 Ca -0.15 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.51 1hg0 n SER 295 Cb 0.52 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1hg0 n SER 295 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1hg0 n ASP 296 N 0.65 0.00 -1.53 4.04 -0.08 -1.25 -1.30 116.55 117.08 1hg0 n ASP 296 Ca 0.14 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.51 1hg0 n ASP 296 Cb 0.35 0.00 0.35 0.00 2.34 0.00 0.00 41.12 44.16 1hg0 n ASP 296 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1hg0 n SER 297 N 4.87 4.72 -4.70 1.67 3.41 -1.26 -1.58 113.62 120.75 1hg0 n SER 297 Ca 0.00 -2.48 -0.42 0.00 -0.26 0.00 0.00 58.87 55.70 1hg0 n SER 297 Cb 0.00 -0.57 -0.03 0.00 -0.26 0.00 0.00 64.21 63.35 1hg0 n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1hg0 s LEU 298 N -1.91 4.30 0.85 1.04 2.01 -0.42 -4.76 118.68 119.79 1hg0 s LEU 298 Ca 0.50 1.63 -0.12 0.00 0.01 0.00 0.00 54.13 56.15 1hg0 s LEU 298 Cb 0.33 -3.56 0.10 0.00 0.01 0.00 0.00 46.19 43.07 1hg0 s LEU 298 CO 0.23 -0.40 1.13 0.54 1.01 0.00 0.00 176.35 178.86 1hg0 s ASN 299 N 1.10 4.08 0.27 2.29 2.20 -1.26 -4.62 114.94 119.00 1hg0 s ASN 299 Ca 0.51 1.02 0.00 0.00 -0.94 0.00 0.00 52.86 53.45 1hg0 s ASN 299 Cb -0.20 -1.63 0.63 0.00 -2.00 0.00 0.00 41.25 38.05 1hg0 s ASN 299 CO 0.22 -2.20 1.68 -0.65 -2.94 0.00 0.00 177.10 173.21 1hg0 h PRO 300 N -1.25 0.30 -0.28 3.55 0.11 -1.94 0.20 132.00 132.69 1hg0 h PRO 300 Ca -0.48 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.57 1hg0 h PRO 300 Cb 1.31 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1hg0 h PRO 300 CO 0.62 0.20 0.04 0.00 -0.21 0.00 0.00 178.00 178.65 1hg0 h ALA 301 N 1.70 0.37 -0.34 -0.75 0.00 -1.96 -1.41 119.26 116.86 1hg0 h ALA 301 Ca 0.51 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 55.12 1hg0 h ALA 301 Cb 0.95 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1hg0 h ALA 301 CO -0.55 0.06 -0.20 0.45 0.00 0.00 0.00 179.25 179.01 1hg0 h HIS 302 N 0.27 0.86 -0.86 0.00 3.86 -1.75 -3.03 115.15 114.50 1hg0 h HIS 302 Ca 0.08 -0.22 0.05 0.00 -1.16 0.00 0.00 60.37 59.12 1hg0 h HIS 302 Cb 0.34 -0.19 -0.05 0.00 1.06 0.00 0.00 27.41 28.57 1hg0 h HIS 302 CO 0.02 0.95 0.56 0.00 0.86 0.00 0.00 177.93 180.33 1hg0 h ALA 303 N 0.77 1.52 -0.64 2.45 0.00 -0.56 -1.80 119.26 121.01 1hg0 h ALA 303 Ca 0.07 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1hg0 h ALA 303 Cb 0.74 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1hg0 h ALA 303 CO 0.06 0.37 0.17 -0.09 0.00 0.00 0.00 179.25 179.75 1hg0 h ARG 304 N 1.00 1.02 0.28 0.00 2.43 -1.17 -0.86 114.38 117.09 1hg0 h ARG 304 Ca 0.36 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1hg0 h ARG 304 Cb 0.14 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1hg0 h ARG 304 CO -0.12 0.91 -0.14 0.82 -1.51 0.00 0.00 179.97 179.94 1hg0 h ILE 305 N 0.94 0.73 -0.85 1.20 1.08 -1.24 -1.55 117.51 117.82 1hg0 h ILE 305 Ca 0.20 -0.02 -0.00 0.00 -0.39 0.00 0.00 64.86 64.65 1hg0 h ILE 305 Cb 0.35 0.74 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 1hg0 h ILE 305 CO 0.00 0.00 0.52 0.25 -0.69 0.00 0.00 178.15 178.23 1hg0 h LEU 306 N -0.39 1.02 -0.74 1.44 5.85 -1.28 -2.28 115.31 118.93 1hg0 h LEU 306 Ca -0.04 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 1hg0 h LEU 306 Cb 0.30 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1hg0 h LEU 306 CO 0.06 0.78 0.31 0.25 -0.34 0.00 0.00 178.44 179.51 1hg0 h LEU 307 N 1.17 1.01 -0.39 2.25 5.85 -1.03 0.12 115.31 124.30 1hg0 h LEU 307 Ca 0.31 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1hg0 h LEU 307 Cb -0.05 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.70 1hg0 h LEU 307 CO -0.06 0.90 0.25 0.24 -0.34 0.00 0.00 178.44 179.43 1hg0 h MET 308 N 1.06 0.52 -0.47 1.25 2.86 -0.92 -1.66 114.93 117.58 1hg0 h MET 308 Ca 0.25 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.72 1hg0 h MET 308 Cb 0.19 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1hg0 h MET 308 CO -0.02 0.36 -0.22 -0.07 1.06 0.00 0.00 176.91 178.02 1hg0 h LEU 309 N 0.52 0.97 -1.08 1.22 3.38 -1.14 -2.98 115.31 116.21 1hg0 h LEU 309 Ca 0.14 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.77 1hg0 h LEU 309 Cb -0.04 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.39 1hg0 h LEU 309 CO -0.03 1.15 0.62 0.00 0.09 0.00 0.00 178.44 180.27 1hg0 h ALA 310 N 0.92 1.37 0.00 1.53 0.00 -0.51 -1.90 119.26 120.67 1hg0 h ALA 310 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1hg0 h ALA 310 Cb 0.78 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1hg0 h ALA 310 CO 0.06 0.56 0.00 1.28 0.00 0.00 0.00 179.25 181.15 1hg0 n LEU 311 N -4.42 0.12 -0.10 0.00 4.77 -0.65 -1.69 117.00 115.03 1hg0 n LEU 311 Ca 0.12 0.53 0.13 0.00 -0.03 0.00 0.00 56.01 56.76 1hg0 n LEU 311 Cb 0.06 -0.51 0.50 0.00 -2.33 0.00 0.00 43.42 41.14 1hg0 n LEU 311 CO 0.36 -0.28 0.76 0.35 -1.33 0.00 0.00 177.39 177.25 1hg0 n THR 312 N -1.63 0.00 -0.01 -5.08 -2.24 -0.71 -4.14 114.28 100.47 1hg0 n THR 312 Ca 0.04 -0.05 -0.01 0.00 -2.27 0.00 0.00 64.05 61.75 1hg0 n THR 312 Cb 0.20 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.42 1hg0 n THR 312 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hg0 n ARG 313 N -1.07 3.40 -3.80 -0.78 1.74 -0.76 -5.12 116.66 110.26 1hg0 n ARG 313 Ca 0.11 -0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.14 1hg0 n ARG 313 Cb 0.31 -1.06 -0.01 0.00 -1.02 0.00 0.00 32.46 30.68 1hg0 n ARG 313 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1hg0 s THR 314 N -2.06 0.00 -0.01 0.55 -1.32 -0.68 -5.01 115.64 107.10 1hg0 s THR 314 Ca -0.01 -0.79 0.01 0.00 -1.21 0.00 0.00 61.69 59.69 1hg0 s THR 314 Cb 0.01 -2.13 0.02 0.00 -1.51 0.00 0.00 72.50 68.89 1hg0 s THR 314 CO 0.09 0.00 0.74 -1.54 -2.21 0.00 0.00 174.62 171.71 1hg0 n SER 315 N -0.59 0.70 -4.60 8.08 3.41 -1.26 -4.06 113.62 115.29 1hg0 n SER 315 Ca -0.05 -1.54 -0.43 0.00 -0.26 0.00 0.00 58.87 56.59 1hg0 n SER 315 Cb 0.60 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.48 1hg0 n SER 315 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hg0 s ASP 316 N -0.59 6.60 0.32 4.04 -1.08 -1.26 -4.91 116.67 119.78 1hg0 s ASP 316 Ca 0.02 0.57 0.05 0.00 -0.52 0.00 0.00 52.55 52.66 1hg0 s ASP 316 Cb 0.02 -2.55 0.67 0.00 -1.46 0.00 0.00 42.92 39.60 1hg0 s ASP 316 CO 0.00 -1.27 1.85 1.55 0.52 0.00 0.00 175.17 177.83 1hg0 h PRO 317 N 9.42 0.84 -0.64 4.34 0.13 -1.98 -1.29 132.00 142.81 1hg0 h PRO 317 Ca -0.24 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 64.87 1hg0 h PRO 317 Cb 1.07 -0.19 -0.04 0.00 0.13 0.00 0.00 31.00 31.97 1hg0 h PRO 317 CO 1.12 0.55 0.40 0.87 -0.23 0.00 0.00 178.00 180.71 1hg0 h LYS 318 N 0.86 0.77 -0.24 0.86 1.79 -1.99 0.24 116.57 118.86 1hg0 h LYS 318 Ca 0.47 -0.05 -0.13 0.00 -2.18 0.00 0.00 60.65 58.77 1hg0 h LYS 318 Cb 0.58 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1hg0 h LYS 318 CO -0.24 0.51 -0.36 0.28 -1.08 0.00 0.00 179.45 178.56 1hg0 h VAL 319 N 0.79 1.31 -0.73 0.50 2.07 -1.78 -2.71 116.25 115.70 1hg0 h VAL 319 Ca 0.26 -1.56 -0.06 0.00 0.82 0.00 0.00 66.70 66.16 1hg0 h VAL 319 Cb 0.01 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1hg0 h VAL 319 CO -0.10 0.49 0.22 0.40 0.02 0.00 0.00 177.57 178.61 1hg0 h ILE 320 N 0.37 1.26 -0.62 4.57 2.04 -1.06 -1.74 117.51 122.33 1hg0 h ILE 320 Ca 0.02 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 64.94 1hg0 h ILE 320 Cb 0.95 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1hg0 h ILE 320 CO 0.08 0.35 0.21 -0.61 0.00 0.00 0.00 178.15 178.19 1hg0 h GLN 321 N 1.08 0.93 -0.33 2.37 5.75 -0.94 -2.17 115.11 121.80 1hg0 h GLN 321 Ca 0.24 -0.17 -0.10 0.00 -0.15 0.00 0.00 58.65 58.47 1hg0 h GLN 321 Cb 0.30 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1hg0 h GLN 321 CO -0.01 0.78 -0.21 1.49 -2.65 0.00 0.00 178.83 178.24 1hg0 h GLU 322 N 0.90 0.63 -0.39 1.69 4.57 -1.10 -2.78 114.58 118.11 1hg0 h GLU 322 Ca 0.21 -0.23 0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1hg0 h GLU 322 Cb 0.23 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.74 1hg0 h GLU 322 CO -0.01 0.79 0.16 1.88 -1.18 0.00 0.00 179.01 180.65 1hg0 h TYR 323 N 0.56 0.29 0.00 0.92 0.05 -0.71 -1.98 116.97 116.11 1hg0 h TYR 323 Ca 0.09 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.88 1hg0 h TYR 323 Cb 0.66 -0.07 -0.00 0.00 1.01 0.00 0.00 36.73 38.33 1hg0 h TYR 323 CO 0.03 0.14 -0.02 0.74 -1.05 0.00 0.00 178.16 177.99 1hg0 h PHE 324 N 0.34 0.00 -0.00 4.88 -1.00 -1.19 0.30 116.94 120.27 1hg0 h PHE 324 Ca 0.17 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.95 1hg0 h PHE 324 Cb 0.12 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.68 1hg0 h PHE 324 CO -0.13 0.02 -0.67 0.72 -1.61 0.00 0.00 178.31 176.64 1hg0 n HIS 325 N -3.39 0.00 0.00 -0.55 8.25 -0.78 -4.46 115.22 114.30 1hg0 n HIS 325 Ca -0.02 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.44 1hg0 n HIS 325 Cb 0.12 -0.15 -0.01 0.00 1.12 0.00 0.00 29.99 31.06 1hg0 n HIS 325 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1hg0 n THR 326 N -1.46 0.00 0.67 1.59 -2.24 -0.67 -5.06 114.28 107.11 1hg0 n THR 326 Ca 0.05 -0.06 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1hg0 n THR 326 Cb 0.34 0.48 0.07 0.00 -2.10 0.00 0.00 70.33 69.11 1hg0 n THR 326 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28