#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hg1 s PRO 5 N 0.00 2.81 -0.45 3.23 0.04 -1.26 -4.48 135.00 134.89 1hg1 s PRO 5 Ca 0.00 1.50 -0.20 0.00 0.04 0.00 0.00 61.00 62.33 1hg1 s PRO 5 Cb 0.00 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.63 1hg1 s PRO 5 CO 0.00 -1.26 0.63 -0.80 0.04 0.00 0.00 177.00 175.61 1hg1 s ASN 6 N -2.33 6.30 -0.14 6.66 -0.87 -1.26 -0.47 114.94 122.83 1hg1 s ASN 6 Ca 0.69 -0.46 -0.00 0.00 -1.57 0.00 0.00 52.86 51.52 1hg1 s ASN 6 Cb -0.23 -2.31 -0.01 0.00 -0.02 0.00 0.00 41.25 38.68 1hg1 s ASN 6 CO 0.39 -0.79 -0.14 -0.63 -2.57 0.00 0.00 177.10 173.36 1hg1 s ILE 7 N 2.76 2.93 -0.24 0.60 -1.09 -0.69 -0.73 121.20 124.74 1hg1 s ILE 7 Ca 0.21 -0.69 -0.11 0.00 -2.23 0.00 0.00 60.65 57.82 1hg1 s ILE 7 Cb -0.15 -2.23 -0.05 0.00 -1.58 0.00 0.00 42.46 38.45 1hg1 s ILE 7 CO 0.17 0.52 0.17 -0.69 -1.23 0.00 0.00 174.94 173.88 1hg1 s VAL 8 N 0.51 5.35 -0.35 2.92 1.01 -0.89 -2.07 120.40 126.88 1hg1 s VAL 8 Ca -0.09 0.21 -0.13 0.00 0.00 0.00 0.00 61.98 61.97 1hg1 s VAL 8 Cb -0.16 -3.51 -0.00 0.00 0.00 0.00 0.00 36.38 32.71 1hg1 s VAL 8 CO 0.04 0.34 0.24 -0.63 0.00 0.00 0.00 175.10 175.09 1hg1 s ILE 9 N 1.04 5.12 -0.28 2.22 1.01 -0.10 -1.65 121.20 128.55 1hg1 s ILE 9 Ca 0.08 -0.39 -0.10 0.00 0.00 0.00 0.00 60.65 60.24 1hg1 s ILE 9 Cb -0.13 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1hg1 s ILE 9 CO 0.04 -0.08 0.17 -0.76 0.00 0.00 0.00 174.94 174.31 1hg1 s LEU 10 N 1.68 3.95 -0.07 2.97 1.43 0.48 -1.06 118.68 128.07 1hg1 s LEU 10 Ca 0.05 -0.10 -0.12 0.00 -1.03 0.00 0.00 54.13 52.93 1hg1 s LEU 10 Cb -0.18 -2.08 -0.05 0.00 0.03 0.00 0.00 46.19 43.91 1hg1 s LEU 10 CO 0.09 -0.07 0.30 0.00 0.23 0.00 0.00 176.35 176.90 1hg1 s ALA 11 N 1.72 3.74 0.00 4.21 0.00 -0.22 -1.27 121.76 129.95 1hg1 s ALA 11 Ca 0.07 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.63 1hg1 s ALA 11 Cb -0.16 -2.24 0.00 0.00 0.00 0.00 0.00 23.12 20.72 1hg1 s ALA 11 CO 0.09 0.47 0.00 0.25 0.00 0.00 0.00 175.76 176.57 1hg1 n THR 12 N 2.16 0.00 0.00 0.00 -2.24 -0.96 -1.03 114.28 112.21 1hg1 n THR 12 Ca -0.16 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1hg1 n THR 12 Cb 0.53 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 1hg1 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hg1 n GLY 13 N 2.11 0.87 0.00 3.38 0.00 -1.23 -1.54 105.19 108.77 1hg1 n GLY 13 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.04 1hg1 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hg1 n GLY 14 N -0.09 3.30 0.34 -0.02 0.00 -1.25 -3.31 105.19 104.15 1hg1 n GLY 14 Ca 0.00 -1.89 0.23 0.00 0.00 0.00 0.00 46.02 44.35 1hg1 n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hg1 h THR 15 N 0.00 0.01 0.00 2.61 2.02 -1.83 -2.56 112.91 113.17 1hg1 h THR 15 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1hg1 h THR 15 Cb 0.00 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 1hg1 h THR 15 CO 0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1hg1 n ILE 16 N -3.10 1.20 -2.00 3.11 3.06 -1.26 -2.43 119.36 117.93 1hg1 n ILE 16 Ca -0.03 0.62 0.00 0.00 -2.50 0.00 0.00 62.75 60.84 1hg1 n ILE 16 Cb 0.08 -1.61 0.00 0.00 0.54 0.00 0.00 39.64 38.65 1hg1 n ILE 16 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1hg1 n ALA 17 N -1.72 0.00 -0.67 1.51 0.00 -0.97 -4.58 120.51 114.09 1hg1 n ALA 17 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1hg1 n ALA 17 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1hg1 n ALA 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hg1 n GLY 35 N 0.84 -0.08 0.22 0.00 0.00 -1.26 -4.93 105.19 99.99 1hg1 n GLY 35 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1hg1 n GLY 35 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1hg1 h VAL 36 N 0.00 1.22 -0.17 1.61 3.04 -1.97 -1.09 116.25 118.88 1hg1 h VAL 36 Ca 0.00 -1.00 -0.18 0.00 -1.01 0.00 0.00 66.70 64.51 1hg1 h VAL 36 Cb 0.00 1.37 -0.00 0.00 -2.01 0.00 0.00 31.29 30.65 1hg1 h VAL 36 CO 0.00 0.30 -0.62 0.44 -1.01 0.00 0.00 177.57 176.68 1hg1 h ASP 37 N 0.19 0.68 -0.61 3.17 3.32 -1.97 -0.93 116.42 120.27 1hg1 h ASP 37 Ca 0.03 -0.39 -0.05 0.00 0.02 0.00 0.00 57.03 56.64 1hg1 h ASP 37 Cb 0.50 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1hg1 h ASP 37 CO 0.03 1.14 0.19 0.74 -1.72 0.00 0.00 179.24 179.62 1hg1 h THR 38 N 0.45 1.24 -0.57 0.35 2.02 -1.87 0.71 112.91 115.24 1hg1 h THR 38 Ca -0.01 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.33 1hg1 h THR 38 Cb 1.19 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1hg1 h THR 38 CO 0.12 0.32 0.32 0.25 0.37 0.00 0.00 175.52 176.90 1hg1 h LEU 39 N 0.88 0.70 -0.12 2.58 7.12 -1.00 0.74 115.31 126.21 1hg1 h LEU 39 Ca 0.20 -0.08 -0.03 0.00 0.13 0.00 0.00 57.88 58.10 1hg1 h LEU 39 Cb 0.29 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 40.24 1hg1 h LEU 39 CO -0.01 0.58 -0.05 0.40 -0.13 0.00 0.00 178.44 179.23 1hg1 h ILE 40 N 0.76 1.31 0.00 4.05 2.04 -0.79 -2.75 117.51 122.13 1hg1 h ILE 40 Ca 0.20 -1.04 -0.04 0.00 1.00 0.00 0.00 64.86 64.97 1hg1 h ILE 40 Cb 0.02 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1hg1 h ILE 40 CO -0.03 0.30 -0.21 0.78 0.00 0.00 0.00 178.15 178.99 1hg1 h ASN 41 N -0.10 0.00 0.24 1.72 2.35 -0.78 -2.34 115.58 116.67 1hg1 h ASN 41 Ca 0.03 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 1hg1 h ASN 41 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1hg1 h ASN 41 CO 0.02 0.21 -0.36 0.00 -1.65 0.00 0.00 177.43 175.64 1hg1 h ALA 42 N 1.79 1.22 -2.13 -0.83 0.00 -0.66 -3.30 119.26 115.35 1hg1 h ALA 42 Ca -0.00 -0.37 -0.59 0.00 0.00 0.00 0.00 54.91 53.95 1hg1 h ALA 42 Cb 0.50 -0.08 -0.41 0.00 0.00 0.00 0.00 17.79 17.80 1hg1 h ALA 42 CO 0.03 0.53 -0.75 1.55 0.00 0.00 0.00 179.25 180.61 1hg1 n VAL 43 N -4.07 1.45 0.22 0.00 3.14 -0.89 -4.93 118.33 113.25 1hg1 n VAL 43 Ca -0.01 -4.86 0.18 0.00 -2.96 0.00 0.00 64.34 56.68 1hg1 n VAL 43 Cb 0.43 -2.04 0.85 0.00 -1.06 0.00 0.00 33.84 32.02 1hg1 n VAL 43 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 1hg1 h PRO 44 N 4.10 0.00 -0.02 1.45 0.13 -1.62 -2.20 132.00 133.84 1hg1 h PRO 44 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1hg1 h PRO 44 Cb 0.73 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 1hg1 h PRO 44 CO 0.72 0.00 0.21 0.93 -0.23 0.00 0.00 178.00 179.63 1hg1 h GLU 45 N 0.00 0.00 -0.46 0.86 3.07 -1.92 -1.50 114.58 114.64 1hg1 h GLU 45 Ca 0.08 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.83 1hg1 h GLU 45 Cb 0.59 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.49 1hg1 h GLU 45 CO -0.00 0.00 -0.17 0.28 -1.40 0.00 0.00 179.01 177.72 1hg1 h VAL 46 N 0.00 1.27 0.00 3.13 2.07 -1.74 -2.86 116.25 118.12 1hg1 h VAL 46 Ca 0.01 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1hg1 h VAL 46 Cb 0.43 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1hg1 h VAL 46 CO -0.00 0.44 0.00 0.29 0.02 0.00 0.00 177.57 178.32 1hg1 n LYS 47 N -4.13 0.29 -0.00 1.57 5.02 -0.56 -0.54 118.16 119.81 1hg1 n LYS 47 Ca 0.01 0.03 0.10 0.00 -2.02 0.00 0.00 58.31 56.42 1hg1 n LYS 47 Cb 0.42 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.81 1hg1 n LYS 47 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1hg1 n LYS 48 N -1.04 0.07 -0.01 1.97 4.81 -1.08 -4.19 118.16 118.70 1hg1 n LYS 48 Ca 0.07 -0.01 0.09 0.00 -0.87 0.00 0.00 58.31 57.59 1hg1 n LYS 48 Cb 0.04 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 33.45 1hg1 n LYS 48 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1hg1 n LEU 49 N -1.53 0.08 -3.73 3.14 4.77 0.30 -5.06 117.00 114.97 1hg1 n LEU 49 Ca 0.04 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1hg1 n LEU 49 Cb 0.34 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1hg1 n LEU 49 CO 0.43 0.02 0.97 0.00 -1.33 0.00 0.00 177.39 177.47 1hg1 s ALA 50 N -3.23 -2.07 -0.56 -1.18 0.00 -1.02 -4.41 121.76 109.29 1hg1 s ALA 50 Ca -0.06 0.35 -0.20 0.00 0.00 0.00 0.00 51.96 52.06 1hg1 s ALA 50 Cb 0.12 0.55 0.07 0.00 0.00 0.00 0.00 23.12 23.86 1hg1 s ALA 50 CO 0.77 -1.07 0.71 -0.80 0.00 0.00 0.00 175.76 175.37 1hg1 s ASN 51 N -3.15 6.21 0.05 0.00 0.01 0.38 -4.28 114.94 114.16 1hg1 s ASN 51 Ca 0.17 -1.06 -0.10 0.00 -0.71 0.00 0.00 52.86 51.16 1hg1 s ASN 51 Cb 0.02 -2.32 -0.06 0.00 0.41 0.00 0.00 41.25 39.30 1hg1 s ASN 51 CO -0.01 -1.06 0.37 -0.69 -1.51 0.00 0.00 177.10 174.21 1hg1 s VAL 52 N 2.91 5.13 -0.06 1.60 1.01 -1.26 -1.70 120.40 128.03 1hg1 s VAL 52 Ca 0.16 0.44 -0.00 0.00 0.00 0.00 0.00 61.98 62.58 1hg1 s VAL 52 Cb -0.20 -3.63 0.03 0.00 0.00 0.00 0.00 36.38 32.57 1hg1 s VAL 52 CO 0.10 0.35 -0.02 -0.54 0.00 0.00 0.00 175.10 174.99 1hg1 s LYS 53 N -1.76 0.69 0.21 2.72 1.02 -0.88 -4.99 119.74 116.75 1hg1 s LYS 53 Ca 0.30 0.02 -0.06 0.00 0.02 0.00 0.00 55.97 56.25 1hg1 s LYS 53 Cb -0.14 -0.90 -0.06 0.00 -0.52 0.00 0.00 37.83 36.21 1hg1 s LYS 53 CO 0.17 -0.21 0.48 0.20 -0.92 0.00 0.00 175.35 175.07 1hg1 s GLY 54 N 1.49 2.14 -0.14 -3.33 0.00 -1.26 -0.92 107.32 105.30 1hg1 s GLY 54 Ca -0.02 -0.47 -0.06 0.00 0.00 0.00 0.00 44.72 44.17 1hg1 s GLY 54 CO -0.03 -0.36 0.30 1.85 0.00 0.00 0.00 173.10 174.85 1hg1 s GLU 55 N -2.95 0.21 -1.01 2.90 2.12 -0.22 -4.92 118.70 114.83 1hg1 s GLU 55 Ca 0.44 0.73 -0.17 0.00 0.36 0.00 0.00 54.97 56.33 1hg1 s GLU 55 Cb -0.11 -0.01 0.15 0.00 0.26 0.00 0.00 34.13 34.42 1hg1 s GLU 55 CO 0.25 -0.23 1.19 -1.14 -0.54 0.00 0.00 175.26 174.79 1hg1 s GLN 56 N 2.00 3.76 0.16 4.30 2.00 -1.26 -1.05 119.66 129.57 1hg1 s GLN 56 Ca -0.03 -2.09 -0.14 0.00 -2.00 0.00 0.00 55.36 51.09 1hg1 s GLN 56 Cb -0.11 -4.92 0.05 0.00 0.80 0.00 0.00 33.01 28.83 1hg1 s GLN 56 CO -0.10 -1.72 1.76 0.35 -0.50 0.00 0.00 175.29 175.09 1hg1 h PHE 57 N 8.21 0.70 -2.42 1.67 3.57 -1.43 -3.48 116.94 123.76 1hg1 h PHE 57 Ca 0.20 -0.02 0.17 0.00 3.53 0.00 0.00 57.97 61.85 1hg1 h PHE 57 Cb 0.98 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 1hg1 h PHE 57 CO 1.13 0.52 0.52 -1.54 -2.23 0.00 0.00 178.31 176.71 1hg1 s SER 58 N -5.82 -0.10 -0.31 0.41 1.04 -0.75 -5.00 113.70 103.18 1hg1 s SER 58 Ca -0.13 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.76 1hg1 s SER 58 Cb 0.12 0.51 0.14 0.00 0.10 0.00 0.00 66.02 66.88 1hg1 s SER 58 CO 0.76 -0.97 0.31 0.21 0.98 0.00 0.00 173.24 174.53 1hg1 s ASN 59 N -3.12 1.64 0.03 7.02 3.84 -1.07 -3.34 114.94 119.94 1hg1 s ASN 59 Ca 0.16 -0.95 -0.27 0.00 0.21 0.00 0.00 52.86 52.01 1hg1 s ASN 59 Cb -0.02 0.48 0.07 0.00 -0.55 0.00 0.00 41.25 41.23 1hg1 s ASN 59 CO 0.04 -0.37 0.64 0.00 -2.79 0.00 0.00 177.10 174.62 1hg1 s MET 60 N 2.16 1.13 0.34 0.43 0.23 -0.59 -4.94 119.30 118.06 1hg1 s MET 60 Ca 0.11 -0.03 -0.29 0.00 -1.03 0.00 0.00 55.69 54.45 1hg1 s MET 60 Cb -0.14 0.53 -0.11 0.00 -1.53 0.00 0.00 34.83 33.58 1hg1 s MET 60 CO -0.27 -0.41 1.37 0.00 -2.03 0.00 0.00 175.02 173.68 1hg1 s ALA 61 N -2.16 3.53 0.62 3.16 0.00 -1.26 -3.87 121.76 121.78 1hg1 s ALA 61 Ca -0.06 1.37 0.32 0.00 0.00 0.00 0.00 51.96 53.59 1hg1 s ALA 61 Cb -0.00 -3.53 1.82 0.00 0.00 0.00 0.00 23.12 21.41 1hg1 s ALA 61 CO 0.01 -0.79 2.12 0.66 0.00 0.00 0.00 175.76 177.76 1hg1 h SER 62 N 3.30 0.00 0.54 0.00 4.64 -1.92 0.45 113.55 120.56 1hg1 h SER 62 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1hg1 h SER 62 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1hg1 h SER 62 CO 0.65 0.00 0.00 -1.84 -0.87 0.00 0.00 176.83 174.77 1hg1 n GLU 63 N -3.44 0.16 -0.12 4.77 0.00 -1.26 -1.49 120.64 119.26 1hg1 n GLU 63 Ca -0.00 0.46 0.09 0.00 0.00 0.00 0.00 57.16 57.71 1hg1 n GLU 63 Cb 0.29 -1.85 0.15 0.00 0.00 0.00 0.00 31.44 30.03 1hg1 n GLU 63 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1hg1 n ASN 64 N -2.17 2.94 -4.72 -1.84 3.02 0.15 -4.96 115.26 107.68 1hg1 n ASN 64 Ca 0.01 -1.86 -0.42 0.00 -0.03 0.00 0.00 54.58 52.28 1hg1 n ASN 64 Cb 0.18 -0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.16 1hg1 n ASN 64 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1hg1 s MET 65 N -1.29 4.28 0.22 3.52 1.75 -0.55 -5.00 119.30 122.22 1hg1 s MET 65 Ca 0.28 2.21 0.10 0.00 -1.25 0.00 0.00 55.69 57.04 1hg1 s MET 65 Cb 0.17 -3.19 -0.04 0.00 2.84 0.00 0.00 34.83 34.61 1hg1 s MET 65 CO 0.24 -0.48 -0.14 0.95 -0.65 0.00 0.00 175.02 174.94 1hg1 s THR 66 N 0.86 2.84 0.25 10.11 -4.23 -1.26 -5.02 115.64 119.19 1hg1 s THR 66 Ca 0.65 -1.96 -0.03 0.00 -1.18 0.00 0.00 61.69 59.16 1hg1 s THR 66 Cb -0.40 -2.43 0.22 0.00 1.34 0.00 0.00 72.50 71.22 1hg1 s THR 66 CO 0.33 -0.21 1.75 1.23 -0.54 0.00 0.00 174.62 177.18 1hg1 h GLY 67 N 2.70 1.22 1.29 3.99 0.00 -1.98 0.14 103.07 110.43 1hg1 h GLY 67 Ca -0.45 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1hg1 h GLY 67 CO 0.55 -0.04 0.45 -0.55 0.00 0.00 0.00 176.54 176.95 1hg1 h ASP 68 N 0.56 0.83 0.13 0.19 3.32 -1.96 0.29 116.42 119.77 1hg1 h ASP 68 Ca 0.42 -0.03 -0.24 0.00 0.02 0.00 0.00 57.03 57.20 1hg1 h ASP 68 Cb 0.58 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.93 1hg1 h ASP 68 CO -0.35 0.62 -0.95 0.58 -1.72 0.00 0.00 179.24 177.41 1hg1 h VAL 69 N 0.97 1.33 -0.38 -1.35 2.07 -1.48 -2.58 116.25 114.82 1hg1 h VAL 69 Ca 0.26 -2.28 -0.09 0.00 0.82 0.00 0.00 66.70 65.40 1hg1 h VAL 69 Cb -0.08 2.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 1hg1 h VAL 69 CO -0.05 0.70 -0.15 0.58 0.02 0.00 0.00 177.57 178.67 1hg1 h VAL 70 N 0.34 1.26 -0.19 2.57 2.07 -0.34 -0.75 116.25 121.21 1hg1 h VAL 70 Ca -0.09 -1.19 0.01 0.00 0.82 0.00 0.00 66.70 66.25 1hg1 h VAL 70 Cb 1.59 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 1hg1 h VAL 70 CO 0.18 0.40 0.11 0.25 0.02 0.00 0.00 177.57 178.53 1hg1 h LEU 71 N 0.63 0.18 -1.18 2.57 5.85 -0.39 -0.24 115.31 122.73 1hg1 h LEU 71 Ca 0.10 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.75 1hg1 h LEU 71 Cb 0.61 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1hg1 h LEU 71 CO 0.04 0.14 -0.18 0.11 -0.34 0.00 0.00 178.44 178.21 1hg1 h LYS 72 N 0.23 0.36 -0.44 1.25 1.57 -1.18 -1.71 116.57 116.66 1hg1 h LYS 72 Ca 0.07 -0.10 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1hg1 h LYS 72 Cb -0.01 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1hg1 h LYS 72 CO -0.03 0.53 0.07 1.25 -0.57 0.00 0.00 179.45 180.70 1hg1 h LEU 73 N 0.33 0.69 -0.52 2.94 5.85 -0.53 -0.62 115.31 123.45 1hg1 h LEU 73 Ca 0.06 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.52 1hg1 h LEU 73 Cb 0.50 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1hg1 h LEU 73 CO 0.03 0.77 0.33 -1.28 -0.34 0.00 0.00 178.44 177.96 1hg1 h SER 74 N 0.58 0.61 -0.72 1.25 0.87 -0.64 -0.26 113.55 115.25 1hg1 h SER 74 Ca 0.13 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 1hg1 h SER 74 Cb 0.37 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 1hg1 h SER 74 CO 0.01 0.47 0.21 1.56 -0.53 0.00 0.00 176.83 178.54 1hg1 h GLN 75 N 0.71 1.12 -0.44 2.24 4.20 -1.10 -1.26 115.11 120.58 1hg1 h GLN 75 Ca 0.19 -0.25 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 1hg1 h GLN 75 Cb -0.05 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.55 1hg1 h GLN 75 CO -0.04 0.97 0.07 -0.09 -0.67 0.00 0.00 178.83 179.07 1hg1 h ARG 76 N 1.07 0.74 -0.83 1.46 9.65 -0.76 -1.47 114.38 124.24 1hg1 h ARG 76 Ca 0.23 -0.20 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 1hg1 h ARG 76 Cb 0.32 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.78 1hg1 h ARG 76 CO -0.00 0.76 0.40 0.28 2.80 0.00 0.00 179.97 184.21 1hg1 h VAL 77 N 0.60 1.25 -0.32 0.20 2.07 -0.78 0.11 116.25 119.37 1hg1 h VAL 77 Ca 0.13 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1hg1 h VAL 77 Cb 0.39 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1hg1 h VAL 77 CO 0.01 0.31 0.14 0.78 0.02 0.00 0.00 177.57 178.82 1hg1 h ASN 78 N 1.18 0.44 -0.30 0.57 2.35 -1.04 0.31 115.58 119.09 1hg1 h ASN 78 Ca 0.29 -0.15 0.05 0.00 -0.55 0.00 0.00 56.30 55.94 1hg1 h ASN 78 Cb 0.11 -0.11 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 1hg1 h ASN 78 CO -0.04 0.47 -0.00 -0.08 -1.65 0.00 0.00 177.43 176.13 1hg1 h GLU 79 N 0.38 0.08 -0.30 0.81 4.81 -0.70 -1.65 114.58 118.02 1hg1 h GLU 79 Ca 0.11 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1hg1 h GLU 79 Cb 0.16 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1hg1 h GLU 79 CO -0.01 0.06 0.14 1.25 -0.73 0.00 0.00 179.01 179.72 1hg1 h LEU 80 N 0.09 0.39 -1.14 1.64 5.85 -0.54 -3.01 115.31 118.58 1hg1 h LEU 80 Ca 0.14 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1hg1 h LEU 80 Cb 0.19 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1hg1 h LEU 80 CO -0.24 0.41 0.00 -0.07 -0.34 0.00 0.00 178.44 178.19 1hg1 h LEU 81 N 0.35 0.00 -0.39 2.25 3.38 -0.64 -2.63 115.31 117.63 1hg1 h LEU 81 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1hg1 h LEU 81 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1hg1 h LEU 81 CO -0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.52 1hg1 n ALA 82 N -1.96 1.96 -1.79 1.53 0.00 -0.65 -4.78 120.51 114.83 1hg1 n ALA 82 Ca 0.01 0.04 -0.40 0.00 0.00 0.00 0.00 53.44 53.09 1hg1 n ALA 82 Cb 0.28 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 1hg1 n ALA 82 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1hg1 s ARG 83 N -3.23 4.85 0.42 0.00 0.52 -0.99 -4.95 118.95 115.57 1hg1 s ARG 83 Ca 0.07 1.49 0.22 0.00 -0.52 0.00 0.00 55.73 56.99 1hg1 s ARG 83 Cb 0.11 -3.29 0.90 0.00 0.52 0.00 0.00 34.95 33.19 1hg1 s ARG 83 CO 0.50 0.50 1.83 -0.44 0.02 0.00 0.00 175.30 177.71 1hg1 h ASP 84 N 4.25 0.00 -0.16 0.23 5.19 -1.88 -2.95 116.42 121.09 1hg1 h ASP 84 Ca -0.45 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 1hg1 h ASP 84 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 1hg1 h ASP 84 CO 0.68 0.28 0.00 -0.90 -3.12 0.00 0.00 179.24 176.18 1hg1 n ASP 85 N -3.54 0.90 -4.04 6.45 5.75 -1.26 -4.72 116.55 116.10 1hg1 n ASP 85 Ca -0.00 -1.95 -0.31 0.00 -0.01 0.00 0.00 54.79 52.52 1hg1 n ASP 85 Cb 0.43 -0.11 -0.16 0.00 -1.03 0.00 0.00 41.12 40.25 1hg1 n ASP 85 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1hg1 s VAL 86 N -1.79 1.66 -0.13 2.12 1.01 -1.12 -4.75 120.40 117.40 1hg1 s VAL 86 Ca 0.14 -0.69 0.22 0.00 0.00 0.00 0.00 61.98 61.64 1hg1 s VAL 86 Cb 0.07 -1.55 -0.17 0.00 0.00 0.00 0.00 36.38 34.73 1hg1 s VAL 86 CO 0.10 0.47 0.74 0.47 0.00 0.00 0.00 175.10 176.87 1hg1 n ASP 87 N 4.74 0.43 -3.67 3.32 8.00 0.09 -4.83 116.55 124.63 1hg1 n ASP 87 Ca -0.18 0.17 0.02 0.00 0.71 0.00 0.00 54.79 55.51 1hg1 n ASP 87 Cb 0.50 1.16 0.00 0.00 -0.02 0.00 0.00 41.12 42.76 1hg1 n ASP 87 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1hg1 s GLY 88 N -4.50 -0.32 0.02 0.44 0.00 -1.17 -4.15 107.32 97.63 1hg1 s GLY 88 Ca -0.04 0.48 0.02 0.00 0.00 0.00 0.00 44.72 45.18 1hg1 s GLY 88 CO 0.85 1.94 -0.06 0.14 0.00 0.00 0.00 173.10 175.97 1hg1 s VAL 89 N -2.26 0.43 -0.11 1.40 1.01 -0.35 -2.10 120.40 118.42 1hg1 s VAL 89 Ca 0.19 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.54 1hg1 s VAL 89 Cb 0.03 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.98 1hg1 s VAL 89 CO -0.03 -0.16 -0.19 -0.69 0.00 0.00 0.00 175.10 174.03 1hg1 s VAL 90 N -0.79 1.78 -0.22 2.92 1.01 -0.66 -0.81 120.40 123.63 1hg1 s VAL 90 Ca -0.05 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 1hg1 s VAL 90 Cb -0.06 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1hg1 s VAL 90 CO 0.00 0.50 -0.10 -0.63 0.00 0.00 0.00 175.10 174.87 1hg1 s ILE 91 N 0.77 2.69 0.10 2.22 1.01 0.25 -0.39 121.20 127.85 1hg1 s ILE 91 Ca -0.10 -0.94 -0.27 0.00 0.00 0.00 0.00 60.65 59.33 1hg1 s ILE 91 Cb -0.16 -2.29 -0.06 0.00 0.01 0.00 0.00 42.46 39.96 1hg1 s ILE 91 CO 0.01 0.32 0.86 0.42 0.00 0.00 0.00 174.94 176.55 1hg1 s THR 92 N 1.33 4.55 0.13 2.92 -4.23 -0.39 -0.71 115.64 119.23 1hg1 s THR 92 Ca 0.02 1.85 -0.13 0.00 -1.18 0.00 0.00 61.69 62.25 1hg1 s THR 92 Cb -0.15 -4.22 0.02 0.00 1.34 0.00 0.00 72.50 69.49 1hg1 s THR 92 CO -0.07 0.37 0.34 -2.28 -0.54 0.00 0.00 174.62 172.45 1hg1 s HIS 93 N -0.24 -0.01 0.57 3.99 5.04 -0.46 -2.26 115.29 121.91 1hg1 s HIS 93 Ca 0.42 -0.34 -0.17 0.00 -1.54 0.00 0.00 55.06 53.42 1hg1 s HIS 93 Cb -0.22 0.14 -0.05 0.00 0.04 0.00 0.00 32.58 32.50 1hg1 s HIS 93 CO 0.27 -0.69 1.06 0.20 -2.34 0.00 0.00 174.74 173.24 1hg1 s GLY 94 N -2.85 2.24 0.29 1.59 0.00 -1.22 -4.31 107.32 103.05 1hg1 s GLY 94 Ca 0.06 0.47 0.12 0.00 0.00 0.00 0.00 44.72 45.37 1hg1 s GLY 94 CO -0.09 0.79 1.64 -0.91 0.00 0.00 0.00 173.10 174.53 1hg1 h THR 95 N 0.70 1.36 -0.57 0.90 1.35 -1.94 -3.12 112.91 111.59 1hg1 h THR 95 Ca -0.48 -2.01 0.08 0.00 -0.55 0.00 0.00 66.41 63.46 1hg1 h THR 95 Cb 1.22 2.10 -0.06 0.00 -1.73 0.00 0.00 68.15 69.68 1hg1 h THR 95 CO 0.58 0.56 0.22 0.44 -0.25 0.00 0.00 175.52 177.08 1hg1 h ASP 96 N 0.00 0.24 0.00 5.36 3.32 -1.93 -3.20 116.42 120.21 1hg1 h ASP 96 Ca -0.01 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1hg1 h ASP 96 Cb 1.05 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1hg1 h ASP 96 CO 0.07 0.16 -0.05 0.35 -1.72 0.00 0.00 179.24 178.05 1hg1 n THR 97 N -4.98 1.65 0.08 0.35 -2.24 -1.26 -4.76 114.28 103.14 1hg1 n THR 97 Ca 0.07 -1.98 0.04 0.00 -2.27 0.00 0.00 64.05 59.92 1hg1 n THR 97 Cb 0.24 -0.13 0.45 0.00 -2.10 0.00 0.00 70.33 68.79 1hg1 n THR 97 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1hg1 h VAL 98 N 0.76 1.11 0.00 2.28 3.04 -1.54 -1.49 116.25 120.41 1hg1 h VAL 98 Ca 0.00 -0.33 -0.04 0.00 -1.01 0.00 0.00 66.70 65.32 1hg1 h VAL 98 Cb 1.03 0.81 -0.01 0.00 -2.01 0.00 0.00 31.29 31.11 1hg1 h VAL 98 CO 0.00 0.12 -0.18 1.05 -1.01 0.00 0.00 177.57 177.55 1hg1 h GLU 99 N 0.36 0.00 -0.00 4.17 4.11 -1.85 0.11 114.58 121.47 1hg1 h GLU 99 Ca 0.09 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.50 1hg1 h GLU 99 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1hg1 h GLU 99 CO -0.01 0.18 -0.07 0.93 0.07 0.00 0.00 179.01 180.12 1hg1 h GLU 100 N 0.00 0.05 -0.43 1.06 5.08 -1.63 -2.54 114.58 116.17 1hg1 h GLU 100 Ca -0.00 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1hg1 h GLU 100 Cb 0.33 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1hg1 h GLU 100 CO 0.02 0.79 0.15 0.77 -1.00 0.00 0.00 179.01 179.74 1hg1 h SER 101 N -0.67 0.62 -0.56 1.42 0.02 -1.22 -1.97 113.55 111.19 1hg1 h SER 101 Ca -0.01 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.73 1hg1 h SER 101 Cb 0.81 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 1hg1 h SER 101 CO 0.01 0.65 0.28 0.00 -1.14 0.00 0.00 176.83 176.63 1hg1 h ALA 102 N 1.00 0.72 -0.31 3.77 0.00 -0.89 -2.27 119.26 121.27 1hg1 h ALA 102 Ca 0.14 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1hg1 h ALA 102 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1hg1 h ALA 102 CO -0.01 0.27 -0.17 -0.92 0.00 0.00 0.00 179.25 178.43 1hg1 h TYR 103 N 0.75 0.62 0.26 0.00 3.20 -1.35 0.34 116.97 120.79 1hg1 h TYR 103 Ca 0.19 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1hg1 h TYR 103 Cb 0.10 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 1hg1 h TYR 103 CO -0.01 0.70 -0.16 0.35 -1.64 0.00 0.00 178.16 177.41 1hg1 h PHE 104 N 0.51 -0.42 0.00 -3.82 3.04 -1.05 -2.01 116.94 113.19 1hg1 h PHE 104 Ca 0.09 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.00 1hg1 h PHE 104 Cb 0.59 0.15 -0.01 0.00 2.56 0.00 0.00 35.95 39.24 1hg1 h PHE 104 CO 0.02 -0.25 -0.17 -0.07 -2.02 0.00 0.00 178.31 175.82 1hg1 h LEU 105 N -0.41 0.00 -1.34 0.59 4.07 -1.17 -1.92 115.31 115.13 1hg1 h LEU 105 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1hg1 h LEU 105 Cb 0.34 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.05 1hg1 h LEU 105 CO 0.02 0.17 0.34 -0.74 -1.08 0.00 0.00 178.44 177.15 1hg1 h HIS 106 N 0.00 0.76 0.00 1.13 2.76 -0.22 -0.11 115.15 119.46 1hg1 h HIS 106 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1hg1 h HIS 106 Cb 0.47 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.18 1hg1 h HIS 106 CO 0.00 0.51 -1.08 1.28 -1.30 0.00 0.00 177.93 177.34 1hg1 n LEU 107 N -4.41 0.72 -0.00 0.26 4.77 -0.79 -0.79 117.00 116.75 1hg1 n LEU 107 Ca 0.05 0.25 0.03 0.00 -0.03 0.00 0.00 56.01 56.31 1hg1 n LEU 107 Cb 0.08 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.06 1hg1 n LEU 107 CO 0.37 -0.13 -0.21 0.35 -1.33 0.00 0.00 177.39 176.44 1hg1 n THR 108 N -2.50 0.00 -2.81 -5.08 -2.24 -0.79 -4.15 114.28 96.70 1hg1 n THR 108 Ca 0.00 -0.28 -0.43 0.00 -2.27 0.00 0.00 64.05 61.07 1hg1 n THR 108 Cb 0.53 0.78 -0.04 0.00 -2.10 0.00 0.00 70.33 69.50 1hg1 n THR 108 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1hg1 s VAL 109 N -1.85 4.45 -1.28 2.28 1.01 -0.08 -4.76 120.40 120.17 1hg1 s VAL 109 Ca 0.01 0.73 -0.09 0.00 0.00 0.00 0.00 61.98 62.62 1hg1 s VAL 109 Cb 0.04 -4.45 0.16 0.00 0.00 0.00 0.00 36.38 32.14 1hg1 s VAL 109 CO 0.24 -0.86 1.89 0.29 0.00 0.00 0.00 175.10 176.65 1hg1 n LYS 110 N 7.22 3.61 -3.52 2.72 5.02 -1.26 -3.93 118.16 128.03 1hg1 n LYS 110 Ca 0.06 -3.51 -0.17 0.00 -2.02 0.00 0.00 58.31 52.67 1hg1 n LYS 110 Cb 0.48 -2.93 -0.06 0.00 -0.02 0.00 0.00 35.03 32.51 1hg1 n LYS 110 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1hg1 s SER 111 N 0.88 -0.64 0.00 4.39 0.15 -1.26 -4.80 113.70 112.42 1hg1 s SER 111 Ca 0.40 0.65 0.25 0.00 0.70 0.00 0.00 55.95 57.94 1hg1 s SER 111 Cb 0.10 0.53 0.42 0.00 -1.71 0.00 0.00 66.02 65.36 1hg1 s SER 111 CO 0.00 -0.62 1.36 0.47 1.20 0.00 0.00 173.24 175.65 1hg1 n ASP 112 N 0.81 1.56 -4.77 5.45 8.00 -1.26 -4.32 116.55 122.02 1hg1 n ASP 112 Ca -0.18 -1.24 -0.39 0.00 0.71 0.00 0.00 54.79 53.69 1hg1 n ASP 112 Cb 0.58 0.27 -0.01 0.00 -0.02 0.00 0.00 41.12 41.94 1hg1 n ASP 112 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1hg1 s LYS 113 N -2.45 3.99 0.26 -1.24 1.02 -1.26 -0.97 119.74 119.10 1hg1 s LYS 113 Ca 0.23 2.05 -0.31 0.00 0.02 0.00 0.00 55.97 57.96 1hg1 s LYS 113 Cb 0.19 -2.73 -0.12 0.00 -0.52 0.00 0.00 37.83 34.65 1hg1 s LYS 113 CO 0.52 -0.44 1.65 -2.14 -0.92 0.00 0.00 175.35 174.03 1hg1 s PRO 114 N -2.25 4.11 -0.25 -1.68 0.02 -1.26 -4.85 135.00 128.83 1hg1 s PRO 114 Ca 0.57 2.61 0.02 0.00 0.02 0.00 0.00 61.00 64.22 1hg1 s PRO 114 Cb -0.36 -3.04 0.06 0.00 0.02 0.00 0.00 34.50 31.19 1hg1 s PRO 114 CO 0.45 -0.69 -0.06 0.08 -0.33 0.00 0.00 177.00 176.45 1hg1 s VAL 115 N 0.44 1.75 -0.22 3.83 1.01 -1.26 -1.21 120.40 124.75 1hg1 s VAL 115 Ca 0.68 -1.45 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1hg1 s VAL 115 Cb -0.49 -2.01 0.04 0.00 0.00 0.00 0.00 36.38 33.92 1hg1 s VAL 115 CO 0.42 -0.14 -0.15 -0.69 0.00 0.00 0.00 175.10 174.54 1hg1 s VAL 116 N 1.28 2.21 0.27 2.92 1.01 0.01 -1.97 120.40 126.12 1hg1 s VAL 116 Ca -0.05 -1.22 -0.22 0.00 0.00 0.00 0.00 61.98 60.49 1hg1 s VAL 116 Cb -0.19 -2.10 -0.09 0.00 0.00 0.00 0.00 36.38 34.00 1hg1 s VAL 116 CO -0.07 0.27 0.82 -0.36 0.00 0.00 0.00 175.10 175.77 1hg1 s PHE 117 N 1.22 3.67 0.03 5.22 0.40 0.39 -0.58 117.98 128.32 1hg1 s PHE 117 Ca -0.01 1.56 0.01 0.00 -0.60 0.00 0.00 56.93 57.89 1hg1 s PHE 117 Cb -0.16 -2.75 -0.02 0.00 0.51 0.00 0.00 43.02 40.59 1hg1 s PHE 117 CO -0.09 0.28 -0.04 0.54 0.70 0.00 0.00 175.22 176.61 1hg1 s VAL 118 N -1.57 0.23 0.32 -0.44 0.11 0.11 -0.72 120.40 118.45 1hg1 s VAL 118 Ca 0.46 -0.97 -0.06 0.00 -2.93 0.00 0.00 61.98 58.48 1hg1 s VAL 118 Cb -0.17 -0.37 0.03 0.00 -1.53 0.00 0.00 36.38 34.33 1hg1 s VAL 118 CO 0.22 -0.47 0.53 0.00 -3.33 0.00 0.00 175.10 172.05 1hg1 n ALA 119 N 1.54 -0.82 -3.50 1.54 0.00 -1.26 -1.36 120.51 116.65 1hg1 n ALA 119 Ca -0.24 -1.27 -0.12 0.00 0.00 0.00 0.00 53.44 51.82 1hg1 n ALA 119 Cb 0.55 1.02 -0.12 0.00 0.00 0.00 0.00 19.45 20.89 1hg1 n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hg1 s ALA 120 N -2.32 -0.67 -0.41 0.00 0.00 -1.26 -4.73 121.76 112.38 1hg1 s ALA 120 Ca 0.20 0.98 0.23 0.00 0.00 0.00 0.00 51.96 53.37 1hg1 s ALA 120 Cb -0.02 -0.60 0.29 0.00 0.00 0.00 0.00 23.12 22.79 1hg1 s ALA 120 CO 0.15 -0.18 1.51 0.52 0.00 0.00 0.00 175.76 177.75 1hg1 h MET 121 N 6.62 0.00 -6.43 0.00 2.86 -1.91 -3.39 114.93 112.68 1hg1 h MET 121 Ca -0.35 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.61 1hg1 h MET 121 Cb 1.17 0.00 -0.22 0.00 0.06 0.00 0.00 31.60 32.61 1hg1 h MET 121 CO 0.35 0.00 -0.78 1.03 1.06 0.00 0.00 176.91 178.57 1hg1 s ARG 122 N -3.23 2.33 0.63 1.72 0.52 -1.26 -5.01 118.95 114.65 1hg1 s ARG 122 Ca 0.06 -0.82 -0.18 0.00 -0.52 0.00 0.00 55.73 54.27 1hg1 s ARG 122 Cb 0.06 -2.30 -0.02 0.00 0.52 0.00 0.00 34.95 33.20 1hg1 s ARG 122 CO 0.69 0.59 1.19 -0.35 0.02 0.00 0.00 175.30 177.44 1hg1 n PRO 123 N 1.94 1.06 0.27 3.54 -0.04 -1.26 -4.56 135.00 135.94 1hg1 n PRO 123 Ca -0.16 0.41 0.15 0.00 -0.04 0.00 0.00 63.50 63.86 1hg1 n PRO 123 Cb 0.52 -2.42 0.81 0.00 -0.04 0.00 0.00 33.50 32.37 1hg1 n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hg1 h ALA 124 N 0.53 1.14 -0.02 0.55 0.00 -1.72 -0.88 119.26 118.87 1hg1 h ALA 124 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1hg1 h ALA 124 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1hg1 h ALA 124 CO 0.52 -0.14 -0.32 0.25 0.00 0.00 0.00 179.25 179.56 1hg1 n THR 125 N -2.66 0.00 -2.12 0.00 -2.24 -1.26 -4.90 114.28 101.09 1hg1 n THR 125 Ca -0.02 -0.32 -0.32 0.00 -2.27 0.00 0.00 64.05 61.11 1hg1 n THR 125 Cb 0.21 1.26 -0.00 0.00 -2.10 0.00 0.00 70.33 69.70 1hg1 n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hg1 s ALA 126 N -2.33 2.84 0.41 6.98 0.00 -0.34 -5.00 121.76 124.32 1hg1 s ALA 126 Ca 0.22 0.31 -0.25 0.00 0.00 0.00 0.00 51.96 52.24 1hg1 s ALA 126 Cb 0.19 -3.19 -0.08 0.00 0.00 0.00 0.00 23.12 20.03 1hg1 s ALA 126 CO 0.48 -0.66 1.15 0.96 0.00 0.00 0.00 175.76 177.69 1hg1 s ILE 127 N -2.54 3.25 -1.59 0.00 -4.36 -1.26 -2.61 121.20 112.07 1hg1 s ILE 127 Ca 0.62 1.02 -0.03 0.00 -0.26 0.00 0.00 60.65 61.99 1hg1 s ILE 127 Cb -0.14 -3.56 0.00 0.00 1.25 0.00 0.00 42.46 40.02 1hg1 s ILE 127 CO 0.36 0.07 0.45 -1.20 0.24 0.00 0.00 174.94 174.86 1hg1 n SER 128 N -0.01 -6.02 -4.73 4.36 7.64 -1.26 -4.91 113.62 108.69 1hg1 n SER 128 Ca 0.05 -0.21 -0.42 0.00 1.01 0.00 0.00 58.87 59.29 1hg1 n SER 128 Cb 0.47 -4.88 -0.02 0.00 -1.01 0.00 0.00 64.21 58.77 1hg1 n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hg1 n ALA 129 N -3.13 2.25 0.38 -0.43 0.00 -1.08 -4.89 120.51 113.61 1hg1 n ALA 129 Ca -0.15 0.38 0.12 0.00 0.00 0.00 0.00 53.44 53.80 1hg1 n ALA 129 Cb 0.64 -2.43 0.18 0.00 0.00 0.00 0.00 19.45 17.84 1hg1 n ALA 129 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1hg1 h ASP 130 N 4.79 0.00 -0.46 0.00 2.03 -1.88 -3.39 116.42 117.50 1hg1 h ASP 130 Ca -0.46 -0.06 0.09 0.00 -0.73 0.00 0.00 57.03 55.87 1hg1 h ASP 130 Cb 1.23 0.00 -0.09 0.00 -0.83 0.00 0.00 39.33 39.64 1hg1 h ASP 130 CO 0.80 0.03 -0.19 1.23 -1.03 0.00 0.00 179.24 180.08 1hg1 h GLY 131 N 4.26 0.17 0.25 7.15 0.00 -1.85 -1.99 103.07 111.07 1hg1 h GLY 131 Ca 0.00 0.24 0.06 0.00 0.00 0.00 0.00 47.33 47.63 1hg1 h GLY 131 CO 0.00 -0.20 -0.21 -2.55 0.00 0.00 0.00 176.54 173.58 1hg1 h PRO 132 N -0.09 -0.22 -0.74 4.80 0.11 -1.90 -0.62 132.00 133.34 1hg1 h PRO 132 Ca 0.22 0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.30 1hg1 h PRO 132 Cb 0.43 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.56 1hg1 h PRO 132 CO -0.52 -0.15 0.26 1.98 -0.21 0.00 0.00 178.00 179.36 1hg1 h MET 133 N -0.23 1.13 -0.41 1.05 4.05 -1.82 -1.93 114.93 116.78 1hg1 h MET 133 Ca 0.12 -0.23 0.01 0.00 -0.28 0.00 0.00 59.70 59.33 1hg1 h MET 133 Cb 0.42 -0.17 -0.03 0.00 -0.80 0.00 0.00 31.60 31.02 1hg1 h MET 133 CO -0.34 0.95 0.25 -0.91 0.23 0.00 0.00 176.91 177.08 1hg1 h ASN 134 N 1.09 0.41 -0.42 1.39 2.35 -0.93 -1.48 115.58 117.99 1hg1 h ASN 134 Ca 0.24 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 1hg1 h ASN 134 Cb 0.26 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1hg1 h ASN 134 CO -0.01 0.29 0.21 0.25 -1.65 0.00 0.00 177.43 176.52 1hg1 h LEU 135 N 0.50 0.54 -1.09 1.61 5.85 -0.90 -0.68 115.31 121.14 1hg1 h LEU 135 Ca 0.16 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1hg1 h LEU 135 Cb -0.01 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 40.84 1hg1 h LEU 135 CO -0.06 0.50 0.61 0.25 -0.34 0.00 0.00 178.44 179.40 1hg1 h LEU 136 N 0.54 1.05 -0.45 2.25 5.85 -1.10 -0.74 115.31 122.72 1hg1 h LEU 136 Ca 0.14 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.67 1hg1 h LEU 136 Cb 0.10 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 1hg1 h LEU 136 CO -0.02 0.75 -0.60 -0.33 -0.34 0.00 0.00 178.44 177.90 1hg1 h GLU 137 N 1.24 0.57 -0.66 1.25 5.08 -1.01 -2.28 114.58 118.76 1hg1 h GLU 137 Ca 0.34 -0.39 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 1hg1 h GLU 137 Cb -0.12 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 1hg1 h GLU 137 CO -0.08 1.01 0.08 0.00 -1.00 0.00 0.00 179.01 179.02 1hg1 h ALA 138 N 0.91 0.89 -0.26 3.43 0.00 -0.42 -0.51 119.26 123.28 1hg1 h ALA 138 Ca -0.00 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1hg1 h ALA 138 Cb 1.17 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1hg1 h ALA 138 CO 0.11 0.67 -0.20 0.28 0.00 0.00 0.00 179.25 180.12 1hg1 h VAL 139 N 1.04 1.31 -0.63 0.00 2.07 -1.14 0.19 116.25 119.08 1hg1 h VAL 139 Ca 0.20 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.40 1hg1 h VAL 139 Cb 0.47 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.80 1hg1 h VAL 139 CO 0.02 0.42 0.40 -0.09 0.02 0.00 0.00 177.57 178.34 1hg1 h ARG 140 N 0.33 0.78 -0.26 1.57 2.43 -1.26 0.02 114.38 117.98 1hg1 h ARG 140 Ca 0.05 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1hg1 h ARG 140 Cb 0.74 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1hg1 h ARG 140 CO 0.05 0.51 0.05 0.28 -1.51 0.00 0.00 179.97 179.36 1hg1 h VAL 141 N 0.80 1.22 0.00 0.20 2.07 -0.98 -2.50 116.25 117.06 1hg1 h VAL 141 Ca 0.25 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1hg1 h VAL 141 Cb -0.02 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1hg1 h VAL 141 CO -0.08 0.24 -0.11 0.00 0.02 0.00 0.00 177.57 177.63 1hg1 h ALA 142 N 0.88 1.81 -0.02 1.67 0.00 -0.53 -2.78 119.26 120.29 1hg1 h ALA 142 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1hg1 h ALA 142 Cb 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1hg1 h ALA 142 CO 0.00 0.14 -0.13 0.41 0.00 0.00 0.00 179.25 179.67 1hg1 n GLY 143 N -1.22 0.11 3.70 0.00 0.00 -0.04 -4.57 105.19 103.17 1hg1 n GLY 143 Ca -0.03 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.07 1hg1 n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hg1 s ASP 144 N -2.18 7.00 0.54 1.61 -1.08 -0.96 -4.78 116.67 116.81 1hg1 s ASP 144 Ca 0.30 1.21 0.23 0.00 -0.52 0.00 0.00 52.55 53.77 1hg1 s ASP 144 Cb 0.20 -2.44 1.47 0.00 -1.46 0.00 0.00 42.92 40.70 1hg1 s ASP 144 CO 0.40 -0.22 2.15 0.07 0.52 0.00 0.00 175.17 178.09 1hg1 h LYS 145 N 6.98 0.00 0.00 4.34 -0.00 -1.90 0.07 116.57 126.06 1hg1 h LYS 145 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.28 1hg1 h LYS 145 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.41 1hg1 h LYS 145 CO 0.78 0.05 0.00 0.94 -0.00 0.00 0.00 179.45 181.22 1hg1 n GLN 146 N -4.08 0.18 0.00 0.07 7.27 -1.26 -2.64 117.38 116.92 1hg1 n GLN 146 Ca -0.03 0.46 0.14 0.00 0.07 0.00 0.00 57.00 57.65 1hg1 n GLN 146 Cb 0.14 -1.87 0.64 0.00 2.41 0.00 0.00 30.24 31.56 1hg1 n GLN 146 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 1hg1 n SER 147 N -2.21 0.85 -4.78 1.69 7.64 0.01 -4.94 113.62 111.89 1hg1 n SER 147 Ca 0.01 -1.13 -0.36 0.00 1.01 0.00 0.00 58.87 58.41 1hg1 n SER 147 Cb 0.19 -0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.37 1hg1 n SER 147 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hg1 s ARG 148 N -2.14 3.67 -1.63 1.43 0.52 -1.08 -3.91 118.95 115.81 1hg1 s ARG 148 Ca 0.38 1.64 0.00 0.00 -0.52 0.00 0.00 55.73 57.23 1hg1 s ARG 148 Cb 0.21 -2.24 0.00 0.00 0.52 0.00 0.00 34.95 33.43 1hg1 s ARG 148 CO 0.39 -0.60 0.00 0.41 0.02 0.00 0.00 175.30 175.52 1hg1 n GLY 149 N 0.25 -0.16 0.78 -3.53 0.00 -0.15 -4.90 105.19 97.49 1hg1 n GLY 149 Ca 0.09 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.09 1hg1 n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hg1 n ARG 150 N -2.75 1.77 0.00 1.61 1.74 -1.25 -5.04 116.66 112.75 1hg1 n ARG 150 Ca -0.22 -1.75 0.00 0.00 -0.77 0.00 0.00 57.85 55.11 1hg1 n ARG 150 Cb 0.66 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.74 1hg1 n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hg1 n GLY 151 N 1.02 -0.88 3.77 -0.13 0.00 -1.26 -4.75 105.19 102.95 1hg1 n GLY 151 Ca 0.12 -1.68 -0.40 0.00 0.00 0.00 0.00 46.02 44.06 1hg1 n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hg1 s VAL 152 N -1.42 2.96 0.25 1.61 1.01 -1.26 -4.70 120.40 118.85 1hg1 s VAL 152 Ca 0.00 0.96 0.11 0.00 0.00 0.00 0.00 61.98 63.05 1hg1 s VAL 152 Cb 0.00 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1hg1 s VAL 152 CO 0.00 0.22 -0.19 -0.04 0.00 0.00 0.00 175.10 175.09 1hg1 s MET 153 N -1.73 1.57 -0.18 2.72 1.00 -0.83 -1.50 119.30 120.34 1hg1 s MET 153 Ca 0.48 -1.68 0.00 0.00 0.00 0.00 0.00 55.69 54.49 1hg1 s MET 153 Cb -0.37 -1.62 0.04 0.00 0.00 0.00 0.00 34.83 32.89 1hg1 s MET 153 CO 0.49 0.30 -0.08 0.08 0.00 0.00 0.00 175.02 175.81 1hg1 s VAL 154 N -2.49 1.41 -0.16 -6.03 1.01 0.23 -0.46 120.40 113.90 1hg1 s VAL 154 Ca 0.27 -0.83 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1hg1 s VAL 154 Cb -0.04 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.79 1hg1 s VAL 154 CO 0.12 0.16 -0.02 -0.69 0.00 0.00 0.00 175.10 174.68 1hg1 s VAL 155 N 1.50 4.06 -0.27 2.92 1.01 0.10 -1.28 120.40 128.45 1hg1 s VAL 155 Ca -0.00 -0.30 -0.27 0.00 0.00 0.00 0.00 61.98 61.41 1hg1 s VAL 155 Cb -0.16 -2.78 0.17 0.00 0.00 0.00 0.00 36.38 33.61 1hg1 s VAL 155 CO -0.08 0.49 1.29 -0.51 0.00 0.00 0.00 175.10 176.30 1hg1 s ILE 156 N 0.29 0.00 -1.36 2.22 2.07 -1.02 -3.98 121.20 119.42 1hg1 s ILE 156 Ca -0.02 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.19 1hg1 s ILE 156 Cb -0.14 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.47 1hg1 s ILE 156 CO 0.02 0.00 0.74 -3.20 -1.91 0.00 0.00 174.94 170.59 1hg1 n ASN 157 N 1.24 -1.84 0.00 4.50 5.15 -1.26 -1.79 115.26 121.26 1hg1 n ASN 157 Ca -0.08 -0.82 0.00 0.00 -0.60 0.00 0.00 54.58 53.08 1hg1 n ASN 157 Cb 0.57 -3.97 0.00 0.00 -0.53 0.00 0.00 39.78 35.85 1hg1 n ASN 157 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1hg1 n ASP 158 N -3.01 -3.74 -4.55 1.20 8.00 -1.26 -4.97 116.55 108.22 1hg1 n ASP 158 Ca -0.23 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 54.98 1hg1 n ASP 158 Cb 0.65 -2.65 -0.10 0.00 -0.02 0.00 0.00 41.12 39.00 1hg1 n ASP 158 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hg1 s ARG 159 N -1.37 2.00 -0.29 -1.24 1.81 -0.74 -0.20 118.95 118.92 1hg1 s ARG 159 Ca 0.00 -1.15 0.02 0.00 -1.72 0.00 0.00 55.73 52.89 1hg1 s ARG 159 Cb 0.00 -2.20 0.07 0.00 -0.45 0.00 0.00 34.95 32.37 1hg1 s ARG 159 CO 0.00 0.48 -0.04 0.42 -0.68 0.00 0.00 175.30 175.47 1hg1 s ILE 160 N -1.34 2.35 0.01 1.52 1.01 -0.05 -2.43 121.20 122.27 1hg1 s ILE 160 Ca 0.21 -1.80 0.02 0.00 0.00 0.00 0.00 60.65 59.08 1hg1 s ILE 160 Cb -0.10 -2.48 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1hg1 s ILE 160 CO 0.13 -0.21 0.00 -0.83 0.00 0.00 0.00 174.94 174.03 1hg1 s GLY 161 N 1.10 1.89 0.20 6.18 0.00 -0.40 -0.21 107.32 116.08 1hg1 s GLY 161 Ca -0.03 -0.98 -0.30 0.00 0.00 0.00 0.00 44.72 43.42 1hg1 s GLY 161 CO -0.05 -0.86 1.09 -0.45 0.00 0.00 0.00 173.10 172.83 1hg1 s SER 162 N -1.69 7.29 0.55 1.64 0.15 -1.26 -0.61 113.70 119.77 1hg1 s SER 162 Ca 0.21 2.12 0.25 0.00 0.70 0.00 0.00 55.95 59.22 1hg1 s SER 162 Cb -0.12 -2.61 1.45 0.00 -1.71 0.00 0.00 66.02 63.04 1hg1 s SER 162 CO 0.12 -0.19 2.04 0.00 1.20 0.00 0.00 173.24 176.41 1hg1 h ALA 163 N 4.81 2.22 0.00 5.45 0.00 -1.60 0.13 119.26 130.27 1hg1 h ALA 163 Ca -0.45 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 1hg1 h ALA 163 Cb 1.21 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1hg1 h ALA 163 CO 0.71 -0.46 -0.56 -0.09 0.00 0.00 0.00 179.25 178.85 1hg1 h ARG 164 N 0.00 0.00 0.00 0.00 9.65 -1.91 -3.39 114.38 118.73 1hg1 h ARG 164 Ca 0.17 0.00 -0.20 0.00 -1.10 0.00 0.00 59.98 58.85 1hg1 h ARG 164 Cb 0.73 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.27 1hg1 h ARG 164 CO -0.00 0.56 -1.74 0.66 2.80 0.00 0.00 179.97 182.24 1hg1 n TYR 165 N -3.59 0.00 -1.86 2.20 4.01 -0.66 -4.94 117.16 112.32 1hg1 n TYR 165 Ca -0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 1hg1 n TYR 165 Cb 0.62 -0.51 0.02 0.00 -0.31 0.00 0.00 39.34 39.17 1hg1 n TYR 165 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 1hg1 s ILE 166 N -2.26 2.22 -0.02 -0.72 1.10 0.35 -4.60 121.20 117.27 1hg1 s ILE 166 Ca -0.15 0.18 -0.27 0.00 -0.51 0.00 0.00 60.65 59.90 1hg1 s ILE 166 Cb 0.04 -3.10 0.06 0.00 0.15 0.00 0.00 42.46 39.61 1hg1 s ILE 166 CO 0.33 0.02 0.60 0.28 -2.11 0.00 0.00 174.94 174.05 1hg1 s THR 167 N -1.26 0.01 -0.45 4.00 -1.32 -1.14 -4.87 115.64 110.61 1hg1 s THR 167 Ca 0.64 -0.10 -0.29 0.00 -1.21 0.00 0.00 61.69 60.73 1hg1 s THR 167 Cb -0.41 -0.95 0.02 0.00 -1.51 0.00 0.00 72.50 69.65 1hg1 s THR 167 CO 0.51 -0.06 1.28 -0.75 -2.21 0.00 0.00 174.62 173.40 1hg1 s LYS 168 N -1.59 3.63 0.03 7.08 2.20 -1.26 -2.26 119.74 127.57 1hg1 s LYS 168 Ca -0.10 0.73 0.23 0.00 -0.36 0.00 0.00 55.97 56.47 1hg1 s LYS 168 Cb -0.01 -3.98 0.09 0.00 -1.51 0.00 0.00 37.83 32.42 1hg1 s LYS 168 CO 0.06 -1.50 1.08 0.25 -0.36 0.00 0.00 175.35 174.87 1hg1 n THR 169 N 6.97 0.10 -4.54 3.43 -2.24 -0.29 -4.91 114.28 112.78 1hg1 n THR 169 Ca 0.14 -0.15 -0.21 0.00 -2.27 0.00 0.00 64.05 61.56 1hg1 n THR 169 Cb 0.49 0.37 -0.15 0.00 -2.10 0.00 0.00 70.33 68.94 1hg1 n THR 169 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1hg1 s ASN 170 N -3.55 1.44 0.32 3.42 3.84 -1.25 -5.05 114.94 114.11 1hg1 s ASN 170 Ca 0.06 -0.22 0.01 0.00 0.21 0.00 0.00 52.86 52.91 1hg1 s ASN 170 Cb 0.15 -0.19 0.52 0.00 -0.55 0.00 0.00 41.25 41.18 1hg1 s ASN 170 CO 0.79 0.14 1.92 0.00 -2.79 0.00 0.00 177.10 177.17 1hg1 h ALA 171 N 5.91 1.38 0.00 1.71 0.00 -1.97 -3.39 119.26 122.90 1hg1 h ALA 171 Ca -0.33 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1hg1 h ALA 171 Cb 1.17 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1hg1 h ALA 171 CO 0.49 0.48 0.00 0.43 0.00 0.00 0.00 179.25 180.65 1hg1 n SER 172 N -4.35 0.28 -4.90 0.00 7.64 -1.26 -5.11 113.62 105.91 1hg1 n SER 172 Ca 0.05 -1.09 -0.28 0.00 1.01 0.00 0.00 58.87 58.57 1hg1 n SER 172 Cb 0.13 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.31 1hg1 n SER 172 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1hg1 s THR 173 N -0.09 4.96 0.33 0.44 -4.23 -1.26 -4.99 115.64 110.80 1hg1 s THR 173 Ca 0.00 0.13 0.05 0.00 -1.18 0.00 0.00 61.69 60.70 1hg1 s THR 173 Cb 0.00 -3.79 0.12 0.00 1.34 0.00 0.00 72.50 70.18 1hg1 s THR 173 CO 0.00 -0.54 1.83 -0.07 -0.54 0.00 0.00 174.62 175.30 1hg1 h LEU 174 N 1.07 0.41 -3.05 4.79 3.38 -1.97 -2.86 115.31 117.07 1hg1 h LEU 174 Ca -0.48 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.26 1hg1 h LEU 174 Cb 1.20 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 1hg1 h LEU 174 CO 0.64 0.57 0.17 -0.90 0.09 0.00 0.00 178.44 179.01 1hg1 n ASP 175 N -4.22 4.09 -0.35 -0.43 5.75 -1.26 -4.62 116.55 115.50 1hg1 n ASP 175 Ca 0.00 -2.84 0.03 0.00 -0.01 0.00 0.00 54.79 51.97 1hg1 n ASP 175 Cb 0.31 -0.67 0.20 0.00 -1.03 0.00 0.00 41.12 39.92 1hg1 n ASP 175 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1hg1 h THR 176 N 2.08 1.07 -2.93 2.12 1.03 -1.83 -3.42 112.91 111.04 1hg1 h THR 176 Ca 0.17 -0.39 -0.57 0.00 -0.01 0.00 0.00 66.41 65.61 1hg1 h THR 176 Cb 1.85 -0.15 -0.04 0.00 -1.07 0.00 0.00 68.15 68.74 1hg1 h THR 176 CO 0.51 0.21 0.99 -0.36 -0.01 0.00 0.00 175.52 176.86 1hg1 s PHE 177 N -5.99 2.56 0.08 0.00 0.08 -1.26 -1.14 117.98 112.30 1hg1 s PHE 177 Ca -0.12 0.79 -0.15 0.00 0.12 0.00 0.00 56.93 57.56 1hg1 s PHE 177 Cb 0.20 -3.77 0.03 0.00 -0.57 0.00 0.00 43.02 38.91 1hg1 s PHE 177 CO 0.81 -2.17 0.36 1.03 -0.10 0.00 0.00 175.22 175.15 1hg1 s ARG 178 N 4.01 0.94 -0.52 0.44 0.52 -0.96 -4.94 118.95 118.44 1hg1 s ARG 178 Ca 0.60 -0.57 0.04 0.00 -0.52 0.00 0.00 55.73 55.28 1hg1 s ARG 178 Cb -0.22 0.41 0.16 0.00 0.52 0.00 0.00 34.95 35.82 1hg1 s ARG 178 CO 0.22 -0.33 0.36 0.00 0.02 0.00 0.00 175.30 175.56 1hg1 s ALA 179 N -3.09 2.48 0.25 2.13 0.00 -1.26 -2.89 121.76 119.38 1hg1 s ALA 179 Ca -0.01 -2.98 -0.07 0.00 0.00 0.00 0.00 51.96 48.90 1hg1 s ALA 179 Cb 0.01 -1.89 0.44 0.00 0.00 0.00 0.00 23.12 21.68 1hg1 s ALA 179 CO -0.07 -2.05 1.63 -0.91 0.00 0.00 0.00 175.76 174.36 1hg1 h ASN 180 N 5.93 -0.40 0.86 0.00 2.35 -1.90 0.52 115.58 122.94 1hg1 h ASN 180 Ca 0.13 0.20 -0.11 0.00 -0.55 0.00 0.00 56.30 55.98 1hg1 h ASN 180 Cb 0.86 0.37 -0.02 0.00 0.05 0.00 0.00 38.32 39.58 1hg1 h ASN 180 CO 0.53 -0.20 -1.21 -0.33 -1.65 0.00 0.00 177.43 174.57 1hg1 h GLU 181 N 0.08 0.00 0.00 0.81 4.39 -1.97 -3.38 114.58 114.51 1hg1 h GLU 181 Ca 0.42 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.12 1hg1 h GLU 181 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1hg1 h GLU 181 CO -0.69 0.20 -0.72 0.39 -1.16 0.00 0.00 179.01 177.03 1hg1 n GLU 182 N -2.84 2.20 0.00 2.33 4.71 -0.99 -5.11 120.64 120.94 1hg1 n GLU 182 Ca -0.06 -0.01 0.00 0.00 -0.01 0.00 0.00 57.16 57.09 1hg1 n GLU 182 Cb 0.73 -1.18 0.00 0.00 -1.01 0.00 0.00 31.44 29.98 1hg1 n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1hg1 n GLY 183 N 1.35 -0.99 3.91 0.62 0.00 0.18 -4.86 105.19 105.39 1hg1 n GLY 183 Ca 0.02 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.67 1hg1 n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hg1 s TYR 184 N 0.00 3.45 0.31 1.61 2.02 -1.26 -4.55 117.35 118.93 1hg1 s TYR 184 Ca 0.00 0.17 0.07 0.00 -0.37 0.00 0.00 57.07 56.95 1hg1 s TYR 184 Cb 0.00 -1.70 0.50 0.00 -0.40 0.00 0.00 41.96 40.36 1hg1 s TYR 184 CO 0.00 0.55 1.72 -0.07 -1.57 0.00 0.00 175.55 176.19 1hg1 h LEU 185 N 2.75 0.22 0.00 -1.29 3.38 -0.87 -3.38 115.31 116.12 1hg1 h LEU 185 Ca -0.46 -0.09 0.14 0.00 0.09 0.00 0.00 57.88 57.55 1hg1 h LEU 185 Cb 1.17 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 1hg1 h LEU 185 CO 0.72 0.60 0.41 0.61 0.09 0.00 0.00 178.44 180.87 1hg1 n GLY 186 N -0.25 0.68 3.15 0.83 0.00 -1.11 0.86 105.19 109.36 1hg1 n GLY 186 Ca -0.01 -1.01 -0.08 0.00 0.00 0.00 0.00 46.02 44.92 1hg1 n GLY 186 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hg1 s VAL 187 N -2.19 0.18 -0.24 1.61 -7.23 -0.40 -0.87 120.40 111.26 1hg1 s VAL 187 Ca 0.15 -1.50 0.02 0.00 -1.81 0.00 0.00 61.98 58.84 1hg1 s VAL 187 Cb -0.01 -1.43 0.05 0.00 0.56 0.00 0.00 36.38 35.55 1hg1 s VAL 187 CO 0.02 -0.82 -0.11 -0.63 -0.31 0.00 0.00 175.10 173.24 1hg1 s ILE 188 N -3.89 2.02 -0.02 -0.62 1.01 0.73 -0.71 121.20 119.72 1hg1 s ILE 188 Ca 0.06 -1.46 0.03 0.00 0.00 0.00 0.00 60.65 59.28 1hg1 s ILE 188 Cb 0.06 -2.12 -0.00 0.00 0.01 0.00 0.00 42.46 40.41 1hg1 s ILE 188 CO -0.10 0.03 -0.09 -0.63 0.00 0.00 0.00 174.94 174.15 1hg1 s ILE 189 N 1.19 0.75 -1.49 2.92 -1.09 -0.51 -4.67 121.20 118.30 1hg1 s ILE 189 Ca -0.07 -0.37 -0.12 0.00 -2.23 0.00 0.00 60.65 57.86 1hg1 s ILE 189 Cb -0.19 -0.66 0.06 0.00 -1.58 0.00 0.00 42.46 40.10 1hg1 s ILE 189 CO -0.06 0.23 1.01 0.61 -1.23 0.00 0.00 174.94 175.49 1hg1 n GLY 190 N 3.12 -0.51 2.53 6.18 0.00 -1.26 -1.19 105.19 114.05 1hg1 n GLY 190 Ca -0.16 0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 1hg1 n GLY 190 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hg1 n ASN 191 N -2.85 -5.47 -4.17 1.61 3.02 -1.26 -4.98 115.26 101.17 1hg1 n ASN 191 Ca 0.03 0.36 -0.25 0.00 -0.03 0.00 0.00 54.58 54.69 1hg1 n ASN 191 Cb 0.54 -4.66 -0.15 0.00 -0.61 0.00 0.00 39.78 34.90 1hg1 n ASN 191 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1hg1 s ARG 192 N -4.02 1.45 -0.11 3.52 3.52 -0.34 -5.12 118.95 117.85 1hg1 s ARG 192 Ca 0.00 -0.63 -0.18 0.00 -0.13 0.00 0.00 55.73 54.79 1hg1 s ARG 192 Cb 0.00 -1.40 -0.04 0.00 -1.56 0.00 0.00 34.95 31.95 1hg1 s ARG 192 CO 0.00 0.38 0.47 0.42 -0.81 0.00 0.00 175.30 175.76 1hg1 s ILE 193 N -0.40 5.18 -0.32 4.11 1.01 -1.26 -1.43 121.20 128.10 1hg1 s ILE 193 Ca 0.06 0.95 0.03 0.00 0.00 0.00 0.00 60.65 61.69 1hg1 s ILE 193 Cb -0.07 -3.81 0.09 0.00 0.01 0.00 0.00 42.46 38.67 1hg1 s ILE 193 CO -0.01 0.33 0.01 -0.31 0.00 0.00 0.00 174.94 174.97 1hg1 s TYR 194 N 0.57 3.59 -0.10 3.97 1.51 0.11 -4.99 117.35 122.01 1hg1 s TYR 194 Ca 0.26 -2.72 -0.25 0.00 -1.01 0.00 0.00 57.07 53.35 1hg1 s TYR 194 Cb -0.15 -2.62 -0.03 0.00 -0.11 0.00 0.00 41.96 39.06 1hg1 s TYR 194 CO 0.10 -0.92 0.78 0.71 -1.11 0.00 0.00 175.55 175.11 1hg1 s TYR 195 N 0.99 3.52 -0.21 2.71 2.02 -1.26 -1.27 117.35 123.84 1hg1 s TYR 195 Ca 0.04 1.30 -0.03 0.00 -0.37 0.00 0.00 57.07 58.00 1hg1 s TYR 195 Cb -0.20 -2.92 -0.12 0.00 -0.40 0.00 0.00 41.96 38.32 1hg1 s TYR 195 CO -0.07 -0.06 -0.22 1.04 -1.57 0.00 0.00 175.55 174.67 1hg1 n GLN 196 N 4.39 0.50 -4.24 -0.62 6.02 0.25 -4.95 117.38 118.73 1hg1 n GLN 196 Ca 0.02 0.15 -0.13 0.00 -0.01 0.00 0.00 57.00 57.03 1hg1 n GLN 196 Cb 0.50 -1.37 -0.10 0.00 1.02 0.00 0.00 30.24 30.30 1hg1 n GLN 196 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1hg1 s ASN 197 N -6.40 1.21 -0.12 1.08 0.01 -0.39 -5.02 114.94 105.32 1hg1 s ASN 197 Ca -0.29 -1.16 0.00 0.00 -0.71 0.00 0.00 52.86 50.70 1hg1 s ASN 197 Cb 0.09 0.11 0.02 0.00 0.41 0.00 0.00 41.25 41.89 1hg1 s ASN 197 CO 0.44 -0.56 -0.11 -0.13 -1.51 0.00 0.00 177.10 175.23 1hg1 s ARG 198 N -3.91 1.88 0.32 -0.60 0.52 -1.26 -4.72 118.95 111.18 1hg1 s ARG 198 Ca 0.23 -0.41 -0.29 0.00 -0.52 0.00 0.00 55.73 54.74 1hg1 s ARG 198 Cb 0.06 -1.76 -0.11 0.00 0.52 0.00 0.00 34.95 33.66 1hg1 s ARG 198 CO 0.03 -0.19 1.55 -1.50 0.02 0.00 0.00 175.30 175.22 1hg1 s ILE 199 N 1.39 2.07 -1.09 1.52 2.07 -1.26 -4.90 121.20 121.00 1hg1 s ILE 199 Ca 0.01 0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.29 1hg1 s ILE 199 Cb -0.13 -3.04 0.27 0.00 0.13 0.00 0.00 42.46 39.68 1hg1 s ILE 199 CO -0.06 0.01 2.00 -0.67 -1.91 0.00 0.00 174.94 174.31 1hg1 n ASP 200 N 1.59 7.54 -3.93 4.50 -0.08 -1.26 -4.92 116.55 120.00 1hg1 n ASP 200 Ca 0.06 -3.55 -0.08 0.00 -1.51 0.00 0.00 54.79 49.71 1hg1 n ASP 200 Cb 0.38 -1.22 -0.08 0.00 2.34 0.00 0.00 41.12 42.54 1hg1 n ASP 200 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1hg1 s LYS 201 N -3.46 0.82 0.39 -0.67 -0.14 -1.26 -5.04 119.74 110.38 1hg1 s LYS 201 Ca 0.44 -1.05 -0.23 0.00 -1.36 0.00 0.00 55.97 53.76 1hg1 s LYS 201 Cb 0.20 0.31 -0.10 0.00 -1.68 0.00 0.00 37.83 36.57 1hg1 s LYS 201 CO -0.13 -0.24 0.99 -0.51 -0.76 0.00 0.00 175.35 174.69 1hg1 s LEU 202 N -2.89 4.11 0.06 3.17 1.43 -0.31 -5.01 118.68 119.24 1hg1 s LEU 202 Ca 0.07 1.87 -0.27 0.00 -1.03 0.00 0.00 54.13 54.76 1hg1 s LEU 202 Cb 0.06 -4.28 0.10 0.00 0.03 0.00 0.00 46.19 42.09 1hg1 s LEU 202 CO -0.09 -0.36 1.17 -1.38 0.23 0.00 0.00 176.35 175.91 1hg1 s HIS 203 N -1.83 -0.03 0.00 0.29 -3.43 -1.26 -4.67 115.29 104.36 1hg1 s HIS 203 Ca 0.58 -0.18 0.00 0.00 -0.80 0.00 0.00 55.06 54.66 1hg1 s HIS 203 Cb -0.17 0.60 0.00 0.00 -1.43 0.00 0.00 32.58 31.58 1hg1 s HIS 203 CO 0.21 -0.52 0.00 0.25 -2.00 0.00 0.00 174.74 172.68 1hg1 n THR 204 N -0.59 0.00 0.32 -5.38 -2.24 0.03 -0.52 114.28 105.90 1hg1 n THR 204 Ca -0.05 0.00 0.22 0.00 -2.27 0.00 0.00 64.05 61.95 1hg1 n THR 204 Cb 0.61 0.00 1.14 0.00 -2.10 0.00 0.00 70.33 69.98 1hg1 n THR 204 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1hg1 h THR 205 N 0.00 0.00 -0.35 4.28 1.35 -1.75 -2.01 112.91 114.42 1hg1 h THR 205 Ca 0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1hg1 h THR 205 Cb 0.00 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.41 1hg1 h THR 205 CO 0.00 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.81 1hg1 n ARG 206 N -3.01 3.36 -3.84 4.72 1.74 0.32 -4.99 116.66 114.96 1hg1 n ARG 206 Ca -0.03 -2.85 -0.33 0.00 -0.77 0.00 0.00 57.85 53.87 1hg1 n ARG 206 Cb 0.08 -1.88 -0.05 0.00 -1.02 0.00 0.00 32.46 29.59 1hg1 n ARG 206 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1hg1 s SER 207 N -1.58 6.42 0.00 0.55 0.15 -0.76 -4.48 113.70 114.00 1hg1 s SER 207 Ca 0.44 0.43 0.26 0.00 0.70 0.00 0.00 55.95 57.78 1hg1 s SER 207 Cb 0.34 -2.04 0.72 0.00 -1.71 0.00 0.00 66.02 63.33 1hg1 s SER 207 CO 0.12 0.23 1.55 1.33 1.20 0.00 0.00 173.24 177.67 1hg1 n VAL 208 N 0.88 0.00 -1.89 4.45 0.24 -1.26 -4.69 118.33 116.06 1hg1 n VAL 208 Ca -0.10 -0.10 -0.42 0.00 -2.04 0.00 0.00 64.34 61.68 1hg1 n VAL 208 Cb 0.52 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.24 1hg1 n VAL 208 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1hg1 n PHE 209 N -0.85 3.69 -3.03 6.34 3.72 -1.26 -4.92 117.46 121.15 1hg1 n PHE 209 Ca 0.11 -2.95 -0.42 0.00 -0.05 0.00 0.00 57.45 54.14 1hg1 n PHE 209 Cb 0.34 -2.54 -0.06 0.00 -0.94 0.00 0.00 39.48 36.28 1hg1 n PHE 209 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1hg1 s ASP 210 N 3.24 6.54 -0.17 4.37 2.15 -1.26 -4.22 116.67 127.32 1hg1 s ASP 210 Ca 0.48 0.41 0.17 0.00 0.43 0.00 0.00 52.55 54.03 1hg1 s ASP 210 Cb 0.12 -2.36 0.39 0.00 -0.30 0.00 0.00 42.92 40.77 1hg1 s ASP 210 CO -0.06 -0.60 1.26 1.33 -0.17 0.00 0.00 175.17 176.93 1hg1 n VAL 211 N 5.57 2.10 -0.30 1.11 0.24 -1.26 -4.79 118.33 121.00 1hg1 n VAL 211 Ca 0.01 -2.30 0.13 0.00 -2.04 0.00 0.00 64.34 60.15 1hg1 n VAL 211 Cb 0.48 -0.25 0.30 0.00 -1.47 0.00 0.00 33.84 32.90 1hg1 n VAL 211 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1hg1 h ARG 212 N 0.71 0.29 -0.64 7.34 2.43 -1.93 -1.05 114.38 121.52 1hg1 h ARG 212 Ca 0.02 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1hg1 h ARG 212 Cb 1.19 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1hg1 h ARG 212 CO 0.10 0.19 0.00 0.41 -1.51 0.00 0.00 179.97 179.16 1hg1 n GLY 213 N -1.35 2.79 3.88 2.80 0.00 -1.26 -4.97 105.19 107.08 1hg1 n GLY 213 Ca 0.22 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 1hg1 n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hg1 s LEU 214 N -2.10 4.20 0.00 0.99 1.43 -0.40 -4.97 118.68 117.83 1hg1 s LEU 214 Ca 0.53 0.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.50 1hg1 s LEU 214 Cb 0.36 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.99 1hg1 s LEU 214 CO 0.23 -0.04 0.00 0.35 0.23 0.00 0.00 176.35 177.12 1hg1 n THR 215 N -0.03 0.00 -4.12 5.49 -2.24 -1.26 -5.00 114.28 107.12 1hg1 n THR 215 Ca -0.00 -0.16 -0.10 0.00 -2.27 0.00 0.00 64.05 61.52 1hg1 n THR 215 Cb 0.52 0.65 -0.09 0.00 -2.10 0.00 0.00 70.33 69.31 1hg1 n THR 215 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hg1 s SER 216 N -1.01 0.25 0.06 3.42 1.04 -1.26 -4.93 113.70 111.26 1hg1 s SER 216 Ca 0.00 -1.17 0.05 0.00 0.48 0.00 0.00 55.95 55.31 1hg1 s SER 216 Cb 0.00 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.42 1hg1 s SER 216 CO 0.00 -0.77 -0.14 -0.76 0.98 0.00 0.00 173.24 172.55 1hg1 s LEU 217 N -3.04 2.23 0.35 2.42 1.43 -1.26 -5.09 118.68 115.71 1hg1 s LEU 217 Ca 0.24 -0.54 -0.29 0.00 -1.03 0.00 0.00 54.13 52.52 1hg1 s LEU 217 Cb 0.07 -0.55 -0.11 0.00 0.03 0.00 0.00 46.19 45.62 1hg1 s LEU 217 CO 0.02 -0.02 1.52 -2.84 0.23 0.00 0.00 176.35 175.26 1hg1 s PRO 218 N -1.44 4.12 0.01 1.29 0.02 -1.26 -4.92 135.00 132.81 1hg1 s PRO 218 Ca -0.00 2.57 -0.30 0.00 0.02 0.00 0.00 61.00 63.28 1hg1 s PRO 218 Cb -0.09 -2.99 -0.06 0.00 0.02 0.00 0.00 34.50 31.38 1hg1 s PRO 218 CO 0.02 -0.57 1.44 0.15 -0.33 0.00 0.00 177.00 177.71 1hg1 s LYS 219 N -1.51 4.27 -0.05 5.54 1.02 -1.26 -4.83 119.74 122.91 1hg1 s LYS 219 Ca 0.57 2.02 -0.00 0.00 0.02 0.00 0.00 55.97 58.57 1hg1 s LYS 219 Cb -0.47 -3.56 0.03 0.00 -0.52 0.00 0.00 37.83 33.30 1hg1 s LYS 219 CO 0.58 -0.59 -0.00 0.08 -0.92 0.00 0.00 175.35 174.49 1hg1 s VAL 220 N 2.38 0.31 0.30 3.17 1.01 -1.26 -0.50 120.40 125.81 1hg1 s VAL 220 Ca 0.65 0.09 0.09 0.00 0.00 0.00 0.00 61.98 62.81 1hg1 s VAL 220 Cb -0.33 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1hg1 s VAL 220 CO 0.27 0.22 0.06 -1.81 0.00 0.00 0.00 175.10 173.84 1hg1 s ASP 221 N 1.54 4.63 -0.13 3.32 1.01 -1.01 -4.97 116.67 121.05 1hg1 s ASP 221 Ca -0.02 -0.69 0.02 0.00 0.71 0.00 0.00 52.55 52.57 1hg1 s ASP 221 Cb -0.13 -0.82 0.00 0.00 1.01 0.00 0.00 42.92 42.98 1hg1 s ASP 221 CO -0.03 -0.12 -0.19 -0.63 0.21 0.00 0.00 175.17 174.40 1hg1 s ILE 222 N -2.36 2.38 -0.06 0.77 1.01 -1.26 -0.35 121.20 121.33 1hg1 s ILE 222 Ca 0.34 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 60.15 1hg1 s ILE 222 Cb -0.05 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.44 1hg1 s ILE 222 CO 0.21 0.54 -0.20 -0.76 0.00 0.00 0.00 174.94 174.73 1hg1 s LEU 223 N 0.61 2.40 0.38 2.97 1.43 -0.45 -4.97 118.68 121.06 1hg1 s LEU 223 Ca -0.10 -0.36 -0.16 0.00 -1.03 0.00 0.00 54.13 52.48 1hg1 s LEU 223 Cb -0.16 -1.47 -0.09 0.00 0.03 0.00 0.00 46.19 44.50 1hg1 s LEU 223 CO 0.03 0.28 0.82 -0.47 0.23 0.00 0.00 176.35 177.24 1hg1 s TYR 224 N -0.37 3.38 -0.17 0.29 5.04 -1.26 -1.31 117.35 122.95 1hg1 s TYR 224 Ca 0.03 1.30 -0.03 0.00 -2.44 0.00 0.00 57.07 55.93 1hg1 s TYR 224 Cb -0.12 -2.62 -0.02 0.00 0.35 0.00 0.00 41.96 39.55 1hg1 s TYR 224 CO 0.02 -0.04 -0.05 0.20 -1.34 0.00 0.00 175.55 174.34 1hg1 s GLY 225 N -2.49 1.66 0.12 8.97 0.00 -0.16 -4.87 107.32 110.55 1hg1 s GLY 225 Ca 0.56 -0.91 -0.26 0.00 0.00 0.00 0.00 44.72 44.11 1hg1 s GLY 225 CO 0.20 0.02 0.95 -2.52 0.00 0.00 0.00 173.10 171.75 1hg1 s TYR 226 N 0.61 -0.17 0.29 1.90 1.13 -1.26 -4.33 117.35 115.52 1hg1 s TYR 226 Ca -0.03 -0.09 -0.30 0.00 -1.41 0.00 0.00 57.07 55.24 1hg1 s TYR 226 Cb -0.15 0.62 -0.13 0.00 -1.10 0.00 0.00 41.96 41.20 1hg1 s TYR 226 CO 0.03 -0.76 1.43 1.04 -2.51 0.00 0.00 175.55 174.78 1hg1 n GLN 227 N -0.42 2.27 -1.31 -3.49 6.02 -1.26 -1.41 117.38 117.78 1hg1 n GLN 227 Ca -0.07 0.80 -0.11 0.00 -0.01 0.00 0.00 57.00 57.62 1hg1 n GLN 227 Cb 0.61 -2.48 -0.05 0.00 1.02 0.00 0.00 30.24 29.35 1hg1 n GLN 227 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1hg1 n ASP 228 N 1.70 -4.62 -4.69 1.08 8.00 -1.26 -4.95 116.55 111.81 1hg1 n ASP 228 Ca 0.08 0.26 -0.44 0.00 0.71 0.00 0.00 54.79 55.41 1hg1 n ASP 228 Cb 0.34 -3.05 -0.03 0.00 -0.02 0.00 0.00 41.12 38.36 1hg1 n ASP 228 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1hg1 n ASP 229 N -0.19 3.19 -4.73 -2.24 5.75 -0.50 -4.93 116.55 112.90 1hg1 n ASP 229 Ca -0.11 1.12 -0.41 0.00 -0.01 0.00 0.00 54.79 55.38 1hg1 n ASP 229 Cb 0.41 -1.48 -0.04 0.00 -1.03 0.00 0.00 41.12 38.98 1hg1 n ASP 229 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 1hg1 s PRO 230 N 0.04 4.66 0.25 0.11 0.04 -1.26 -4.56 135.00 134.27 1hg1 s PRO 230 Ca 0.70 1.56 0.05 0.00 0.04 0.00 0.00 61.00 63.36 1hg1 s PRO 230 Cb -0.61 -3.34 0.29 0.00 0.04 0.00 0.00 34.50 30.88 1hg1 s PRO 230 CO 0.45 0.16 1.59 1.49 0.04 0.00 0.00 177.00 180.72 1hg1 h GLU 231 N 5.41 0.23 -0.05 4.56 4.81 -1.92 -3.21 114.58 124.41 1hg1 h GLU 231 Ca -0.43 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 58.66 1hg1 h GLU 231 Cb 1.21 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1hg1 h GLU 231 CO 0.72 0.74 0.11 0.10 -0.73 0.00 0.00 179.01 179.95 1hg1 h TYR 232 N 0.18 0.00 0.00 0.92 -0.00 -1.93 -0.36 116.97 115.77 1hg1 h TYR 232 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 58.63 1hg1 h TYR 232 Cb 1.06 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.77 1hg1 h TYR 232 CO 0.02 0.00 -0.47 -0.07 -0.00 0.00 0.00 178.16 177.64 1hg1 h LEU 233 N 0.00 0.00 -0.22 0.10 3.38 -1.99 -0.31 115.31 116.28 1hg1 h LEU 233 Ca 0.02 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 1hg1 h LEU 233 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1hg1 h LEU 233 CO -0.00 0.47 -0.32 1.88 0.09 0.00 0.00 178.44 180.56 1hg1 h TYR 234 N 0.00 0.74 -0.74 1.13 -1.99 -1.26 -1.82 116.97 113.03 1hg1 h TYR 234 Ca -0.00 -0.25 0.04 0.00 2.00 0.00 0.00 58.73 60.51 1hg1 h TYR 234 Cb 0.88 -0.15 -0.05 0.00 2.00 0.00 0.00 36.73 39.42 1hg1 h TYR 234 CO 0.00 0.98 0.46 -0.44 -0.00 0.00 0.00 178.16 179.16 1hg1 h ASP 235 N 0.29 0.75 -0.35 3.88 3.32 -1.32 -0.57 116.42 122.42 1hg1 h ASP 235 Ca 0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1hg1 h ASP 235 Cb 0.90 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 1hg1 h ASP 235 CO 0.07 0.51 0.20 0.00 -1.72 0.00 0.00 179.24 178.30 1hg1 h ALA 236 N 1.32 0.45 -0.46 3.45 0.00 -0.95 0.11 119.26 123.18 1hg1 h ALA 236 Ca 0.30 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1hg1 h ALA 236 Cb 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1hg1 h ALA 236 CO -0.12 -0.03 0.27 0.00 0.00 0.00 0.00 179.25 179.36 1hg1 h ALA 237 N 1.06 0.59 -0.19 0.00 0.00 -0.86 -1.28 119.26 118.59 1hg1 h ALA 237 Ca 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1hg1 h ALA 237 Cb 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1hg1 h ALA 237 CO -0.02 0.10 0.12 0.82 0.00 0.00 0.00 179.25 180.27 1hg1 h ILE 238 N 0.61 1.07 -0.17 0.00 2.04 -0.85 -2.14 117.51 118.08 1hg1 h ILE 238 Ca 0.16 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.91 1hg1 h ILE 238 Cb 0.03 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1hg1 h ILE 238 CO -0.03 0.07 0.12 1.56 0.00 0.00 0.00 178.15 179.87 1hg1 h GLN 239 N 0.23 0.00 -0.68 2.37 7.50 -0.48 -1.76 115.11 122.29 1hg1 h GLN 239 Ca 0.07 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.22 1hg1 h GLN 239 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.54 1hg1 h GLN 239 CO -0.01 0.00 0.00 0.72 -1.50 0.00 0.00 178.83 178.04 1hg1 n HIS 240 N -4.48 1.26 -1.76 2.96 8.25 -0.51 -4.95 115.22 115.99 1hg1 n HIS 240 Ca 0.01 -0.45 -0.11 0.00 -0.26 0.00 0.00 57.72 56.91 1hg1 n HIS 240 Cb 0.26 -0.31 -0.03 0.00 1.12 0.00 0.00 29.99 31.03 1hg1 n HIS 240 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hg1 n GLY 241 N 0.57 0.57 3.76 -1.41 0.00 -0.66 -5.01 105.19 103.00 1hg1 n GLY 241 Ca 0.18 -0.48 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 1hg1 n GLY 241 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hg1 s VAL 242 N -2.47 2.58 -0.33 1.61 -7.23 -1.07 -4.78 120.40 108.71 1hg1 s VAL 242 Ca 0.00 0.41 0.22 0.00 -1.81 0.00 0.00 61.98 60.80 1hg1 s VAL 242 Cb 0.00 -3.19 -0.28 0.00 0.56 0.00 0.00 36.38 33.47 1hg1 s VAL 242 CO 0.00 -0.03 0.66 0.29 -0.31 0.00 0.00 175.10 175.71 1hg1 n LYS 243 N -1.08 0.46 -3.67 4.82 4.76 0.34 -4.80 118.16 119.00 1hg1 n LYS 243 Ca 0.11 -0.12 -0.15 0.00 -2.87 0.00 0.00 58.31 55.28 1hg1 n LYS 243 Cb 0.48 -1.54 -0.07 0.00 -1.84 0.00 0.00 35.03 32.06 1hg1 n LYS 243 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1hg1 s GLY 244 N -4.07 -0.31 -0.09 0.72 0.00 -1.09 -1.67 107.32 100.82 1hg1 s GLY 244 Ca -0.03 0.62 0.01 0.00 0.00 0.00 0.00 44.72 45.32 1hg1 s GLY 244 CO 0.88 0.35 -0.11 -0.42 0.00 0.00 0.00 173.10 173.81 1hg1 s ILE 245 N -1.54 1.13 -0.20 0.90 1.01 -0.14 -2.41 121.20 119.94 1hg1 s ILE 245 Ca -0.11 -0.43 -0.09 0.00 0.00 0.00 0.00 60.65 60.02 1hg1 s ILE 245 Cb -0.03 -1.07 -0.05 0.00 0.01 0.00 0.00 42.46 41.33 1hg1 s ILE 245 CO 0.04 0.37 0.11 -0.69 0.00 0.00 0.00 174.94 174.78 1hg1 s VAL 246 N 1.04 5.23 -0.33 2.92 1.01 0.52 -1.08 120.40 129.70 1hg1 s VAL 246 Ca -0.07 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 1hg1 s VAL 246 Cb -0.15 -3.39 0.01 0.00 0.00 0.00 0.00 36.38 32.86 1hg1 s VAL 246 CO -0.01 0.43 0.17 -0.47 0.00 0.00 0.00 175.10 175.22 1hg1 s TYR 247 N 0.46 3.20 -1.28 5.22 5.04 0.67 -1.34 117.35 129.32 1hg1 s TYR 247 Ca 0.07 -0.76 -0.15 0.00 -2.44 0.00 0.00 57.07 53.78 1hg1 s TYR 247 Cb -0.12 -2.38 0.11 0.00 0.35 0.00 0.00 41.96 39.93 1hg1 s TYR 247 CO -0.01 -0.54 1.68 0.00 -1.34 0.00 0.00 175.55 175.34 1hg1 n ALA 248 N 4.98 3.97 -1.37 3.97 0.00 -0.43 0.48 120.51 132.11 1hg1 n ALA 248 Ca -0.13 -4.03 -0.30 0.00 0.00 0.00 0.00 53.44 48.98 1hg1 n ALA 248 Cb 0.48 -3.35 0.12 0.00 0.00 0.00 0.00 19.45 16.69 1hg1 n ALA 248 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1hg1 s GLY 249 N 3.37 1.62 0.06 0.00 0.00 -0.94 -0.99 107.32 110.44 1hg1 s GLY 249 Ca 0.48 -0.15 -0.31 0.00 0.00 0.00 0.00 44.72 44.75 1hg1 s GLY 249 CO 0.03 0.32 1.19 1.06 0.00 0.00 0.00 173.10 175.70 1hg1 s MET 250 N -5.05 4.43 5.13 2.90 -1.94 -1.23 -0.58 119.30 122.96 1hg1 s MET 250 Ca 0.62 1.76 0.00 0.00 -1.71 0.00 0.00 55.69 56.36 1hg1 s MET 250 Cb -0.16 -3.35 0.00 0.00 2.01 0.00 0.00 34.83 33.33 1hg1 s MET 250 CO 0.56 -0.25 0.00 0.41 -0.01 0.00 0.00 175.02 175.72 1hg1 n GLY 251 N 3.21 2.97 2.38 -0.03 0.00 -1.26 -1.01 105.19 111.44 1hg1 n GLY 251 Ca 0.09 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 1hg1 n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hg1 n ALA 252 N 9.40 7.28 -1.65 4.61 0.00 -1.26 -4.54 120.51 134.34 1hg1 n ALA 252 Ca 0.00 -3.68 -0.16 0.00 0.00 0.00 0.00 53.44 49.61 1hg1 n ALA 252 Cb 0.00 -3.26 -0.05 0.00 0.00 0.00 0.00 19.45 16.14 1hg1 n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hg1 n GLY 253 N 3.22 1.14 3.76 0.00 0.00 -1.15 -4.74 105.19 107.43 1hg1 n GLY 253 Ca 0.73 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 46.10 1hg1 n GLY 253 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hg1 s SER 254 N -2.71 5.81 -0.03 1.61 1.04 -0.18 -4.82 113.70 114.43 1hg1 s SER 254 Ca 0.00 2.67 0.06 0.00 0.48 0.00 0.00 55.95 59.15 1hg1 s SER 254 Cb 0.00 -2.63 -0.01 0.00 0.10 0.00 0.00 66.02 63.48 1hg1 s SER 254 CO 0.00 -1.19 -0.20 -0.69 0.98 0.00 0.00 173.24 172.13 1hg1 s VAL 255 N -1.33 1.63 0.92 5.02 1.01 -1.26 -3.56 120.40 122.83 1hg1 s VAL 255 Ca 0.65 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 1hg1 s VAL 255 Cb -0.38 -1.37 0.16 0.00 0.00 0.00 0.00 36.38 34.79 1hg1 s VAL 255 CO 0.47 0.46 1.24 -0.94 0.00 0.00 0.00 175.10 176.33 1hg1 s SER 256 N -0.30 3.50 0.40 3.32 1.04 -1.26 -4.78 113.70 115.63 1hg1 s SER 256 Ca 0.03 0.55 0.10 0.00 0.48 0.00 0.00 55.95 57.11 1hg1 s SER 256 Cb -0.10 -0.82 0.85 0.00 0.10 0.00 0.00 66.02 66.06 1hg1 s SER 256 CO 0.01 -2.52 1.96 -0.37 0.98 0.00 0.00 173.24 173.30 1hg1 h VAL 257 N -1.49 1.15 -0.02 5.02 -1.51 -1.99 -0.64 116.25 116.76 1hg1 h VAL 257 Ca -0.46 -0.61 -0.26 0.00 -1.23 0.00 0.00 66.70 64.15 1hg1 h VAL 257 Cb 1.28 1.08 0.02 0.00 -2.13 0.00 0.00 31.29 31.54 1hg1 h VAL 257 CO 0.50 0.20 -1.00 0.03 -1.23 0.00 0.00 177.57 176.07 1hg1 h ARG 258 N 0.25 0.69 -0.34 5.19 3.08 -1.92 -2.69 114.38 118.64 1hg1 h ARG 258 Ca 0.06 -0.71 -0.11 0.00 0.07 0.00 0.00 59.98 59.28 1hg1 h ARG 258 Cb 0.27 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1hg1 h ARG 258 CO 0.01 1.30 -0.22 0.78 -1.07 0.00 0.00 179.97 180.77 1hg1 h GLY 259 N 0.51 0.72 1.03 0.04 0.00 -1.70 -1.71 103.07 101.96 1hg1 h GLY 259 Ca -0.11 -0.60 -0.09 0.00 0.00 0.00 0.00 47.33 46.52 1hg1 h GLY 259 CO 0.19 0.55 -0.04 -2.22 0.00 0.00 0.00 176.54 175.03 1hg1 h ILE 260 N 0.59 1.27 -0.71 2.60 2.04 -1.16 0.82 117.51 122.95 1hg1 h ILE 260 Ca 0.08 -1.15 -0.06 0.00 1.00 0.00 0.00 64.86 64.74 1hg1 h ILE 260 Cb 0.70 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1hg1 h ILE 260 CO 0.05 0.40 0.22 0.00 0.00 0.00 0.00 178.15 178.83 1hg1 h ALA 261 N 0.93 1.05 -0.50 1.87 0.00 -1.34 0.10 119.26 121.36 1hg1 h ALA 261 Ca 0.14 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1hg1 h ALA 261 Cb 0.57 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1hg1 h ALA 261 CO 0.03 0.64 -0.18 0.78 0.00 0.00 0.00 179.25 180.52 1hg1 h GLY 262 N 1.10 1.10 1.10 0.00 0.00 -0.97 -1.90 103.07 103.49 1hg1 h GLY 262 Ca 0.23 -0.95 -0.11 0.00 0.00 0.00 0.00 47.33 46.50 1hg1 h GLY 262 CO -0.01 0.86 -0.07 -0.33 0.00 0.00 0.00 176.54 176.99 1hg1 h MET 263 N 0.88 1.06 -0.56 4.80 2.07 -0.35 -1.80 114.93 121.03 1hg1 h MET 263 Ca 0.12 -0.37 -0.08 0.00 -2.07 0.00 0.00 59.70 57.30 1hg1 h MET 263 Cb 0.76 -0.08 -0.02 0.00 -1.87 0.00 0.00 31.60 30.39 1hg1 h MET 263 CO 0.06 1.07 0.04 0.00 1.07 0.00 0.00 176.91 179.15 1hg1 h ARG 264 N 0.95 0.93 -0.45 1.72 3.08 -0.89 0.72 114.38 120.44 1hg1 h ARG 264 Ca 0.15 -0.26 -0.08 0.00 0.07 0.00 0.00 59.98 59.87 1hg1 h ARG 264 Cb 0.65 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 1hg1 h ARG 264 CO 0.04 0.90 -0.05 -0.22 -1.07 0.00 0.00 179.97 179.58 1hg1 h LYS 265 N 0.87 0.76 -0.36 0.04 3.64 -1.17 0.20 116.57 120.55 1hg1 h LYS 265 Ca 0.17 -0.22 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 1hg1 h LYS 265 Cb 0.46 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1hg1 h LYS 265 CO 0.02 0.80 0.06 0.00 -2.27 0.00 0.00 179.45 178.06 1hg1 h ALA 266 N 1.24 0.47 -0.64 5.00 0.00 -0.70 -1.90 119.26 122.74 1hg1 h ALA 266 Ca 0.13 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1hg1 h ALA 266 Cb 0.50 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1hg1 h ALA 266 CO 0.03 0.17 0.13 -0.07 0.00 0.00 0.00 179.25 179.51 1hg1 h LEU 267 N 0.43 0.98 -1.72 0.00 3.38 -0.62 -0.23 115.31 117.52 1hg1 h LEU 267 Ca 0.11 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1hg1 h LEU 267 Cb 0.35 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1hg1 h LEU 267 CO 0.01 0.96 -0.15 -0.33 0.09 0.00 0.00 178.44 179.01 1hg1 h GLU 268 N 0.98 0.00 -0.65 1.13 5.08 -0.77 -2.30 114.58 118.05 1hg1 h GLU 268 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1hg1 h GLU 268 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1hg1 h GLU 268 CO 0.01 0.15 0.00 1.63 -1.00 0.00 0.00 179.01 179.80 1hg1 n LYS 269 N -4.27 3.52 -0.95 2.33 4.76 -0.73 -4.93 118.16 117.89 1hg1 n LYS 269 Ca -0.02 -2.33 0.00 0.00 -2.87 0.00 0.00 58.31 53.09 1hg1 n LYS 269 Cb 0.22 -1.90 0.00 0.00 -1.84 0.00 0.00 35.03 31.51 1hg1 n LYS 269 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hg1 n GLY 270 N 0.76 0.55 3.79 0.72 0.00 -0.87 -5.04 105.19 105.12 1hg1 n GLY 270 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 1hg1 n GLY 270 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hg1 s VAL 271 N -2.11 4.50 -0.15 1.61 1.01 -0.17 -4.96 120.40 120.12 1hg1 s VAL 271 Ca 0.00 1.50 -0.21 0.00 0.00 0.00 0.00 61.98 63.27 1hg1 s VAL 271 Cb 0.00 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1hg1 s VAL 271 CO 0.00 0.47 0.63 -0.69 0.00 0.00 0.00 175.10 175.51 1hg1 s VAL 272 N -1.22 5.05 -0.20 2.92 1.01 -0.67 -4.07 120.40 123.22 1hg1 s VAL 272 Ca 0.36 1.23 -0.06 0.00 0.00 0.00 0.00 61.98 63.51 1hg1 s VAL 272 Cb -0.21 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 1hg1 s VAL 272 CO 0.23 0.18 0.03 -0.69 0.00 0.00 0.00 175.10 174.85 1hg1 s VAL 273 N 1.41 4.26 -0.20 2.92 1.01 -1.26 -0.97 120.40 127.58 1hg1 s VAL 273 Ca 0.31 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1hg1 s VAL 273 Cb -0.16 -2.94 0.02 0.00 0.00 0.00 0.00 36.38 33.31 1hg1 s VAL 273 CO 0.12 0.42 -0.17 -0.32 0.00 0.00 0.00 175.10 175.16 1hg1 s MET 274 N 0.91 2.90 -0.38 2.72 -2.45 -0.24 -0.33 119.30 122.43 1hg1 s MET 274 Ca 0.02 -0.90 -0.19 0.00 -1.25 0.00 0.00 55.69 53.37 1hg1 s MET 274 Cb -0.14 -2.67 0.01 0.00 1.25 0.00 0.00 34.83 33.28 1hg1 s MET 274 CO 0.02 -0.27 0.57 1.03 1.05 0.00 0.00 175.02 177.42 1hg1 s ARG 275 N 1.28 3.49 0.00 4.11 0.52 0.79 -0.24 118.95 128.90 1hg1 s ARG 275 Ca 0.03 -0.23 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 1hg1 s ARG 275 Cb -0.14 -3.86 0.00 0.00 0.52 0.00 0.00 34.95 31.46 1hg1 s ARG 275 CO -0.11 -0.78 0.00 0.45 0.02 0.00 0.00 175.30 174.88 1hg1 n SER 276 N 5.94 0.62 -3.93 0.23 2.88 0.18 -1.53 113.62 118.00 1hg1 n SER 276 Ca -0.03 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.41 1hg1 n SER 276 Cb 0.48 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.83 1hg1 n SER 276 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1hg1 s THR 277 N 1.89 0.09 -0.92 2.46 -1.32 -1.25 -2.21 115.64 114.38 1hg1 s THR 277 Ca 0.00 -0.74 0.25 0.00 -1.21 0.00 0.00 61.69 59.98 1hg1 s THR 277 Cb 0.00 -0.30 0.01 0.00 -1.51 0.00 0.00 72.50 70.70 1hg1 s THR 277 CO 0.00 -0.41 1.38 -2.11 -2.21 0.00 0.00 174.62 171.27 1hg1 n ARG 278 N 1.70 0.06 -0.34 7.08 1.85 0.25 -4.28 116.66 122.98 1hg1 n ARG 278 Ca -0.22 0.01 0.03 0.00 -1.00 0.00 0.00 57.85 56.67 1hg1 n ARG 278 Cb 0.56 -1.53 0.17 0.00 -1.05 0.00 0.00 32.46 30.60 1hg1 n ARG 278 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1hg1 h THR 279 N 0.00 1.03 0.00 8.89 1.35 -1.84 -3.47 112.91 118.87 1hg1 h THR 279 Ca 0.00 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.50 1hg1 h THR 279 Cb 0.55 -0.11 0.00 0.00 -1.73 0.00 0.00 68.15 66.87 1hg1 h THR 279 CO 0.00 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.07 1hg1 n GLY 280 N -1.34 2.38 3.39 5.82 0.00 -1.26 -5.09 105.19 109.08 1hg1 n GLY 280 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1hg1 n GLY 280 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hg1 s ASN 281 N -1.84 -0.17 0.00 1.61 0.01 -1.26 -4.96 114.94 108.33 1hg1 s ASN 281 Ca 0.00 -0.50 0.00 0.00 -0.71 0.00 0.00 52.86 51.65 1hg1 s ASN 281 Cb 0.00 0.50 0.00 0.00 0.41 0.00 0.00 41.25 42.16 1hg1 s ASN 281 CO 0.00 -0.92 0.00 0.61 -1.51 0.00 0.00 177.10 175.28 1hg1 n GLY 282 N -0.25 0.16 3.72 0.66 0.00 -1.26 -4.99 105.19 103.23 1hg1 n GLY 282 Ca -0.12 -1.98 -0.36 0.00 0.00 0.00 0.00 46.02 43.55 1hg1 n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hg1 s ILE 283 N -1.15 5.31 -0.45 -0.61 -1.09 -1.26 -4.05 121.20 117.91 1hg1 s ILE 283 Ca 0.00 0.52 -0.15 0.00 -2.23 0.00 0.00 60.65 58.79 1hg1 s ILE 283 Cb 0.00 -3.62 0.05 0.00 -1.58 0.00 0.00 42.46 37.31 1hg1 s ILE 283 CO 0.00 0.38 0.35 -0.69 -1.23 0.00 0.00 174.94 173.76 1hg1 s VAL 284 N 0.53 5.23 0.66 2.92 1.01 -0.65 -4.90 120.40 125.20 1hg1 s VAL 284 Ca 0.16 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.13 1hg1 s VAL 284 Cb -0.13 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 1hg1 s VAL 284 CO 0.04 -0.46 1.05 -2.16 0.00 0.00 0.00 175.10 173.56 1hg1 s PRO 285 N 1.65 3.18 0.53 2.72 0.04 -1.26 -3.58 135.00 138.28 1hg1 s PRO 285 Ca 0.04 0.91 -0.22 0.00 0.04 0.00 0.00 61.00 61.78 1hg1 s PRO 285 Cb -0.22 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 1hg1 s PRO 285 CO 0.08 -0.91 1.30 -2.14 0.04 0.00 0.00 177.00 175.37 1hg1 s PRO 286 N -5.00 3.27 -0.25 0.56 0.02 -1.26 -4.89 135.00 127.44 1hg1 s PRO 286 Ca 0.57 2.09 -0.02 0.00 0.02 0.00 0.00 61.00 63.67 1hg1 s PRO 286 Cb -0.13 -2.26 0.13 0.00 0.02 0.00 0.00 34.50 32.26 1hg1 s PRO 286 CO 0.53 -1.04 0.33 0.34 -0.33 0.00 0.00 177.00 176.83 1hg1 s ASP 287 N -1.10 0.84 0.13 2.53 -1.08 -1.26 -5.02 116.67 111.70 1hg1 s ASP 287 Ca 0.70 -0.20 0.16 0.00 -0.52 0.00 0.00 52.55 52.69 1hg1 s ASP 287 Cb -0.37 0.82 0.72 0.00 -1.46 0.00 0.00 42.92 42.63 1hg1 s ASP 287 CO 0.43 -0.34 1.50 -0.62 0.52 0.00 0.00 175.17 176.66 1hg1 n GLU 288 N 5.34 0.08 -0.16 4.34 1.02 -1.26 -2.26 120.64 127.75 1hg1 n GLU 288 Ca -0.03 0.40 0.11 0.00 -0.02 0.00 0.00 57.16 57.63 1hg1 n GLU 288 Cb 0.49 -1.69 0.26 0.00 -0.02 0.00 0.00 31.44 30.48 1hg1 n GLU 288 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1hg1 n GLU 289 N -1.85 2.27 -4.63 3.49 1.02 -1.26 -4.89 120.64 114.78 1hg1 n GLU 289 Ca 0.02 -1.91 -0.26 0.00 -0.02 0.00 0.00 57.16 54.99 1hg1 n GLU 289 Cb 0.14 -1.47 -0.14 0.00 -0.02 0.00 0.00 31.44 29.95 1hg1 n GLU 289 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1hg1 s LEU 290 N -1.51 2.18 0.81 -4.62 1.43 -0.96 -5.14 118.68 110.87 1hg1 s LEU 290 Ca 0.36 -0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 52.81 1hg1 s LEU 290 Cb 0.21 -0.99 0.08 0.00 0.03 0.00 0.00 46.19 45.52 1hg1 s LEU 290 CO 0.30 0.16 1.09 -2.16 0.23 0.00 0.00 176.35 175.97 1hg1 s PRO 291 N -1.24 2.00 0.01 1.29 0.04 -1.26 -4.88 135.00 130.97 1hg1 s PRO 291 Ca 0.08 0.71 0.00 0.00 0.04 0.00 0.00 61.00 61.83 1hg1 s PRO 291 Cb -0.09 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1hg1 s PRO 291 CO 0.02 -1.69 0.00 0.41 0.04 0.00 0.00 177.00 175.78 1hg1 n GLY 292 N -1.89 -1.41 4.02 0.56 0.00 -1.26 -4.90 105.19 100.31 1hg1 n GLY 292 Ca 0.07 -1.52 -0.18 0.00 0.00 0.00 0.00 46.02 44.39 1hg1 n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hg1 s LEU 293 N -2.69 3.38 0.11 0.99 1.43 0.55 -4.92 118.68 117.53 1hg1 s LEU 293 Ca 0.00 -0.61 0.09 0.00 -1.03 0.00 0.00 54.13 52.58 1hg1 s LEU 293 Cb 0.00 -2.17 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 1hg1 s LEU 293 CO 0.00 -1.06 -0.19 0.68 0.23 0.00 0.00 176.35 176.01 1hg1 s VAL 294 N -2.52 2.77 -1.93 -1.59 -7.23 -1.26 -0.15 120.40 108.48 1hg1 s VAL 294 Ca 0.58 -1.49 0.11 0.00 -1.81 0.00 0.00 61.98 59.38 1hg1 s VAL 294 Cb -0.08 -2.25 0.33 0.00 0.56 0.00 0.00 36.38 34.95 1hg1 s VAL 294 CO 0.36 0.13 1.27 -1.54 -0.31 0.00 0.00 175.10 175.01 1hg1 n SER 295 N 0.92 2.07 0.00 4.85 3.41 -0.58 -4.83 113.62 119.45 1hg1 n SER 295 Ca -0.16 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.43 1hg1 n SER 295 Cb 0.53 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1hg1 n SER 295 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1hg1 n ASP 296 N 0.58 0.00 -1.42 4.04 -0.08 -1.23 -1.18 116.55 117.26 1hg1 n ASP 296 Ca 0.13 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.51 1hg1 n ASP 296 Cb 0.34 0.00 0.33 0.00 2.34 0.00 0.00 41.12 44.12 1hg1 n ASP 296 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1hg1 n SER 297 N 3.41 4.16 -4.71 1.67 3.41 -1.26 -1.64 113.62 118.66 1hg1 n SER 297 Ca 0.00 -2.21 -0.42 0.00 -0.26 0.00 0.00 58.87 55.98 1hg1 n SER 297 Cb 0.00 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.40 1hg1 n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1hg1 s LEU 298 N -1.39 4.35 0.96 1.04 1.02 -0.32 -4.71 118.68 119.64 1hg1 s LEU 298 Ca 0.48 1.83 -0.14 0.00 0.02 0.00 0.00 54.13 56.32 1hg1 s LEU 298 Cb 0.28 -3.57 0.17 0.00 0.02 0.00 0.00 46.19 43.09 1hg1 s LEU 298 CO 0.28 -0.40 1.18 0.54 0.02 0.00 0.00 176.35 177.96 1hg1 s ASN 299 N 1.09 3.11 0.22 2.29 2.20 -1.26 -4.61 114.94 117.98 1hg1 s ASN 299 Ca 0.55 0.74 -0.08 0.00 -0.94 0.00 0.00 52.86 53.13 1hg1 s ASN 299 Cb -0.25 -1.14 0.35 0.00 -2.00 0.00 0.00 41.25 38.21 1hg1 s ASN 299 CO 0.27 -2.78 1.71 -0.65 -2.94 0.00 0.00 177.10 172.72 1hg1 h PRO 300 N -1.66 0.31 -0.29 3.55 0.11 -1.94 0.25 132.00 132.34 1hg1 h PRO 300 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1hg1 h PRO 300 Cb 1.30 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1hg1 h PRO 300 CO 0.53 0.20 0.13 0.00 -0.21 0.00 0.00 178.00 178.65 1hg1 h ALA 301 N 1.50 0.37 -0.35 -0.75 0.00 -1.96 -1.28 119.26 116.79 1hg1 h ALA 301 Ca 0.35 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 1hg1 h ALA 301 Cb 0.52 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1hg1 h ALA 301 CO -0.41 -0.06 -0.09 0.45 0.00 0.00 0.00 179.25 179.15 1hg1 h HIS 302 N 0.33 0.77 -0.89 0.00 3.86 -1.83 -2.95 115.15 114.43 1hg1 h HIS 302 Ca 0.10 -0.17 0.06 0.00 -1.16 0.00 0.00 60.37 59.20 1hg1 h HIS 302 Cb 0.14 -0.19 -0.06 0.00 1.06 0.00 0.00 27.41 28.36 1hg1 h HIS 302 CO -0.02 0.85 0.58 0.00 0.86 0.00 0.00 177.93 180.20 1hg1 h ALA 303 N 0.82 1.50 -0.56 2.45 0.00 -0.37 -1.57 119.26 121.53 1hg1 h ALA 303 Ca 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1hg1 h ALA 303 Cb 0.60 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1hg1 h ALA 303 CO 0.04 0.38 0.10 -0.09 0.00 0.00 0.00 179.25 179.68 1hg1 h ARG 304 N 1.04 0.92 -0.29 0.00 2.43 -1.15 -0.42 114.38 116.90 1hg1 h ARG 304 Ca 0.37 -0.24 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1hg1 h ARG 304 Cb 0.15 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1hg1 h ARG 304 CO -0.13 0.88 0.15 0.82 -1.51 0.00 0.00 179.97 180.18 1hg1 h ILE 305 N 0.81 1.14 -0.36 1.20 1.08 -1.19 -1.09 117.51 119.09 1hg1 h ILE 305 Ca 0.17 -0.39 -0.11 0.00 -0.39 0.00 0.00 64.86 64.14 1hg1 h ILE 305 Cb 0.40 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 1hg1 h ILE 305 CO 0.01 0.14 -0.24 0.25 -0.69 0.00 0.00 178.15 177.62 1hg1 h LEU 306 N 0.35 0.74 -0.55 1.44 5.85 -1.22 -2.56 115.31 119.34 1hg1 h LEU 306 Ca 0.10 -0.27 -0.10 0.00 0.84 0.00 0.00 57.88 58.46 1hg1 h LEU 306 Cb 0.09 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 1hg1 h LEU 306 CO -0.01 0.95 -0.03 0.25 -0.34 0.00 0.00 178.44 179.26 1hg1 h LEU 307 N 0.63 0.98 -0.23 2.25 5.85 -0.87 0.91 115.31 124.83 1hg1 h LEU 307 Ca 0.09 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1hg1 h LEU 307 Cb 0.74 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1hg1 h LEU 307 CO 0.06 1.07 0.15 0.24 -0.34 0.00 0.00 178.44 179.61 1hg1 h MET 308 N 0.88 0.31 -0.67 1.25 2.86 -1.11 -0.88 114.93 117.56 1hg1 h MET 308 Ca 0.15 -0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1hg1 h MET 308 Cb 0.58 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.15 1hg1 h MET 308 CO 0.03 0.22 0.19 -0.07 1.06 0.00 0.00 176.91 178.35 1hg1 h LEU 309 N 0.30 0.99 -0.81 1.22 3.38 -1.31 -2.83 115.31 116.25 1hg1 h LEU 309 Ca 0.08 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1hg1 h LEU 309 Cb -0.01 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 1hg1 h LEU 309 CO -0.02 0.95 0.50 0.00 0.09 0.00 0.00 178.44 179.97 1hg1 h ALA 310 N 1.08 1.03 0.00 1.53 0.00 -0.52 -2.13 119.26 120.25 1hg1 h ALA 310 Ca 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1hg1 h ALA 310 Cb 0.32 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1hg1 h ALA 310 CO -0.00 0.47 0.00 -0.07 0.00 0.00 0.00 179.25 179.65 1hg1 h LEU 311 N 1.10 0.00 -0.13 0.00 3.38 -0.92 -0.44 115.31 118.31 1hg1 h LEU 311 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1hg1 h LEU 311 Cb -0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1hg1 h LEU 311 CO -0.06 0.00 0.00 0.71 0.09 0.00 0.00 178.44 179.18 1hg1 h THR 312 N 0.00 0.00 0.00 0.22 1.35 -1.30 -3.34 112.91 109.84 1hg1 h THR 312 Ca 0.00 -0.60 -0.25 0.00 -0.55 0.00 0.00 66.41 65.01 1hg1 h THR 312 Cb 0.20 1.57 -0.05 0.00 -1.73 0.00 0.00 68.15 68.15 1hg1 h THR 312 CO 0.00 0.00 -1.96 0.54 -0.25 0.00 0.00 175.52 173.85 1hg1 n ARG 313 N -2.52 1.22 -3.82 4.72 1.74 -0.31 -5.09 116.66 112.60 1hg1 n ARG 313 Ca 0.05 0.04 -0.07 0.00 -0.77 0.00 0.00 57.85 57.10 1hg1 n ARG 313 Cb 0.43 -1.35 -0.02 0.00 -1.02 0.00 0.00 32.46 30.51 1hg1 n ARG 313 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1hg1 s THR 314 N -2.34 0.00 0.00 0.55 -1.32 -0.43 -5.01 115.64 107.10 1hg1 s THR 314 Ca -0.14 -0.90 0.00 0.00 -1.21 0.00 0.00 61.69 59.45 1hg1 s THR 314 Cb 0.05 -1.94 0.00 0.00 -1.51 0.00 0.00 72.50 69.09 1hg1 s THR 314 CO 0.49 0.00 0.72 -1.20 -2.21 0.00 0.00 174.62 172.42 1hg1 n SER 315 N -0.46 1.25 -4.60 8.08 7.64 -1.26 -3.93 113.62 120.34 1hg1 n SER 315 Ca -0.05 -1.51 -0.43 0.00 1.01 0.00 0.00 58.87 57.89 1hg1 n SER 315 Cb 0.60 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.77 1hg1 n SER 315 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1hg1 s ASP 316 N -0.51 6.32 0.23 6.43 -1.08 -1.26 -4.93 116.67 121.87 1hg1 s ASP 316 Ca 0.00 0.87 -0.06 0.00 -0.52 0.00 0.00 52.55 52.83 1hg1 s ASP 316 Cb 0.00 -2.54 0.41 0.00 -1.46 0.00 0.00 42.92 39.33 1hg1 s ASP 316 CO 0.00 -1.44 1.70 -0.65 0.52 0.00 0.00 175.17 175.30 1hg1 h PRO 317 N 10.80 0.29 -0.47 4.34 0.11 -1.98 -0.35 132.00 144.73 1hg1 h PRO 317 Ca -0.28 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.83 1hg1 h PRO 317 Cb 1.11 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 1hg1 h PRO 317 CO 1.08 0.19 0.29 0.87 -0.21 0.00 0.00 178.00 180.22 1hg1 h LYS 318 N 0.30 0.57 -0.11 1.05 1.57 -1.99 0.14 116.57 118.10 1hg1 h LYS 318 Ca 0.39 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 59.12 1hg1 h LYS 318 Cb 0.63 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 1hg1 h LYS 318 CO -0.46 0.38 0.00 0.28 -0.57 0.00 0.00 179.45 179.08 1hg1 h VAL 319 N 0.59 1.24 -0.58 0.50 2.07 -1.76 -2.04 116.25 116.27 1hg1 h VAL 319 Ca 0.18 -0.77 0.02 0.00 0.82 0.00 0.00 66.70 66.95 1hg1 h VAL 319 Cb -0.02 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.26 1hg1 h VAL 319 CO -0.06 0.22 0.37 0.40 0.02 0.00 0.00 177.57 178.51 1hg1 h ILE 320 N -0.08 1.10 -0.80 4.57 2.04 -0.93 -1.17 117.51 122.23 1hg1 h ILE 320 Ca 0.03 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.67 1hg1 h ILE 320 Cb 0.34 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 36.67 1hg1 h ILE 320 CO 0.00 0.13 0.51 -0.61 0.00 0.00 0.00 178.15 178.19 1hg1 h GLN 321 N 0.73 0.97 -0.14 2.37 5.75 -0.64 -1.25 115.11 122.90 1hg1 h GLN 321 Ca 0.23 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.60 1hg1 h GLN 321 Cb -0.02 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.30 1hg1 h GLN 321 CO -0.08 0.64 -0.25 1.49 -2.65 0.00 0.00 178.83 177.99 1hg1 h GLU 322 N 1.00 0.24 -0.40 1.69 4.57 -0.73 -2.26 114.58 118.70 1hg1 h GLU 322 Ca 0.32 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.42 1hg1 h GLU 322 Cb 0.00 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 1hg1 h GLU 322 CO -0.11 0.48 0.24 1.88 -1.18 0.00 0.00 179.01 180.32 1hg1 h TYR 323 N 0.22 0.53 0.00 0.92 0.05 -0.09 -2.23 116.97 116.36 1hg1 h TYR 323 Ca 0.04 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1hg1 h TYR 323 Cb 0.56 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.13 1hg1 h TYR 323 CO 0.01 0.38 0.00 0.74 -1.05 0.00 0.00 178.16 178.23 1hg1 h PHE 324 N 0.52 0.00 -0.00 4.88 -1.00 -0.80 0.13 116.94 120.67 1hg1 h PHE 324 Ca 0.14 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.92 1hg1 h PHE 324 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1hg1 h PHE 324 CO -0.03 0.00 -0.68 0.72 -1.61 0.00 0.00 178.31 176.70 1hg1 n HIS 325 N -3.00 0.00 0.00 -0.55 8.25 -0.91 -4.50 115.22 114.51 1hg1 n HIS 325 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1hg1 n HIS 325 Cb 0.18 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1hg1 n HIS 325 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1hg1 n THR 326 N -1.15 0.00 0.61 1.59 -2.24 -0.78 -5.07 114.28 107.24 1hg1 n THR 326 Ca 0.06 -0.07 0.07 0.00 -2.27 0.00 0.00 64.05 61.84 1hg1 n THR 326 Cb 0.36 0.55 0.06 0.00 -2.10 0.00 0.00 70.33 69.20 1hg1 n THR 326 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28