#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 3.46 -0.33 3.23 0.04 -1.26 -4.57 135.00 135.57 1hg1 s PRO 5 Ca 0.00 1.55 -0.20 0.00 0.04 0.00 0.00 61.00 62.39 1hg1 s PRO 5 Cb 0.00 -2.03 -0.00 0.00 0.04 0.00 0.00 34.50 32.51 1hg1 s PRO 5 CO 0.00 -0.75 0.63 -0.80 0.04 0.00 0.00 177.00 176.12 1hg1 s ASN 6 N -1.82 6.47 -0.10 6.66 0.01 -1.26 -0.87 114.94 124.03 1hg1 s ASN 6 Ca 0.71 0.32 0.04 0.00 -0.71 0.00 0.00 52.86 53.22 1hg1 s ASN 6 Cb -0.22 -2.33 0.00 0.00 0.41 0.00 0.00 41.25 39.11 1hg1 s ASN 6 CO 0.25 -0.53 -0.23 -0.63 -1.51 0.00 0.00 177.10 174.46 1hg1 s ILE 7 N 2.65 2.00 -0.21 0.60 -1.09 -0.36 -0.87 121.20 123.92 1hg1 s ILE 7 Ca 0.25 -0.98 -0.09 0.00 -2.23 0.00 0.00 60.65 57.60 1hg1 s ILE 7 Cb -0.15 -1.73 -0.05 0.00 -1.58 0.00 0.00 42.46 38.95 1hg1 s ILE 7 CO 0.13 0.55 0.12 -0.69 -1.23 0.00 0.00 174.94 173.81 1hg1 s VAL 8 N 0.40 5.20 -0.35 2.92 1.01 -0.94 -1.04 120.40 127.58 1hg1 s VAL 8 Ca -0.18 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 1hg1 s VAL 8 Cb -0.18 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.84 1hg1 s VAL 8 CO 0.08 0.42 0.19 -0.63 0.00 0.00 0.00 175.10 175.16 1hg1 s ILE 9 N 0.55 4.61 -0.32 2.22 1.01 -0.18 -0.96 121.20 128.12 1hg1 s ILE 9 Ca 0.06 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 59.87 1hg1 s ILE 9 Cb -0.12 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 1hg1 s ILE 9 CO 0.00 -0.14 0.31 -0.76 0.00 0.00 0.00 174.94 174.35 1hg1 s LEU 10 N 1.58 4.34 -0.09 2.97 1.43 0.11 -1.26 118.68 127.75 1hg1 s LEU 10 Ca 0.03 -0.17 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 1hg1 s LEU 10 Cb -0.18 -2.27 -0.05 0.00 0.03 0.00 0.00 46.19 43.72 1hg1 s LEU 10 CO 0.07 -0.25 0.37 0.00 0.23 0.00 0.00 176.35 176.77 1hg1 s ALA 11 N 1.91 3.62 0.00 4.21 0.00 -0.14 -1.15 121.76 130.22 1hg1 s ALA 11 Ca 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1hg1 s ALA 11 Cb -0.17 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.53 1hg1 s ALA 11 CO 0.11 0.23 0.00 0.25 0.00 0.00 0.00 175.76 176.35 1hg1 n THR 12 N 2.92 0.00 0.00 0.00 -2.24 -0.90 -0.51 114.28 113.55 1hg1 n THR 12 Ca -0.12 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1hg1 n THR 12 Cb 0.52 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 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 2.03 0.76 0.00 3.38 0.00 -1.25 -1.53 105.19 108.57 1hg1 n GLY 13 Ca 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.96 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 0.00 2.69 0.34 -0.02 0.00 -1.21 -3.19 105.19 103.79 1hg1 n GLY 14 Ca 0.00 -1.95 0.19 0.00 0.00 0.00 0.00 46.02 44.26 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 0.05 0.00 2.61 2.02 -1.84 -0.63 112.91 115.12 1hg1 h THR 15 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1hg1 h THR 15 Cb 0.00 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.22 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 -3.06 1.44 -1.97 3.11 3.06 -1.26 -1.46 119.36 119.23 1hg1 n ILE 16 Ca -0.02 0.36 0.02 0.00 -2.50 0.00 0.00 62.75 60.61 1hg1 n ILE 16 Cb 0.26 -1.27 0.03 0.00 0.54 0.00 0.00 39.64 39.19 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 -1.44 2.14 -3.21 1.51 0.00 -0.25 -4.58 120.51 114.68 1hg1 n ALA 17 Ca 0.02 -1.48 -0.43 0.00 0.00 0.00 0.00 53.44 51.54 1hg1 n ALA 17 Cb 0.06 -0.52 -0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 18 N -0.11 4.66 0.00 0.00 0.00 -0.53 -4.89 105.19 104.32 1hg1 n GLY 18 Ca 0.03 -2.63 0.00 0.00 0.00 0.00 0.00 46.02 43.42 1hg1 n GLY 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hg1 n LEU 34 N 2.00 0.00 -4.74 0.99 4.77 -1.26 -1.75 117.00 117.01 1hg1 n LEU 34 Ca 0.25 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.94 1hg1 n LEU 34 Cb 0.36 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.59 1hg1 n LEU 34 CO 0.58 0.00 0.68 -0.83 -1.33 0.00 0.00 177.39 176.49 1hg1 s GLY 35 N 0.00 1.60 0.40 -0.72 0.00 -1.26 -4.89 107.32 102.45 1hg1 s GLY 35 Ca 0.00 -0.24 0.13 0.00 0.00 0.00 0.00 44.72 44.61 1hg1 s GLY 35 CO 0.00 0.27 1.89 -0.24 0.00 0.00 0.00 173.10 175.02 1hg1 h VAL 36 N -1.51 1.22 -0.17 1.40 3.04 -1.98 -2.17 116.25 116.07 1hg1 h VAL 36 Ca -0.50 -1.03 -0.08 0.00 -1.01 0.00 0.00 66.70 64.08 1hg1 h VAL 36 Cb 1.30 1.55 -0.00 0.00 -2.01 0.00 0.00 31.29 32.12 1hg1 h VAL 36 CO 0.58 0.29 -0.20 0.44 -1.01 0.00 0.00 177.57 177.67 1hg1 h ASP 37 N 0.01 0.46 0.16 3.17 3.32 -1.96 -1.68 116.42 119.91 1hg1 h ASP 37 Ca -0.00 -0.50 -0.03 0.00 0.02 0.00 0.00 57.03 56.52 1hg1 h ASP 37 Cb 0.53 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1hg1 h ASP 37 CO 0.04 0.87 -0.14 0.74 -1.72 0.00 0.00 179.24 179.02 1hg1 h THR 38 N 0.07 1.03 -0.49 0.35 2.02 -1.90 -0.12 112.91 113.87 1hg1 h THR 38 Ca 0.02 -0.50 -0.13 0.00 0.77 0.00 0.00 66.41 66.57 1hg1 h THR 38 Cb 0.75 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1hg1 h THR 38 CO 0.05 0.14 -0.21 0.25 0.37 0.00 0.00 175.52 176.11 1hg1 h LEU 39 N 0.00 1.03 -0.10 2.58 7.12 -1.09 -2.07 115.31 122.78 1hg1 h LEU 39 Ca -0.00 -0.39 -0.15 0.00 0.13 0.00 0.00 57.88 57.47 1hg1 h LEU 39 Cb 0.26 -0.28 0.01 0.00 -0.53 0.00 0.00 40.66 40.12 1hg1 h LEU 39 CO 0.02 1.19 -0.51 0.40 -0.13 0.00 0.00 178.44 179.41 1hg1 h ILE 40 N 0.86 1.37 0.00 4.05 2.04 -0.37 -3.21 117.51 122.25 1hg1 h ILE 40 Ca 0.11 -1.84 -0.02 0.00 1.00 0.00 0.00 64.86 64.11 1hg1 h ILE 40 Cb 0.79 2.21 -0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1hg1 h ILE 40 CO 0.07 0.55 -0.11 0.78 0.00 0.00 0.00 178.15 179.44 1hg1 h ASN 41 N 0.11 0.00 0.61 1.72 -0.26 -1.04 -0.88 115.58 115.84 1hg1 h ASN 41 Ca -0.04 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.67 1hg1 h ASN 41 Cb 1.16 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.42 1hg1 h ASN 41 CO 0.11 0.11 -0.14 0.00 -1.06 0.00 0.00 177.43 176.44 1hg1 h ALA 42 N 1.89 1.14 -2.15 -0.83 0.00 -1.37 -3.29 119.26 114.66 1hg1 h ALA 42 Ca -0.00 -0.13 -0.58 0.00 0.00 0.00 0.00 54.91 54.20 1hg1 h ALA 42 Cb 0.21 -0.02 -0.40 0.00 0.00 0.00 0.00 17.79 17.58 1hg1 h ALA 42 CO 0.01 0.18 -0.93 1.55 0.00 0.00 0.00 179.25 180.06 1hg1 n VAL 43 N -3.47 0.18 0.17 0.00 3.14 -0.34 -4.95 118.33 113.06 1hg1 n VAL 43 Ca -0.01 -4.31 0.19 0.00 -2.96 0.00 0.00 64.34 57.25 1hg1 n VAL 43 Cb 0.30 -1.97 0.79 0.00 -1.06 0.00 0.00 33.84 31.90 1hg1 n VAL 43 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 1hg1 h PRO 44 N 4.31 0.00 -0.29 1.45 0.11 -1.60 -2.20 132.00 133.78 1hg1 h PRO 44 Ca 0.13 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.33 1hg1 h PRO 44 Cb 0.82 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.92 1hg1 h PRO 44 CO 0.56 0.00 0.27 0.93 -0.21 0.00 0.00 178.00 179.56 1hg1 h GLU 45 N 0.00 0.00 -0.23 1.05 3.07 -1.92 -1.22 114.58 115.33 1hg1 h GLU 45 Ca 0.13 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.95 1hg1 h GLU 45 Cb 0.84 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.74 1hg1 h GLU 45 CO -0.00 0.00 -0.03 -0.39 -1.40 0.00 0.00 179.01 177.19 1hg1 h VAL 46 N 0.00 1.16 0.00 3.13 -1.51 -1.73 -1.76 116.25 115.55 1hg1 h VAL 46 Ca 0.14 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.96 1hg1 h VAL 46 Cb 0.69 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 30.88 1hg1 h VAL 46 CO -0.00 0.22 0.00 0.29 -1.23 0.00 0.00 177.57 176.84 1hg1 n LYS 47 N -4.32 0.16 0.11 5.19 5.02 -0.46 -0.87 118.16 122.99 1hg1 n LYS 47 Ca 0.00 0.56 0.12 0.00 -2.02 0.00 0.00 58.31 56.97 1hg1 n LYS 47 Cb 0.22 -1.93 0.03 0.00 -0.02 0.00 0.00 35.03 33.33 1hg1 n LYS 47 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1hg1 h LYS 48 N 0.00 0.00 0.00 1.97 1.57 -1.46 -3.34 116.57 115.31 1hg1 h LYS 48 Ca 0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1hg1 h LYS 48 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1hg1 h LYS 48 CO 0.00 0.00 -1.40 1.28 -0.57 0.00 0.00 179.45 178.76 1hg1 n LEU 49 N -2.67 0.64 -3.73 2.94 4.77 -0.05 -5.03 117.00 113.87 1hg1 n LEU 49 Ca 0.01 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1hg1 n LEU 49 Cb 0.54 0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1hg1 n LEU 49 CO 0.39 -0.01 0.97 0.00 -1.33 0.00 0.00 177.39 177.41 1hg1 s ALA 50 N -3.21 -2.08 -0.77 -1.18 0.00 -0.87 -4.47 121.76 109.19 1hg1 s ALA 50 Ca -0.03 0.36 -0.19 0.00 0.00 0.00 0.00 51.96 52.09 1hg1 s ALA 50 Cb 0.10 0.54 0.12 0.00 0.00 0.00 0.00 23.12 23.88 1hg1 s ALA 50 CO 0.82 -1.07 0.95 -0.80 0.00 0.00 0.00 175.76 175.66 1hg1 s ASN 51 N -3.15 6.42 0.14 0.00 -0.87 -0.05 -4.37 114.94 113.07 1hg1 s ASN 51 Ca 0.17 -1.70 -0.16 0.00 -1.57 0.00 0.00 52.86 49.60 1hg1 s ASN 51 Cb 0.02 -2.36 -0.07 0.00 -0.02 0.00 0.00 41.25 38.82 1hg1 s ASN 51 CO -0.01 -1.12 0.58 0.68 -2.57 0.00 0.00 177.10 174.65 1hg1 s VAL 52 N 2.77 4.80 -0.14 1.60 -7.23 -1.26 -1.22 120.40 119.72 1hg1 s VAL 52 Ca 0.23 0.96 -0.00 0.00 -1.81 0.00 0.00 61.98 61.36 1hg1 s VAL 52 Cb -0.13 -3.78 0.03 0.00 0.56 0.00 0.00 36.38 33.06 1hg1 s VAL 52 CO -0.01 0.29 -0.10 -0.54 -0.31 0.00 0.00 175.10 174.43 1hg1 s LYS 53 N -1.82 1.88 0.26 4.82 -0.14 -0.21 -4.96 119.74 119.57 1hg1 s LYS 53 Ca 0.37 -0.47 -0.22 0.00 -1.36 0.00 0.00 55.97 54.29 1hg1 s LYS 53 Cb -0.16 -1.93 -0.09 0.00 -1.68 0.00 0.00 37.83 33.97 1hg1 s LYS 53 CO 0.19 -0.29 0.81 0.20 -0.76 0.00 0.00 175.35 175.50 1hg1 s GLY 54 N 1.58 2.69 -0.21 -3.33 0.00 -1.26 -1.01 107.32 105.78 1hg1 s GLY 54 Ca 0.04 0.31 -0.08 0.00 0.00 0.00 0.00 44.72 44.98 1hg1 s GLY 54 CO -0.09 0.70 0.45 1.85 0.00 0.00 0.00 173.10 176.01 1hg1 s GLU 55 N -1.98 0.38 -0.61 2.90 2.12 -0.39 -4.92 118.70 116.19 1hg1 s GLU 55 Ca 0.46 1.04 -0.23 0.00 0.36 0.00 0.00 54.97 56.59 1hg1 s GLU 55 Cb -0.18 0.31 0.06 0.00 0.26 0.00 0.00 34.13 34.58 1hg1 s GLU 55 CO 0.22 -0.22 0.95 -1.14 -0.54 0.00 0.00 175.26 174.52 1hg1 s GLN 56 N 2.37 3.20 -0.04 4.30 2.00 -1.26 -0.96 119.66 129.26 1hg1 s GLN 56 Ca -0.04 -0.60 -0.22 0.00 -2.00 0.00 0.00 55.36 52.50 1hg1 s GLN 56 Cb -0.11 -4.15 -0.26 0.00 0.80 0.00 0.00 33.01 29.29 1hg1 s GLN 56 CO -0.14 -1.67 1.00 0.35 -0.50 0.00 0.00 175.29 174.34 1hg1 h PHE 57 N 9.46 0.44 -3.25 1.67 3.57 -1.14 -3.47 116.94 124.22 1hg1 h PHE 57 Ca -0.28 -0.26 -0.06 0.00 3.53 0.00 0.00 57.97 60.90 1hg1 h PHE 57 Cb 1.07 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.75 1hg1 h PHE 57 CO 0.94 1.11 0.16 -1.54 -2.23 0.00 0.00 178.31 176.75 1hg1 s SER 58 N -6.63 0.14 -0.31 0.41 1.04 -0.79 -5.01 113.70 102.56 1hg1 s SER 58 Ca -0.15 -1.13 0.01 0.00 0.48 0.00 0.00 55.95 55.17 1hg1 s SER 58 Cb 0.02 0.79 0.15 0.00 0.10 0.00 0.00 66.02 67.07 1hg1 s SER 58 CO 0.79 -1.54 0.37 0.21 0.98 0.00 0.00 173.24 174.05 1hg1 s ASN 59 N -3.08 0.94 -0.02 7.02 2.47 -1.10 -3.61 114.94 117.56 1hg1 s ASN 59 Ca 0.18 -0.73 -0.29 0.00 0.42 0.00 0.00 52.86 52.44 1hg1 s ASN 59 Cb -0.04 0.82 0.10 0.00 -1.45 0.00 0.00 41.25 40.68 1hg1 s ASN 59 CO 0.12 -0.35 0.85 0.00 -3.72 0.00 0.00 177.10 174.01 1hg1 s MET 60 N 2.28 0.86 0.37 0.43 0.23 -0.58 -4.95 119.30 117.93 1hg1 s MET 60 Ca 0.11 -0.18 -0.27 0.00 -1.03 0.00 0.00 55.69 54.32 1hg1 s MET 60 Cb -0.13 0.40 -0.09 0.00 -1.53 0.00 0.00 34.83 33.47 1hg1 s MET 60 CO -0.26 -0.35 1.26 0.00 -2.03 0.00 0.00 175.02 173.64 1hg1 s ALA 61 N -2.61 3.32 0.63 3.16 0.00 -1.26 -3.35 121.76 121.65 1hg1 s ALA 61 Ca 0.02 1.16 0.36 0.00 0.00 0.00 0.00 51.96 53.49 1hg1 s ALA 61 Cb -0.01 -3.45 2.06 0.00 0.00 0.00 0.00 23.12 21.72 1hg1 s ALA 61 CO -0.06 -0.65 2.27 0.66 0.00 0.00 0.00 175.76 177.99 1hg1 h SER 62 N 2.98 0.00 0.65 0.00 4.64 -1.92 0.20 113.55 120.10 1hg1 h SER 62 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 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 0.64 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.65 1hg1 h GLU 63 N 0.00 0.00 -0.26 4.77 9.09 -1.94 -1.73 114.58 124.52 1hg1 h GLU 63 Ca 0.01 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.42 1hg1 h GLU 63 Cb 0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.20 1hg1 h GLU 63 CO -0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 1hg1 n ASN 64 N -2.33 2.96 -4.72 3.06 3.02 0.05 -4.95 115.26 112.35 1hg1 n ASN 64 Ca 0.01 -1.87 -0.42 0.00 -0.03 0.00 0.00 54.58 52.28 1hg1 n ASN 64 Cb 0.21 -0.16 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 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 -1.31 4.32 0.21 3.52 1.75 -0.65 -4.99 119.30 122.15 1hg1 s MET 65 Ca 0.29 2.12 0.10 0.00 -1.25 0.00 0.00 55.69 56.94 1hg1 s MET 65 Cb 0.17 -3.22 -0.04 0.00 2.84 0.00 0.00 34.83 34.58 1hg1 s MET 65 CO 0.24 -0.42 -0.11 0.95 -0.65 0.00 0.00 175.02 175.03 1hg1 s THR 66 N 0.87 3.05 0.30 10.11 -4.23 -1.26 -5.02 115.64 119.46 1hg1 s THR 66 Ca 0.63 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.32 1hg1 s THR 66 Cb -0.38 -2.55 0.29 0.00 1.34 0.00 0.00 72.50 71.21 1hg1 s THR 66 CO 0.32 -0.21 1.84 1.23 -0.54 0.00 0.00 174.62 177.27 1hg1 h GLY 67 N 2.63 1.54 1.30 3.99 0.00 -1.98 0.52 103.07 111.06 1hg1 h GLY 67 Ca -0.45 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 46.44 1hg1 h GLY 67 CO 0.56 0.13 0.18 -0.55 0.00 0.00 0.00 176.54 176.85 1hg1 h ASP 68 N 0.91 0.82 -0.14 0.19 3.32 -1.96 0.95 116.42 120.50 1hg1 h ASP 68 Ca 0.49 -0.13 -0.22 0.00 0.02 0.00 0.00 57.03 57.19 1hg1 h ASP 68 Cb 0.57 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 39.92 1hg1 h ASP 68 CO -0.25 0.77 -0.75 0.58 -1.72 0.00 0.00 179.24 177.87 1hg1 h VAL 69 N 0.85 1.29 -0.80 -1.35 2.07 -1.62 -2.58 116.25 114.11 1hg1 h VAL 69 Ca 0.19 -1.96 -0.02 0.00 0.82 0.00 0.00 66.70 65.73 1hg1 h VAL 69 Cb 0.26 2.03 -0.04 0.00 -1.52 0.00 0.00 31.29 32.02 1hg1 h VAL 69 CO -0.01 0.62 0.42 0.58 0.02 0.00 0.00 177.57 179.20 1hg1 h VAL 70 N 0.48 1.24 -0.76 2.57 2.07 -0.61 0.41 116.25 121.65 1hg1 h VAL 70 Ca -0.05 -0.63 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 1hg1 h VAL 70 Cb 1.39 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1hg1 h VAL 70 CO 0.16 0.28 0.37 0.25 0.02 0.00 0.00 177.57 178.64 1hg1 h LEU 71 N 1.13 1.00 -0.72 2.57 5.85 -0.75 -0.27 115.31 124.11 1hg1 h LEU 71 Ca 0.28 -0.13 -0.11 0.00 0.84 0.00 0.00 57.88 58.76 1hg1 h LEU 71 Cb 0.06 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 1hg1 h LEU 71 CO -0.04 0.85 -0.17 0.11 -0.34 0.00 0.00 178.44 178.85 1hg1 h LYS 72 N 1.08 0.80 -0.40 1.25 1.57 -0.97 -1.74 116.57 118.16 1hg1 h LYS 72 Ca 0.26 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1hg1 h LYS 72 Cb 0.12 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1hg1 h LYS 72 CO -0.03 0.92 0.22 1.25 -0.57 0.00 0.00 179.45 181.24 1hg1 h LEU 73 N 0.71 0.50 -0.33 2.94 5.85 -0.31 -0.41 115.31 124.25 1hg1 h LEU 73 Ca 0.11 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1hg1 h LEU 73 Cb 0.68 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1hg1 h LEU 73 CO 0.05 0.44 0.18 -1.28 -0.34 0.00 0.00 178.44 177.48 1hg1 h SER 74 N 0.52 0.42 -0.58 1.25 0.87 -0.83 -1.00 113.55 114.20 1hg1 h SER 74 Ca 0.14 -0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.57 1hg1 h SER 74 Cb 0.04 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 1hg1 h SER 74 CO -0.02 0.39 0.24 1.56 -0.53 0.00 0.00 176.83 178.47 1hg1 h GLN 75 N 0.42 0.90 -0.42 2.24 4.20 -1.09 -0.47 115.11 120.88 1hg1 h GLN 75 Ca 0.12 -0.14 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1hg1 h GLN 75 Cb 0.07 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1hg1 h GLN 75 CO -0.02 0.74 0.07 -0.09 -0.67 0.00 0.00 178.83 178.86 1hg1 h ARG 76 N 0.88 0.70 -0.67 1.46 9.65 -0.72 -1.81 114.38 123.87 1hg1 h ARG 76 Ca 0.21 -0.19 -0.06 0.00 -1.10 0.00 0.00 59.98 58.84 1hg1 h ARG 76 Cb 0.18 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.65 1hg1 h ARG 76 CO -0.02 0.74 0.18 0.28 2.80 0.00 0.00 179.97 183.95 1hg1 h VAL 77 N 0.56 1.25 -0.60 0.20 2.07 -0.79 -1.61 116.25 117.33 1hg1 h VAL 77 Ca 0.13 -0.92 0.03 0.00 0.82 0.00 0.00 66.70 66.75 1hg1 h VAL 77 Cb 0.38 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1hg1 h VAL 77 CO 0.01 0.35 0.37 0.78 0.02 0.00 0.00 177.57 179.10 1hg1 h ASN 78 N 1.01 0.60 0.46 0.57 2.35 -0.87 -0.98 115.58 118.73 1hg1 h ASN 78 Ca 0.22 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 1hg1 h ASN 78 Cb 0.34 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.59 1hg1 h ASN 78 CO -0.00 0.42 -0.22 -0.33 -1.65 0.00 0.00 177.43 175.64 1hg1 h GLU 79 N 0.73 -0.60 -0.36 0.81 5.08 -0.86 -2.48 114.58 116.89 1hg1 h GLU 79 Ca 0.24 0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.71 1hg1 h GLU 79 Cb 0.02 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.35 1hg1 h GLU 79 CO -0.10 -0.39 0.01 -0.07 -1.00 0.00 0.00 179.01 177.46 1hg1 h LEU 80 N -0.64 -0.12 -0.72 1.33 3.38 -1.09 -1.56 115.31 115.90 1hg1 h LEU 80 Ca -0.06 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1hg1 h LEU 80 Cb 0.49 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1hg1 h LEU 80 CO 0.10 -0.02 0.00 0.18 0.09 0.00 0.00 178.44 178.79 1hg1 n LEU 81 N -5.17 0.53 0.15 1.67 4.77 -0.39 -1.64 117.00 116.92 1hg1 n LEU 81 Ca 0.02 0.65 0.13 0.00 -0.03 0.00 0.00 56.01 56.78 1hg1 n LEU 81 Cb 0.18 -0.61 0.36 0.00 -2.33 0.00 0.00 43.42 41.02 1hg1 n LEU 81 CO 0.21 -0.60 0.87 0.00 -1.33 0.00 0.00 177.39 176.55 1hg1 h ALA 82 N 2.23 1.00 -2.46 -1.18 0.00 -0.80 -3.45 119.26 114.60 1hg1 h ALA 82 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1hg1 h ALA 82 Cb 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1hg1 h ALA 82 CO 0.00 0.00 0.24 1.03 0.00 0.00 0.00 179.25 180.52 1hg1 s ARG 83 N -3.18 4.42 0.47 0.00 0.52 -0.65 -4.97 118.95 115.56 1hg1 s ARG 83 Ca 0.09 1.11 0.26 0.00 -0.52 0.00 0.00 55.73 56.67 1hg1 s ARG 83 Cb 0.10 -2.79 0.71 0.00 0.52 0.00 0.00 34.95 33.50 1hg1 s ARG 83 CO 0.60 0.31 1.74 -0.44 0.02 0.00 0.00 175.30 177.53 1hg1 h ASP 84 N 3.18 0.00 -0.30 0.23 3.32 -1.87 -3.10 116.42 117.87 1hg1 h ASP 84 Ca -0.47 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 1hg1 h ASP 84 Cb 1.19 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.74 1hg1 h ASP 84 CO 0.65 0.04 0.01 -0.90 -1.72 0.00 0.00 179.24 177.31 1hg1 n ASP 85 N -3.12 3.48 -3.71 6.45 5.75 -1.26 -4.71 116.55 119.43 1hg1 n ASP 85 Ca 0.03 -2.49 -0.25 0.00 -0.01 0.00 0.00 54.79 52.06 1hg1 n ASP 85 Cb 0.46 -0.60 -0.17 0.00 -1.03 0.00 0.00 41.12 39.78 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 -1.92 0.26 -0.44 2.12 1.01 -1.17 -4.79 120.40 115.47 1hg1 s VAL 86 Ca 0.28 -0.14 0.22 0.00 0.00 0.00 0.00 61.98 62.35 1hg1 s VAL 86 Cb 0.22 -0.66 -0.16 0.00 0.00 0.00 0.00 36.38 35.78 1hg1 s VAL 86 CO 0.08 -0.04 0.89 0.47 0.00 0.00 0.00 175.10 176.51 1hg1 n ASP 87 N 5.16 0.53 -3.60 3.32 8.00 -0.05 -4.80 116.55 125.12 1hg1 n ASP 87 Ca -0.07 -0.13 0.01 0.00 0.71 0.00 0.00 54.79 55.31 1hg1 n ASP 87 Cb 0.49 1.04 -0.01 0.00 -0.02 0.00 0.00 41.12 42.62 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 -3.93 -0.41 0.00 0.44 0.00 -1.17 -4.10 107.32 98.16 1hg1 s GLY 88 Ca 0.00 1.00 0.02 0.00 0.00 0.00 0.00 44.72 45.75 1hg1 s GLY 88 CO 0.83 0.23 -0.07 0.14 0.00 0.00 0.00 173.10 174.23 1hg1 s VAL 89 N -2.26 0.55 -0.09 1.40 1.01 -0.31 -2.23 120.40 118.48 1hg1 s VAL 89 Ca 0.14 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.72 1hg1 s VAL 89 Cb 0.05 -0.49 -0.01 0.00 0.00 0.00 0.00 36.38 35.93 1hg1 s VAL 89 CO -0.05 0.06 -0.22 -0.69 0.00 0.00 0.00 175.10 174.20 1hg1 s VAL 90 N -0.37 2.27 -0.23 2.92 1.01 -0.13 -0.68 120.40 125.20 1hg1 s VAL 90 Ca 0.01 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.04 1hg1 s VAL 90 Cb -0.04 -1.87 0.05 0.00 0.00 0.00 0.00 36.38 34.52 1hg1 s VAL 90 CO -0.00 0.56 -0.13 -0.63 0.00 0.00 0.00 175.10 174.90 1hg1 s ILE 91 N 0.10 2.04 0.19 2.22 1.01 0.28 0.07 121.20 127.10 1hg1 s ILE 91 Ca -0.10 -1.36 -0.30 0.00 0.00 0.00 0.00 60.65 58.89 1hg1 s ILE 91 Cb -0.16 -2.08 -0.08 0.00 0.01 0.00 0.00 42.46 40.16 1hg1 s ILE 91 CO 0.06 0.14 1.02 0.42 0.00 0.00 0.00 174.94 176.58 1hg1 s THR 92 N 1.20 4.06 0.09 2.92 -4.23 -0.30 -0.78 115.64 118.61 1hg1 s THR 92 Ca -0.04 1.86 -0.21 0.00 -1.18 0.00 0.00 61.69 62.12 1hg1 s THR 92 Cb -0.18 -4.18 0.05 0.00 1.34 0.00 0.00 72.50 69.53 1hg1 s THR 92 CO -0.07 0.36 0.50 -2.28 -0.54 0.00 0.00 174.62 172.58 1hg1 s HIS 93 N -0.52 -0.38 0.61 3.99 5.04 -0.33 -2.12 115.29 121.57 1hg1 s HIS 93 Ca 0.46 0.27 -0.17 0.00 -1.54 0.00 0.00 55.06 54.08 1hg1 s HIS 93 Cb -0.27 0.36 -0.02 0.00 0.04 0.00 0.00 32.58 32.69 1hg1 s HIS 93 CO 0.33 -0.70 1.15 0.20 -2.34 0.00 0.00 174.74 173.38 1hg1 s GLY 94 N -2.37 2.48 0.20 1.59 0.00 -1.19 -4.28 107.32 103.74 1hg1 s GLY 94 Ca -0.02 0.79 0.01 0.00 0.00 0.00 0.00 44.72 45.51 1hg1 s GLY 94 CO -0.07 1.16 1.48 -0.91 0.00 0.00 0.00 173.10 174.76 1hg1 h THR 95 N 0.59 1.39 -0.79 0.90 1.35 -1.94 -3.12 112.91 111.29 1hg1 h THR 95 Ca -0.49 -2.13 0.16 0.00 -0.55 0.00 0.00 66.41 63.41 1hg1 h THR 95 Cb 1.27 2.10 -0.10 0.00 -1.73 0.00 0.00 68.15 69.69 1hg1 h THR 95 CO 0.55 0.63 0.32 0.44 -0.25 0.00 0.00 175.52 177.21 1hg1 h ASP 96 N 0.22 0.28 0.00 5.36 3.32 -1.93 -3.12 116.42 120.56 1hg1 h ASP 96 Ca -0.02 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1hg1 h ASP 96 Cb 1.25 0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.90 1hg1 h ASP 96 CO 0.11 0.08 -0.11 0.35 -1.72 0.00 0.00 179.24 177.95 1hg1 n THR 97 N -5.02 1.32 0.08 0.35 -2.24 -1.26 -4.77 114.28 102.75 1hg1 n THR 97 Ca 0.16 -1.57 0.07 0.00 -2.27 0.00 0.00 64.05 60.44 1hg1 n THR 97 Cb 0.47 0.03 0.52 0.00 -2.10 0.00 0.00 70.33 69.25 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 1.69 1.03 0.00 2.28 3.04 -1.47 -0.96 116.25 121.86 1hg1 h VAL 98 Ca 0.00 -0.11 -0.06 0.00 -1.01 0.00 0.00 66.70 65.52 1hg1 h VAL 98 Cb 1.05 0.67 -0.01 0.00 -2.01 0.00 0.00 31.29 30.99 1hg1 h VAL 98 CO 0.00 0.06 -0.28 1.05 -1.01 0.00 0.00 177.57 177.39 1hg1 h GLU 99 N 0.33 0.00 0.06 4.17 4.11 -1.86 0.24 114.58 121.62 1hg1 h GLU 99 Ca 0.12 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.55 1hg1 h GLU 99 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1hg1 h GLU 99 CO -0.03 0.28 -0.03 0.93 0.07 0.00 0.00 179.01 180.23 1hg1 h GLU 100 N 0.00 -0.07 -0.43 1.06 5.08 -1.54 -2.53 114.58 116.15 1hg1 h GLU 100 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1hg1 h GLU 100 Cb 0.49 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1hg1 h GLU 100 CO 0.04 0.52 0.22 0.77 -1.00 0.00 0.00 179.01 179.56 1hg1 h SER 101 N -0.78 0.56 -0.59 1.42 0.02 -1.30 -1.59 113.55 111.29 1hg1 h SER 101 Ca -0.01 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1hg1 h SER 101 Cb 0.63 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1hg1 h SER 101 CO 0.01 0.52 0.38 0.00 -1.14 0.00 0.00 176.83 176.60 1hg1 h ALA 102 N 1.06 0.76 -0.17 3.77 0.00 -0.63 -2.19 119.26 121.86 1hg1 h ALA 102 Ca 0.15 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1hg1 h ALA 102 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1hg1 h ALA 102 CO -0.02 0.15 -0.38 -0.92 0.00 0.00 0.00 179.25 178.08 1hg1 h TYR 103 N 0.76 0.44 0.14 0.00 3.20 -1.30 -0.68 116.97 119.52 1hg1 h TYR 103 Ca 0.23 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1hg1 h TYR 103 Cb -0.04 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1hg1 h TYR 103 CO -0.04 0.70 -0.13 0.35 -1.64 0.00 0.00 178.16 177.41 1hg1 h PHE 104 N 0.32 -0.32 0.00 -3.82 3.04 -0.72 -2.00 116.94 113.44 1hg1 h PHE 104 Ca 0.03 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.93 1hg1 h PHE 104 Cb 0.81 0.12 -0.01 0.00 2.56 0.00 0.00 35.95 39.44 1hg1 h PHE 104 CO 0.02 -0.19 -0.25 -0.07 -2.02 0.00 0.00 178.31 175.79 1hg1 h LEU 105 N -0.28 0.00 -1.38 0.59 4.07 -1.26 -2.08 115.31 114.96 1hg1 h LEU 105 Ca -0.00 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.01 1hg1 h LEU 105 Cb 0.27 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.96 1hg1 h LEU 105 CO -0.02 0.25 0.47 -0.74 -1.08 0.00 0.00 178.44 177.32 1hg1 h HIS 106 N 0.00 0.77 0.00 1.13 2.76 -0.39 -0.30 115.15 119.11 1hg1 h HIS 106 Ca -0.00 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1hg1 h HIS 106 Cb 0.51 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.22 1hg1 h HIS 106 CO 0.00 0.42 -1.18 1.28 -1.30 0.00 0.00 177.93 177.15 1hg1 n LEU 107 N -4.47 0.57 -0.00 0.26 4.77 -0.90 -0.66 117.00 116.57 1hg1 n LEU 107 Ca 0.10 0.06 0.04 0.00 -0.03 0.00 0.00 56.01 56.17 1hg1 n LEU 107 Cb 0.20 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.16 1hg1 n LEU 107 CO 0.34 -0.01 -0.40 0.35 -1.33 0.00 0.00 177.39 176.34 1hg1 n THR 108 N -2.16 0.00 -2.83 -5.08 -2.24 -0.83 -4.23 114.28 96.90 1hg1 n THR 108 Ca 0.01 -0.23 -0.43 0.00 -2.27 0.00 0.00 64.05 61.13 1hg1 n THR 108 Cb 0.48 0.55 -0.04 0.00 -2.10 0.00 0.00 70.33 69.22 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 -2.26 4.49 -1.33 2.28 1.01 -0.16 -4.73 120.40 119.70 1hg1 s VAL 109 Ca -0.01 0.73 -0.12 0.00 0.00 0.00 0.00 61.98 62.59 1hg1 s VAL 109 Cb 0.05 -4.42 0.12 0.00 0.00 0.00 0.00 36.38 32.14 1hg1 s VAL 109 CO 0.32 -0.81 1.92 0.29 0.00 0.00 0.00 175.10 176.82 1hg1 n LYS 110 N 7.11 3.34 -3.49 2.72 4.76 -1.26 -3.87 118.16 127.47 1hg1 n LYS 110 Ca 0.06 -3.27 -0.14 0.00 -2.87 0.00 0.00 58.31 52.08 1hg1 n LYS 110 Cb 0.48 -3.08 -0.04 0.00 -1.84 0.00 0.00 35.03 30.55 1hg1 n LYS 110 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1hg1 s SER 111 N 1.99 -0.58 0.00 4.39 0.15 -1.26 -4.79 113.70 113.60 1hg1 s SER 111 Ca 0.43 0.38 0.23 0.00 0.70 0.00 0.00 55.95 57.69 1hg1 s SER 111 Cb 0.09 0.53 0.16 0.00 -1.71 0.00 0.00 66.02 65.09 1hg1 s SER 111 CO -0.02 -0.72 1.18 0.47 1.20 0.00 0.00 173.24 175.36 1hg1 n ASP 112 N 0.34 1.46 -4.77 5.45 8.00 -1.26 -4.23 116.55 121.54 1hg1 n ASP 112 Ca -0.17 -1.16 -0.40 0.00 0.71 0.00 0.00 54.79 53.77 1hg1 n ASP 112 Cb 0.60 0.49 -0.02 0.00 -0.02 0.00 0.00 41.12 42.18 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 -2.64 4.24 0.19 -1.24 1.02 -1.26 -1.03 119.74 119.03 1hg1 s LYS 113 Ca 0.17 2.24 -0.33 0.00 0.02 0.00 0.00 55.97 58.07 1hg1 s LYS 113 Cb 0.18 -2.99 -0.13 0.00 -0.52 0.00 0.00 37.83 34.37 1hg1 s LYS 113 CO 0.64 -0.29 1.57 -2.30 -0.92 0.00 0.00 175.35 174.04 1hg1 n PRO 114 N 0.61 2.26 -4.01 -1.68 -0.02 -1.26 -4.88 135.00 126.03 1hg1 n PRO 114 Ca 0.01 0.81 -0.31 0.00 -2.02 0.00 0.00 63.50 61.99 1hg1 n PRO 114 Cb 0.42 -2.57 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 1hg1 n PRO 114 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1hg1 s VAL 115 N 0.70 1.83 -0.21 -1.45 1.01 -1.26 -1.16 120.40 119.87 1hg1 s VAL 115 Ca 0.75 -1.35 0.02 0.00 0.00 0.00 0.00 61.98 61.40 1hg1 s VAL 115 Cb -0.63 -1.99 0.04 0.00 0.00 0.00 0.00 36.38 33.80 1hg1 s VAL 115 CO 0.40 -0.00 -0.14 -0.69 0.00 0.00 0.00 175.10 174.66 1hg1 s VAL 116 N 1.27 2.00 0.17 2.92 1.01 0.15 -1.94 120.40 125.97 1hg1 s VAL 116 Ca -0.06 -1.21 -0.24 0.00 0.00 0.00 0.00 61.98 60.46 1hg1 s VAL 116 Cb -0.19 -1.98 -0.08 0.00 0.00 0.00 0.00 36.38 34.13 1hg1 s VAL 116 CO -0.06 0.24 0.75 -0.36 0.00 0.00 0.00 175.10 175.68 1hg1 s PHE 117 N 1.24 3.87 0.04 5.22 0.40 0.47 -0.56 117.98 128.66 1hg1 s PHE 117 Ca -0.02 1.58 0.02 0.00 -0.60 0.00 0.00 56.93 57.91 1hg1 s PHE 117 Cb -0.16 -2.73 -0.02 0.00 0.51 0.00 0.00 43.02 40.61 1hg1 s PHE 117 CO -0.09 0.50 -0.07 0.54 0.70 0.00 0.00 175.22 176.80 1hg1 s VAL 118 N -1.19 0.48 0.22 -0.44 0.11 0.04 -0.88 120.40 118.75 1hg1 s VAL 118 Ca 0.36 -1.07 -0.04 0.00 -2.93 0.00 0.00 61.98 58.30 1hg1 s VAL 118 Cb -0.22 -0.58 0.02 0.00 -1.53 0.00 0.00 36.38 34.07 1hg1 s VAL 118 CO 0.25 -0.41 0.36 0.00 -3.33 0.00 0.00 175.10 171.98 1hg1 n ALA 119 N 1.45 -0.54 -3.44 1.54 0.00 -1.26 -1.19 120.51 117.07 1hg1 n ALA 119 Ca -0.23 -0.88 -0.12 0.00 0.00 0.00 0.00 53.44 52.21 1hg1 n ALA 119 Cb 0.55 0.71 -0.11 0.00 0.00 0.00 0.00 19.45 20.59 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 -2.03 -0.83 -0.58 0.00 0.00 -1.26 -4.68 121.76 112.37 1hg1 s ALA 120 Ca 0.14 1.10 0.24 0.00 0.00 0.00 0.00 51.96 53.45 1hg1 s ALA 120 Cb -0.02 -0.66 0.47 0.00 0.00 0.00 0.00 23.12 22.92 1hg1 s ALA 120 CO 0.10 -0.19 1.52 0.52 0.00 0.00 0.00 175.76 177.71 1hg1 h MET 121 N 6.29 0.00 -6.59 0.00 2.86 -1.91 -3.37 114.93 112.21 1hg1 h MET 121 Ca -0.32 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.63 1hg1 h MET 121 Cb 1.18 0.00 -0.23 0.00 0.06 0.00 0.00 31.60 32.61 1hg1 h MET 121 CO 0.31 0.00 -0.82 1.03 1.06 0.00 0.00 176.91 178.49 1hg1 s ARG 122 N -3.18 2.04 0.69 1.72 0.52 -1.26 -5.00 118.95 114.48 1hg1 s ARG 122 Ca 0.07 -0.99 -0.17 0.00 -0.52 0.00 0.00 55.73 54.13 1hg1 s ARG 122 Cb 0.11 -2.15 0.01 0.00 0.52 0.00 0.00 34.95 33.44 1hg1 s ARG 122 CO 0.67 0.54 1.26 -1.25 0.02 0.00 0.00 175.30 176.54 1hg1 s PRO 123 N -1.33 2.33 0.59 3.54 0.04 -1.26 -4.57 135.00 134.34 1hg1 s PRO 123 Ca 0.14 1.96 0.29 0.00 0.04 0.00 0.00 61.00 63.42 1hg1 s PRO 123 Cb -0.10 -1.83 1.67 0.00 0.04 0.00 0.00 34.50 34.27 1hg1 s PRO 123 CO 0.04 -1.74 2.11 0.00 0.04 0.00 0.00 177.00 177.46 1hg1 h ALA 124 N 0.17 1.79 -0.01 8.56 0.00 -1.30 -0.50 119.26 127.97 1hg1 h ALA 124 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1hg1 h ALA 124 Cb 1.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1hg1 h ALA 124 CO 0.51 -0.27 -0.15 0.25 0.00 0.00 0.00 179.25 179.60 1hg1 n THR 125 N -3.81 0.00 -2.07 0.00 -2.24 -1.24 -4.87 114.28 100.05 1hg1 n THR 125 Ca 0.01 -0.23 -0.32 0.00 -2.27 0.00 0.00 64.05 61.24 1hg1 n THR 125 Cb 0.31 0.66 -0.00 0.00 -2.10 0.00 0.00 70.33 69.19 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 -2.24 2.94 0.22 6.98 0.00 -0.20 -5.00 121.76 124.46 1hg1 s ALA 126 Ca 0.30 0.16 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 1hg1 s ALA 126 Cb 0.20 -3.15 -0.10 0.00 0.00 0.00 0.00 23.12 20.07 1hg1 s ALA 126 CO 0.42 -0.62 1.44 0.42 0.00 0.00 0.00 175.76 177.42 1hg1 s ILE 127 N -2.77 2.75 -1.41 0.00 -1.09 -1.26 -2.45 121.20 114.98 1hg1 s ILE 127 Ca 0.59 0.61 -0.10 0.00 -2.23 0.00 0.00 60.65 59.52 1hg1 s ILE 127 Cb -0.12 -3.39 0.03 0.00 -1.58 0.00 0.00 42.46 37.40 1hg1 s ILE 127 CO 0.41 0.09 1.12 -1.20 -1.23 0.00 0.00 174.94 174.13 1hg1 n SER 128 N 2.68 -6.03 -4.73 3.58 7.64 -1.26 -4.91 113.62 110.58 1hg1 n SER 128 Ca 0.08 -0.59 -0.42 0.00 1.01 0.00 0.00 58.87 58.95 1hg1 n SER 128 Cb 0.40 -4.76 -0.01 0.00 -1.01 0.00 0.00 64.21 58.83 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 -4.89 1.97 0.11 -0.43 0.00 -1.02 -4.92 120.51 111.33 1hg1 n ALA 129 Ca 0.01 0.37 0.09 0.00 0.00 0.00 0.00 53.44 53.91 1hg1 n ALA 129 Cb 0.55 -2.37 0.02 0.00 0.00 0.00 0.00 19.45 17.65 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 3.63 0.00 -0.63 0.00 2.03 -1.87 -3.39 116.42 116.19 1hg1 h ASP 130 Ca -0.47 0.00 0.13 0.00 -0.73 0.00 0.00 57.03 55.96 1hg1 h ASP 130 Cb 1.25 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 39.65 1hg1 h ASP 130 CO 0.70 0.15 0.00 1.23 -1.03 0.00 0.00 179.24 180.30 1hg1 h GLY 131 N 3.90 0.67 0.16 7.15 0.00 -1.83 -1.40 103.07 111.72 1hg1 h GLY 131 Ca -0.03 0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.42 1hg1 h GLY 131 CO 0.01 -0.20 -0.35 -2.55 0.00 0.00 0.00 176.54 173.45 1hg1 h PRO 132 N 0.12 -0.44 -0.51 4.80 0.11 -1.94 0.40 132.00 134.54 1hg1 h PRO 132 Ca 0.33 0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.39 1hg1 h PRO 132 Cb 0.54 0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.73 1hg1 h PRO 132 CO -0.54 -0.29 -0.02 1.98 -0.21 0.00 0.00 178.00 178.92 1hg1 h MET 133 N -0.45 0.87 -0.60 1.05 1.85 -1.79 -1.95 114.93 113.90 1hg1 h MET 133 Ca 0.08 -0.25 0.00 0.00 -0.61 0.00 0.00 59.70 58.92 1hg1 h MET 133 Cb 0.58 -0.09 -0.03 0.00 0.43 0.00 0.00 31.60 32.49 1hg1 h MET 133 CO -0.34 0.88 0.40 -0.91 -0.40 0.00 0.00 176.91 176.53 1hg1 h ASN 134 N 0.80 0.70 -0.44 1.39 2.35 -0.80 -0.97 115.58 118.61 1hg1 h ASN 134 Ca 0.15 -0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 1hg1 h ASN 134 Cb 0.50 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1hg1 h ASN 134 CO 0.03 0.51 0.02 0.25 -1.65 0.00 0.00 177.43 176.59 1hg1 h LEU 135 N 0.82 0.74 -0.69 1.61 5.85 -0.73 -0.30 115.31 122.62 1hg1 h LEU 135 Ca 0.22 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1hg1 h LEU 135 Cb -0.09 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1hg1 h LEU 135 CO -0.05 0.85 0.40 0.25 -0.34 0.00 0.00 178.44 179.55 1hg1 h LEU 136 N 0.61 0.83 -0.48 2.25 5.85 -1.09 -1.09 115.31 122.19 1hg1 h LEU 136 Ca 0.13 -0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.67 1hg1 h LEU 136 Cb 0.46 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1hg1 h LEU 136 CO 0.02 0.67 -0.09 -0.33 -0.34 0.00 0.00 178.44 178.36 1hg1 h GLU 137 N 0.93 0.92 -0.68 1.25 5.08 -0.99 -1.88 114.58 119.21 1hg1 h GLU 137 Ca 0.24 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1hg1 h GLU 137 Cb -0.00 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1hg1 h GLU 137 CO -0.04 0.99 0.43 0.00 -1.00 0.00 0.00 179.01 179.39 1hg1 h ALA 138 N 0.90 0.86 -0.56 3.43 0.00 -0.68 -0.17 119.26 123.04 1hg1 h ALA 138 Ca 0.13 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1hg1 h ALA 138 Cb 0.64 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1hg1 h ALA 138 CO 0.04 0.31 -0.03 0.28 0.00 0.00 0.00 179.25 179.85 1hg1 h VAL 139 N 0.92 1.27 -0.45 0.00 2.07 -1.11 0.49 116.25 119.44 1hg1 h VAL 139 Ca 0.25 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.60 1hg1 h VAL 139 Cb -0.07 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1hg1 h VAL 139 CO -0.05 0.42 0.29 -0.09 0.02 0.00 0.00 177.57 178.16 1hg1 h ARG 140 N 0.88 0.58 -0.30 1.57 2.43 -0.85 -0.35 114.38 118.33 1hg1 h ARG 140 Ca 0.15 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1hg1 h ARG 140 Cb 0.59 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1hg1 h ARG 140 CO 0.04 0.38 0.11 0.28 -1.51 0.00 0.00 179.97 179.27 1hg1 h VAL 141 N 0.59 1.19 -0.28 0.20 2.07 -0.81 -2.30 116.25 116.92 1hg1 h VAL 141 Ca 0.17 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 67.06 1hg1 h VAL 141 Cb -0.05 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1hg1 h VAL 141 CO -0.04 0.20 0.03 0.00 0.02 0.00 0.00 177.57 177.78 1hg1 h ALA 142 N 0.95 1.54 -0.00 1.67 0.00 -0.58 -2.95 119.26 119.89 1hg1 h ALA 142 Ca 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1hg1 h ALA 142 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1hg1 h ALA 142 CO -0.01 0.34 -0.36 0.41 0.00 0.00 0.00 179.25 179.64 1hg1 n GLY 143 N -1.07 -1.11 3.67 0.00 0.00 -0.17 -4.56 105.19 101.95 1hg1 n GLY 143 Ca 0.01 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.84 7.08 0.65 1.61 -1.08 -0.88 -4.79 116.67 116.42 1hg1 s ASP 144 Ca 0.16 1.34 0.43 0.00 -0.52 0.00 0.00 52.55 53.95 1hg1 s ASP 144 Cb 0.18 -2.51 2.26 0.00 -1.46 0.00 0.00 42.92 41.39 1hg1 s ASP 144 CO 0.62 -0.49 2.31 0.11 0.52 0.00 0.00 175.17 178.25 1hg1 h LYS 145 N 7.30 0.00 0.00 4.34 1.79 -1.88 0.26 116.57 128.37 1hg1 h LYS 145 Ca -0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 1hg1 h LYS 145 Cb 1.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.77 1hg1 h LYS 145 CO 0.88 0.00 0.00 0.94 -1.08 0.00 0.00 179.45 180.19 1hg1 n GLN 146 N -3.11 0.16 0.00 3.15 -0.06 -1.26 -2.98 117.38 113.27 1hg1 n GLN 146 Ca -0.02 0.29 0.15 0.00 -2.00 0.00 0.00 57.00 55.42 1hg1 n GLN 146 Cb 0.11 -1.75 0.71 0.00 -4.06 0.00 0.00 30.24 25.25 1hg1 n GLN 146 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 1hg1 n SER 147 N -2.04 0.44 -4.77 1.69 7.64 0.08 -4.93 113.62 111.73 1hg1 n SER 147 Ca 0.04 -0.80 -0.36 0.00 1.01 0.00 0.00 58.87 58.76 1hg1 n SER 147 Cb 0.28 -0.06 0.01 0.00 -1.01 0.00 0.00 64.21 63.43 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 -2.27 3.33 -1.72 1.43 0.52 -1.16 -3.81 118.95 115.27 1hg1 s ARG 148 Ca 0.36 1.70 0.00 0.00 -0.52 0.00 0.00 55.73 57.27 1hg1 s ARG 148 Cb 0.21 -2.05 0.00 0.00 0.52 0.00 0.00 34.95 33.62 1hg1 s ARG 148 CO 0.42 -0.89 0.00 0.41 0.02 0.00 0.00 175.30 175.26 1hg1 n GLY 149 N 0.29 -0.29 0.73 -3.53 0.00 -0.20 -4.89 105.19 97.30 1hg1 n GLY 149 Ca 0.11 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.87 1.58 0.00 1.61 1.74 -1.25 -5.03 116.66 112.44 1hg1 n ARG 150 Ca -0.23 -1.64 0.00 0.00 -0.77 0.00 0.00 57.85 55.21 1hg1 n ARG 150 Cb 0.68 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.78 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 0.98 -0.81 3.77 -0.13 0.00 -1.26 -4.75 105.19 102.99 1hg1 n GLY 151 Ca 0.11 -1.70 -0.39 0.00 0.00 0.00 0.00 46.02 44.04 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 -1.31 3.12 0.18 1.61 1.01 -1.26 -4.69 120.40 119.05 1hg1 s VAL 152 Ca 0.00 1.01 0.09 0.00 0.00 0.00 0.00 61.98 63.08 1hg1 s VAL 152 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1hg1 s VAL 152 CO 0.00 0.15 -0.19 -0.04 0.00 0.00 0.00 175.10 175.02 1hg1 s MET 153 N -2.06 1.34 -0.22 2.72 1.00 -0.82 -1.54 119.30 119.72 1hg1 s MET 153 Ca 0.53 -1.45 0.01 0.00 0.00 0.00 0.00 55.69 54.79 1hg1 s MET 153 Cb -0.33 -1.44 0.05 0.00 0.00 0.00 0.00 34.83 33.12 1hg1 s MET 153 CO 0.42 0.29 -0.09 0.08 0.00 0.00 0.00 175.02 175.72 1hg1 s VAL 154 N -2.03 1.73 -0.18 -6.03 1.01 0.30 -0.40 120.40 114.80 1hg1 s VAL 154 Ca 0.17 -1.20 -0.06 0.00 0.00 0.00 0.00 61.98 60.89 1hg1 s VAL 154 Cb -0.06 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1hg1 s VAL 154 CO 0.08 0.06 0.04 -0.69 0.00 0.00 0.00 175.10 174.58 1hg1 s VAL 155 N 1.33 4.52 -0.28 2.92 1.01 -0.06 -1.29 120.40 128.55 1hg1 s VAL 155 Ca -0.04 -0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.55 1hg1 s VAL 155 Cb -0.18 -3.03 0.17 0.00 0.00 0.00 0.00 36.38 33.34 1hg1 s VAL 155 CO -0.07 0.45 1.28 -0.51 0.00 0.00 0.00 175.10 176.26 1hg1 s ILE 156 N 0.51 0.00 -1.36 2.22 2.07 -0.89 -4.06 121.20 119.69 1hg1 s ILE 156 Ca 0.02 0.00 -0.03 0.00 -1.41 0.00 0.00 60.65 59.23 1hg1 s ILE 156 Cb -0.13 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.48 1hg1 s ILE 156 CO 0.01 0.00 0.74 -3.20 -1.91 0.00 0.00 174.94 170.58 1hg1 n ASN 157 N 1.47 -1.81 0.00 4.50 5.15 -1.26 -1.60 115.26 121.71 1hg1 n ASN 157 Ca -0.09 -0.82 0.00 0.00 -0.60 0.00 0.00 54.58 53.07 1hg1 n ASN 157 Cb 0.57 -3.96 0.00 0.00 -0.53 0.00 0.00 39.78 35.86 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 -4.25 -4.54 1.20 8.00 -1.26 -4.98 116.55 107.70 1hg1 n ASP 158 Ca -0.23 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 54.99 1hg1 n ASP 158 Cb 0.65 -2.57 -0.10 0.00 -0.02 0.00 0.00 41.12 39.08 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 -1.35 1.97 -0.26 -1.24 1.81 -0.63 -0.48 118.95 118.78 1hg1 s ARG 159 Ca 0.00 -1.27 0.02 0.00 -1.72 0.00 0.00 55.73 52.76 1hg1 s ARG 159 Cb 0.00 -2.13 0.06 0.00 -0.45 0.00 0.00 34.95 32.44 1hg1 s ARG 159 CO 0.00 0.44 -0.07 0.42 -0.68 0.00 0.00 175.30 175.41 1hg1 s ILE 160 N -1.61 1.90 0.03 1.52 1.01 -0.04 -2.10 121.20 121.92 1hg1 s ILE 160 Ca 0.23 -1.54 0.04 0.00 0.00 0.00 0.00 60.65 59.39 1hg1 s ILE 160 Cb -0.09 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 1hg1 s ILE 160 CO 0.14 -0.12 -0.06 -0.83 0.00 0.00 0.00 174.94 174.07 1hg1 s GLY 161 N 1.21 1.80 0.19 6.18 0.00 -0.41 -0.23 107.32 116.05 1hg1 s GLY 161 Ca -0.06 -1.07 -0.30 0.00 0.00 0.00 0.00 44.72 43.30 1hg1 s GLY 161 CO -0.06 -0.97 1.06 -0.45 0.00 0.00 0.00 173.10 172.68 1hg1 s SER 162 N -1.71 7.35 0.49 1.64 0.15 -1.26 -0.54 113.70 119.82 1hg1 s SER 162 Ca 0.19 2.06 0.22 0.00 0.70 0.00 0.00 55.95 59.13 1hg1 s SER 162 Cb -0.11 -2.61 1.27 0.00 -1.71 0.00 0.00 66.02 62.86 1hg1 s SER 162 CO 0.11 -0.14 1.96 0.00 1.20 0.00 0.00 173.24 176.37 1hg1 h ALA 163 N 4.85 2.38 0.00 5.45 0.00 -1.61 0.13 119.26 130.45 1hg1 h ALA 163 Ca -0.45 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1hg1 h ALA 163 Cb 1.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1hg1 h ALA 163 CO 0.71 -0.56 -0.23 -0.09 0.00 0.00 0.00 179.25 179.08 1hg1 h ARG 164 N 0.16 0.00 0.00 0.00 9.65 -1.92 -3.38 114.38 118.89 1hg1 h ARG 164 Ca 0.31 0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 59.07 1hg1 h ARG 164 Cb 0.99 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.55 1hg1 h ARG 164 CO -0.05 0.23 -1.46 0.66 2.80 0.00 0.00 179.97 182.16 1hg1 n TYR 165 N -3.34 0.00 -1.87 2.20 4.01 -0.54 -4.94 117.16 112.67 1hg1 n TYR 165 Ca 0.01 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.37 1hg1 n TYR 165 Cb 0.46 -0.31 0.04 0.00 -0.31 0.00 0.00 39.34 39.22 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 -2.16 2.29 0.01 -0.72 1.10 0.34 -4.61 121.20 117.44 1hg1 s ILE 166 Ca -0.09 0.20 -0.29 0.00 -0.51 0.00 0.00 60.65 59.97 1hg1 s ILE 166 Cb 0.03 -3.10 0.07 0.00 0.15 0.00 0.00 42.46 39.61 1hg1 s ILE 166 CO 0.21 -0.01 0.66 0.28 -2.11 0.00 0.00 174.94 173.96 1hg1 s THR 167 N -1.39 0.00 -0.42 4.00 -1.32 -1.14 -4.89 115.64 110.47 1hg1 s THR 167 Ca 0.73 -0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.92 1hg1 s THR 167 Cb -0.37 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.64 1hg1 s THR 167 CO 0.43 -0.00 1.21 -0.75 -2.21 0.00 0.00 174.62 173.29 1hg1 s LYS 168 N -1.87 3.75 0.02 7.08 2.20 -1.26 -2.50 119.74 127.16 1hg1 s LYS 168 Ca -0.08 0.79 0.22 0.00 -0.36 0.00 0.00 55.97 56.54 1hg1 s LYS 168 Cb -0.00 -3.91 -0.14 0.00 -1.51 0.00 0.00 37.83 32.27 1hg1 s LYS 168 CO 0.04 -1.34 0.83 0.25 -0.36 0.00 0.00 175.35 174.78 1hg1 n THR 169 N 6.71 0.10 -4.73 3.43 -2.24 -0.24 -4.92 114.28 112.38 1hg1 n THR 169 Ca 0.13 -0.28 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 1hg1 n THR 169 Cb 0.48 0.29 -0.15 0.00 -2.10 0.00 0.00 70.33 68.85 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 -3.97 1.87 0.43 3.42 3.84 -1.25 -5.04 114.94 114.24 1hg1 s ASN 170 Ca 0.01 -0.29 0.12 0.00 0.21 0.00 0.00 52.86 52.90 1hg1 s ASN 170 Cb 0.14 -0.32 0.96 0.00 -0.55 0.00 0.00 41.25 41.48 1hg1 s ASN 170 CO 0.85 0.17 2.01 0.00 -2.79 0.00 0.00 177.10 177.34 1hg1 h ALA 171 N 5.94 1.69 0.00 1.71 0.00 -1.96 -3.39 119.26 123.25 1hg1 h ALA 171 Ca -0.35 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1hg1 h ALA 171 Cb 1.16 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1hg1 h ALA 171 CO 0.48 0.23 0.00 0.43 0.00 0.00 0.00 179.25 180.40 1hg1 n SER 172 N -4.37 0.05 -4.88 0.00 7.64 -1.26 -5.11 113.62 105.68 1hg1 n SER 172 Ca -0.01 -1.01 -0.30 0.00 1.01 0.00 0.00 58.87 58.56 1hg1 n SER 172 Cb 0.19 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.36 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 -0.01 4.88 0.38 0.44 -4.23 -1.26 -4.99 115.64 110.84 1hg1 s THR 173 Ca 0.00 0.42 0.10 0.00 -1.18 0.00 0.00 61.69 61.02 1hg1 s THR 173 Cb 0.00 -3.72 0.14 0.00 1.34 0.00 0.00 72.50 70.25 1hg1 s THR 173 CO 0.00 -0.41 1.88 -0.07 -0.54 0.00 0.00 174.62 175.48 1hg1 h LEU 174 N 1.52 0.18 -2.91 4.79 3.38 -1.96 -2.60 115.31 117.71 1hg1 h LEU 174 Ca -0.47 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.39 1hg1 h LEU 174 Cb 1.19 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 1hg1 h LEU 174 CO 0.65 0.40 0.07 -0.90 0.09 0.00 0.00 178.44 178.75 1hg1 n ASP 175 N -4.22 4.23 -0.22 -0.43 5.75 -1.26 -4.58 116.55 115.81 1hg1 n ASP 175 Ca -0.01 -2.74 0.11 0.00 -0.01 0.00 0.00 54.79 52.15 1hg1 n ASP 175 Cb 0.31 -0.65 0.40 0.00 -1.03 0.00 0.00 41.12 40.15 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 2.49 0.88 -3.35 2.12 1.03 -1.78 -3.41 112.91 110.89 1hg1 h THR 176 Ca 0.07 -0.22 -0.57 0.00 -0.01 0.00 0.00 66.41 65.68 1hg1 h THR 176 Cb 1.68 0.17 -0.06 0.00 -1.07 0.00 0.00 68.15 68.87 1hg1 h THR 176 CO 0.42 0.12 0.91 -0.36 -0.01 0.00 0.00 175.52 176.60 1hg1 s PHE 177 N -5.61 2.91 0.09 0.00 0.08 -1.26 -1.08 117.98 113.10 1hg1 s PHE 177 Ca -0.09 0.97 -0.11 0.00 0.12 0.00 0.00 56.93 57.82 1hg1 s PHE 177 Cb 0.21 -3.95 0.01 0.00 -0.57 0.00 0.00 43.02 38.72 1hg1 s PHE 177 CO 0.78 -1.21 0.25 1.03 -0.10 0.00 0.00 175.22 175.97 1hg1 s ARG 178 N 4.04 0.88 -0.51 0.44 0.52 -1.04 -4.94 118.95 118.33 1hg1 s ARG 178 Ca 0.50 -0.84 0.04 0.00 -0.52 0.00 0.00 55.73 54.91 1hg1 s ARG 178 Cb -0.12 0.37 0.16 0.00 0.52 0.00 0.00 34.95 35.88 1hg1 s ARG 178 CO 0.22 -0.29 0.37 0.00 0.02 0.00 0.00 175.30 175.62 1hg1 s ALA 179 N -3.62 2.34 0.23 2.13 0.00 -1.26 -2.91 121.76 118.66 1hg1 s ALA 179 Ca 0.03 -2.93 -0.13 0.00 0.00 0.00 0.00 51.96 48.93 1hg1 s ALA 179 Cb 0.03 -1.84 0.29 0.00 0.00 0.00 0.00 23.12 21.60 1hg1 s ALA 179 CO -0.10 -2.04 1.60 -0.91 0.00 0.00 0.00 175.76 174.31 1hg1 h ASN 180 N 5.79 -0.78 1.09 0.00 2.35 -1.90 0.71 115.58 122.85 1hg1 h ASN 180 Ca 0.17 0.23 -0.11 0.00 -0.55 0.00 0.00 56.30 56.04 1hg1 h ASN 180 Cb 0.86 0.49 -0.02 0.00 0.05 0.00 0.00 38.32 39.70 1hg1 h ASN 180 CO 0.50 -0.26 -0.96 -0.33 -1.65 0.00 0.00 177.43 174.74 1hg1 h GLU 181 N -0.02 0.00 0.00 0.81 4.39 -1.98 -3.37 114.58 114.41 1hg1 h GLU 181 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1hg1 h GLU 181 Cb 0.55 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1hg1 h GLU 181 CO -0.78 0.30 -0.94 0.39 -1.16 0.00 0.00 179.01 176.83 1hg1 n GLU 182 N -2.99 1.25 -0.00 2.33 4.71 -0.92 -5.10 120.64 119.92 1hg1 n GLU 182 Ca -0.03 -0.02 0.00 0.00 -0.01 0.00 0.00 57.16 57.09 1hg1 n GLU 182 Cb 0.74 -1.32 -0.00 0.00 -1.01 0.00 0.00 31.44 29.85 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 1.42 -1.26 3.89 0.62 0.00 0.24 -4.85 105.19 105.24 1hg1 n GLY 183 Ca 0.02 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.64 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 3.41 0.33 1.61 2.02 -1.26 -4.54 117.35 118.92 1hg1 s TYR 184 Ca 0.00 0.15 0.08 0.00 -0.37 0.00 0.00 57.07 56.93 1hg1 s TYR 184 Cb 0.00 -1.68 0.59 0.00 -0.40 0.00 0.00 41.96 40.47 1hg1 s TYR 184 CO 0.00 0.55 1.79 -0.07 -1.57 0.00 0.00 175.55 176.24 1hg1 h LEU 185 N 2.74 0.22 0.00 -1.29 3.38 -0.90 -3.38 115.31 116.08 1hg1 h LEU 185 Ca -0.47 -0.07 0.26 0.00 0.09 0.00 0.00 57.88 57.69 1hg1 h LEU 185 Cb 1.18 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 1hg1 h LEU 185 CO 0.70 0.53 0.76 0.61 0.09 0.00 0.00 178.44 181.13 1hg1 n GLY 186 N -0.46 0.39 3.10 0.83 0.00 -1.10 0.38 105.19 108.33 1hg1 n GLY 186 Ca -0.01 -1.09 -0.07 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.04 0.20 -0.23 1.61 -7.23 -0.53 -0.86 120.40 111.32 1hg1 s VAL 187 Ca 0.26 -1.81 0.02 0.00 -1.81 0.00 0.00 61.98 58.64 1hg1 s VAL 187 Cb -0.02 -1.60 0.05 0.00 0.56 0.00 0.00 36.38 35.38 1hg1 s VAL 187 CO 0.02 -0.91 -0.11 -0.63 -0.31 0.00 0.00 175.10 173.16 1hg1 s ILE 188 N -3.94 1.95 -0.04 -0.62 1.09 0.37 -0.87 121.20 119.14 1hg1 s ILE 188 Ca 0.10 -1.36 0.02 0.00 -1.10 0.00 0.00 60.65 58.30 1hg1 s ILE 188 Cb 0.08 -2.04 0.01 0.00 -1.06 0.00 0.00 42.46 39.45 1hg1 s ILE 188 CO -0.08 0.07 -0.08 -0.63 -0.10 0.00 0.00 174.94 174.12 1hg1 s ILE 189 N 1.23 0.72 -1.48 2.92 -1.09 -0.60 -4.69 121.20 118.23 1hg1 s ILE 189 Ca -0.05 -0.28 -0.07 0.00 -2.23 0.00 0.00 60.65 58.02 1hg1 s ILE 189 Cb -0.18 -0.68 0.01 0.00 -1.58 0.00 0.00 42.46 40.02 1hg1 s ILE 189 CO -0.07 0.25 0.88 0.61 -1.23 0.00 0.00 174.94 175.38 1hg1 n GLY 190 N 3.64 -0.54 2.44 6.18 0.00 -1.26 -1.87 105.19 113.79 1hg1 n GLY 190 Ca -0.22 0.19 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.75 -5.11 -4.12 1.61 3.02 -1.26 -4.99 115.26 101.66 1hg1 n ASN 191 Ca -0.06 0.27 -0.23 0.00 -0.03 0.00 0.00 54.58 54.53 1hg1 n ASN 191 Cb 0.59 -4.16 -0.15 0.00 -0.61 0.00 0.00 39.78 35.45 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 -3.99 1.19 -0.04 3.52 3.52 -0.78 -5.13 118.95 117.24 1hg1 s ARG 192 Ca 0.00 -0.53 -0.16 0.00 -0.13 0.00 0.00 55.73 54.90 1hg1 s ARG 192 Cb 0.00 -1.16 -0.05 0.00 -1.56 0.00 0.00 34.95 32.18 1hg1 s ARG 192 CO 0.00 0.32 0.45 0.42 -0.81 0.00 0.00 175.30 175.67 1hg1 s ILE 193 N -0.36 5.07 -0.31 4.11 1.01 -1.26 -1.55 121.20 127.91 1hg1 s ILE 193 Ca 0.06 0.91 0.02 0.00 0.00 0.00 0.00 60.65 61.64 1hg1 s ILE 193 Cb -0.06 -3.77 0.09 0.00 0.01 0.00 0.00 42.46 38.74 1hg1 s ILE 193 CO -0.01 0.47 0.03 -0.31 0.00 0.00 0.00 174.94 175.13 1hg1 s TYR 194 N -0.37 3.02 -0.07 3.97 1.51 -0.05 -5.00 117.35 120.35 1hg1 s TYR 194 Ca 0.25 -2.46 -0.26 0.00 -1.01 0.00 0.00 57.07 53.59 1hg1 s TYR 194 Cb -0.16 -2.35 -0.03 0.00 -0.11 0.00 0.00 41.96 39.31 1hg1 s TYR 194 CO 0.12 -0.90 0.81 0.71 -1.11 0.00 0.00 175.55 175.19 1hg1 s TYR 195 N 1.17 3.56 -0.18 2.71 2.02 -1.26 -1.46 117.35 123.90 1hg1 s TYR 195 Ca 0.07 1.38 -0.01 0.00 -0.37 0.00 0.00 57.07 58.14 1hg1 s TYR 195 Cb -0.19 -2.95 -0.11 0.00 -0.40 0.00 0.00 41.96 38.32 1hg1 s TYR 195 CO -0.12 -0.03 -0.18 1.04 -1.57 0.00 0.00 175.55 174.70 1hg1 n GLN 196 N 4.19 0.44 -4.25 -0.62 6.02 0.16 -4.95 117.38 118.37 1hg1 n GLN 196 Ca 0.02 0.12 -0.14 0.00 -0.01 0.00 0.00 57.00 56.99 1hg1 n GLN 196 Cb 0.51 -1.33 -0.10 0.00 1.02 0.00 0.00 30.24 30.34 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 -5.93 1.04 -0.08 1.08 0.01 -0.54 -5.02 114.94 105.50 1hg1 s ASN 197 Ca -0.25 -1.25 0.01 0.00 -0.71 0.00 0.00 52.86 50.65 1hg1 s ASN 197 Cb 0.07 0.17 0.02 0.00 0.41 0.00 0.00 41.25 41.92 1hg1 s ASN 197 CO 0.40 -0.65 -0.08 -0.13 -1.51 0.00 0.00 177.10 175.13 1hg1 s ARG 198 N -3.98 1.36 0.28 -0.60 0.52 -1.26 -4.75 118.95 110.51 1hg1 s ARG 198 Ca 0.29 -0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 54.97 1hg1 s ARG 198 Cb 0.07 -1.34 -0.11 0.00 0.52 0.00 0.00 34.95 34.09 1hg1 s ARG 198 CO 0.07 -0.15 1.50 -1.50 0.02 0.00 0.00 175.30 175.24 1hg1 s ILE 199 N 1.29 2.40 -1.07 1.52 2.07 -1.26 -4.90 121.20 121.24 1hg1 s ILE 199 Ca -0.04 0.34 -0.03 0.00 -1.41 0.00 0.00 60.65 59.52 1hg1 s ILE 199 Cb -0.14 -3.22 0.24 0.00 0.13 0.00 0.00 42.46 39.48 1hg1 s ILE 199 CO -0.03 0.06 2.09 -0.67 -1.91 0.00 0.00 174.94 174.48 1hg1 n ASP 200 N 2.10 7.55 -3.93 4.50 -0.08 -1.26 -4.91 116.55 120.53 1hg1 n ASP 200 Ca 0.07 -3.49 -0.08 0.00 -1.51 0.00 0.00 54.79 49.77 1hg1 n ASP 200 Cb 0.39 -1.23 -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 -3.10 0.76 0.29 -0.67 -0.14 -1.26 -5.04 119.74 110.58 1hg1 s LYS 201 Ca 0.47 -1.03 -0.28 0.00 -1.36 0.00 0.00 55.97 53.76 1hg1 s LYS 201 Cb 0.23 0.30 -0.09 0.00 -1.68 0.00 0.00 37.83 36.58 1hg1 s LYS 201 CO -0.15 -0.22 0.99 -0.51 -0.76 0.00 0.00 175.35 174.70 1hg1 s LEU 202 N -2.85 4.48 0.15 3.17 1.43 -0.58 -5.02 118.68 119.46 1hg1 s LEU 202 Ca 0.05 2.01 -0.25 0.00 -1.03 0.00 0.00 54.13 54.91 1hg1 s LEU 202 Cb 0.06 -3.79 0.06 0.00 0.03 0.00 0.00 46.19 42.55 1hg1 s LEU 202 CO -0.11 -0.05 0.96 -1.38 0.23 0.00 0.00 176.35 176.00 1hg1 s HIS 203 N -1.34 -0.13 0.00 0.29 -3.43 -1.26 -4.67 115.29 104.75 1hg1 s HIS 203 Ca 0.46 -0.17 0.00 0.00 -0.80 0.00 0.00 55.06 54.55 1hg1 s HIS 203 Cb -0.25 0.64 0.00 0.00 -1.43 0.00 0.00 32.58 31.54 1hg1 s HIS 203 CO 0.32 -0.82 0.00 0.25 -2.00 0.00 0.00 174.74 172.49 1hg1 n THR 204 N -0.47 0.00 0.08 -5.38 -2.24 0.17 -0.49 114.28 105.95 1hg1 n THR 204 Ca -0.06 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.76 1hg1 n THR 204 Cb 0.61 0.00 0.19 0.00 -2.10 0.00 0.00 70.33 69.03 1hg1 n THR 204 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1hg1 n THR 205 N 0.00 1.65 0.37 4.28 -2.24 -1.25 -0.91 114.28 116.17 1hg1 n THR 205 Ca 0.00 0.55 0.07 0.00 -2.27 0.00 0.00 64.05 62.40 1hg1 n THR 205 Cb 0.00 -1.53 0.10 0.00 -2.10 0.00 0.00 70.33 66.80 1hg1 n THR 205 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hg1 n ARG 206 N -1.73 1.58 -3.21 -0.78 3.00 0.36 -4.99 116.66 110.89 1hg1 n ARG 206 Ca -0.00 -1.63 -0.35 0.00 -0.01 0.00 0.00 57.85 55.85 1hg1 n ARG 206 Cb 0.02 -1.31 -0.06 0.00 0.00 0.00 0.00 32.46 31.12 1hg1 n ARG 206 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1hg1 s SER 207 N -1.17 6.90 0.00 0.55 0.15 -0.09 -4.60 113.70 115.45 1hg1 s SER 207 Ca 0.21 1.25 0.25 0.00 0.70 0.00 0.00 55.95 58.37 1hg1 s SER 207 Cb 0.13 -2.36 0.50 0.00 -1.71 0.00 0.00 66.02 62.59 1hg1 s SER 207 CO 0.19 0.01 1.42 1.33 1.20 0.00 0.00 173.24 177.39 1hg1 n VAL 208 N 0.50 0.00 -2.26 4.45 0.24 -1.26 -4.75 118.33 115.25 1hg1 n VAL 208 Ca -0.02 -0.29 -0.42 0.00 -2.04 0.00 0.00 64.34 61.57 1hg1 n VAL 208 Cb 0.52 0.92 -0.00 0.00 -1.47 0.00 0.00 33.84 33.80 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 0.23 4.16 -2.67 6.34 3.72 -1.26 -4.94 117.46 123.04 1hg1 n PHE 209 Ca 0.14 -2.79 -0.43 0.00 -0.05 0.00 0.00 57.45 54.32 1hg1 n PHE 209 Cb 0.44 -2.59 -0.02 0.00 -0.94 0.00 0.00 39.48 36.37 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 4.04 7.17 -0.08 4.37 -1.08 -1.26 -4.40 116.67 125.42 1hg1 s ASP 210 Ca 0.53 1.46 0.12 0.00 -0.52 0.00 0.00 52.55 54.14 1hg1 s ASP 210 Cb 0.07 -2.55 0.21 0.00 -1.46 0.00 0.00 42.92 39.19 1hg1 s ASP 210 CO 0.03 -0.56 1.12 1.33 0.52 0.00 0.00 175.17 177.61 1hg1 n VAL 211 N 4.94 1.57 -1.76 1.11 0.24 -1.26 -5.02 118.33 118.15 1hg1 n VAL 211 Ca 0.10 -1.74 -0.41 0.00 -2.04 0.00 0.00 64.34 60.25 1hg1 n VAL 211 Cb 0.47 0.05 -0.01 0.00 -1.47 0.00 0.00 33.84 32.88 1hg1 n VAL 211 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1hg1 n ARG 212 N -0.96 2.73 0.00 7.34 1.74 -1.26 -2.54 116.66 123.71 1hg1 n ARG 212 Ca 0.11 0.97 0.00 0.00 -0.77 0.00 0.00 57.85 58.15 1hg1 n ARG 212 Cb 0.51 -2.74 0.00 0.00 -1.02 0.00 0.00 32.46 29.21 1hg1 n ARG 212 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hg1 n GLY 213 N 1.55 2.93 3.75 -0.13 0.00 -1.26 -5.01 105.19 107.02 1hg1 n GLY 213 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 3.53 0.00 0.99 1.43 -1.05 -4.96 118.68 118.62 1hg1 s LEU 214 Ca 0.00 2.33 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 1hg1 s LEU 214 Cb 0.00 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 41.63 1hg1 s LEU 214 CO 0.00 -1.79 0.11 0.35 0.23 0.00 0.00 176.35 175.26 1hg1 n THR 215 N -2.00 0.00 -3.60 5.49 -2.24 -1.26 -4.95 114.28 105.71 1hg1 n THR 215 Ca 0.13 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.48 1hg1 n THR 215 Cb 0.50 1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 69.83 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 -0.43 -0.44 0.15 3.42 1.04 -1.26 -4.88 113.70 111.31 1hg1 s SER 216 Ca 0.00 -0.25 0.06 0.00 0.48 0.00 0.00 55.95 56.23 1hg1 s SER 216 Cb 0.00 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 1hg1 s SER 216 CO 0.00 -1.11 -0.12 -0.76 0.98 0.00 0.00 173.24 172.22 1hg1 s LEU 217 N -2.82 2.50 0.54 2.42 1.43 -1.26 -5.09 118.68 116.40 1hg1 s LEU 217 Ca 0.05 -0.96 -0.21 0.00 -1.03 0.00 0.00 54.13 51.98 1hg1 s LEU 217 Cb -0.03 -0.48 -0.06 0.00 0.03 0.00 0.00 46.19 45.66 1hg1 s LEU 217 CO -0.05 -0.24 1.16 -2.65 0.23 0.00 0.00 176.35 174.80 1hg1 n PRO 218 N -0.04 1.37 -2.91 1.29 -0.02 -1.26 -4.94 135.00 128.50 1hg1 n PRO 218 Ca -0.11 0.51 -0.41 0.00 -2.02 0.00 0.00 63.50 61.47 1hg1 n PRO 218 Cb 0.60 -2.34 -0.04 0.00 -0.02 0.00 0.00 33.50 31.69 1hg1 n PRO 218 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1hg1 s LYS 219 N -2.67 4.50 -0.05 -0.52 1.02 -1.26 -4.85 119.74 115.91 1hg1 s LYS 219 Ca 0.71 1.12 0.00 0.00 0.02 0.00 0.00 55.97 57.82 1hg1 s LYS 219 Cb -0.44 -3.44 0.02 0.00 -0.52 0.00 0.00 37.83 33.45 1hg1 s LYS 219 CO 0.50 0.06 -0.02 0.08 -0.92 0.00 0.00 175.35 175.05 1hg1 s VAL 220 N 0.73 0.40 0.31 3.17 1.01 -1.26 0.05 120.40 124.82 1hg1 s VAL 220 Ca 0.43 0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.48 1hg1 s VAL 220 Cb -0.19 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.68 1hg1 s VAL 220 CO 0.23 0.21 0.30 -1.81 0.00 0.00 0.00 175.10 174.03 1hg1 s ASP 221 N 1.25 5.50 -0.16 3.32 1.01 -1.01 -4.95 116.67 121.63 1hg1 s ASP 221 Ca -0.06 -0.36 0.01 0.00 0.71 0.00 0.00 52.55 52.85 1hg1 s ASP 221 Cb -0.14 -1.16 0.02 0.00 1.01 0.00 0.00 42.92 42.65 1hg1 s ASP 221 CO -0.02 -0.27 -0.17 -0.63 0.21 0.00 0.00 175.17 174.29 1hg1 s ILE 222 N -2.23 1.81 -0.11 0.77 1.01 -1.26 -0.26 121.20 120.94 1hg1 s ILE 222 Ca 0.39 -0.79 -0.01 0.00 0.00 0.00 0.00 60.65 60.24 1hg1 s ILE 222 Cb -0.07 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.71 1hg1 s ILE 222 CO 0.27 0.50 -0.06 -0.76 0.00 0.00 0.00 174.94 174.89 1hg1 s LEU 223 N 1.32 3.15 0.47 2.97 1.43 -0.17 -4.97 118.68 122.87 1hg1 s LEU 223 Ca 0.03 -0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 52.87 1hg1 s LEU 223 Cb -0.13 -1.72 -0.08 0.00 0.03 0.00 0.00 46.19 44.29 1hg1 s LEU 223 CO -0.10 0.26 0.92 -0.47 0.23 0.00 0.00 176.35 177.19 1hg1 s TYR 224 N -0.21 3.42 -0.12 0.29 5.04 -1.26 -1.18 117.35 123.33 1hg1 s TYR 224 Ca 0.03 1.40 0.01 0.00 -2.44 0.00 0.00 57.07 56.07 1hg1 s TYR 224 Cb -0.13 -2.72 -0.01 0.00 0.35 0.00 0.00 41.96 39.44 1hg1 s TYR 224 CO 0.03 -0.24 -0.15 0.20 -1.34 0.00 0.00 175.55 174.04 1hg1 s GLY 225 N -2.86 1.51 0.13 8.97 0.00 -0.50 -4.85 107.32 109.71 1hg1 s GLY 225 Ca 0.58 -0.91 -0.25 0.00 0.00 0.00 0.00 44.72 44.14 1hg1 s GLY 225 CO 0.27 -0.25 1.02 -2.52 0.00 0.00 0.00 173.10 171.63 1hg1 s TYR 226 N 0.28 -0.09 0.27 1.90 1.13 -1.26 -4.39 117.35 115.19 1hg1 s TYR 226 Ca -0.11 -0.20 -0.31 0.00 -1.41 0.00 0.00 57.07 55.05 1hg1 s TYR 226 Cb -0.16 0.63 -0.12 0.00 -1.10 0.00 0.00 41.96 41.21 1hg1 s TYR 226 CO 0.06 -0.75 1.55 1.04 -2.51 0.00 0.00 175.55 174.93 1hg1 n GLN 227 N -0.50 2.50 -1.20 -3.49 6.02 -1.26 -1.41 117.38 118.03 1hg1 n GLN 227 Ca -0.06 0.89 -0.07 0.00 -0.01 0.00 0.00 57.00 57.75 1hg1 n GLN 227 Cb 0.61 -2.64 -0.03 0.00 1.02 0.00 0.00 30.24 29.20 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 2.25 -4.49 -4.67 1.08 8.00 -1.26 -4.94 116.55 112.51 1hg1 n ASP 228 Ca 0.10 0.17 -0.46 0.00 0.71 0.00 0.00 54.79 55.30 1hg1 n ASP 228 Cb 0.35 -2.60 -0.04 0.00 -0.02 0.00 0.00 41.12 38.80 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 -0.14 3.29 -4.77 -2.24 5.75 -0.50 -4.92 116.55 113.03 1hg1 n ASP 229 Ca -0.07 1.04 -0.38 0.00 -0.01 0.00 0.00 54.79 55.36 1hg1 n ASP 229 Cb 0.34 -1.42 -0.04 0.00 -1.03 0.00 0.00 41.12 38.97 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 2.16 4.43 0.30 0.11 0.04 -1.26 -4.63 135.00 136.15 1hg1 s PRO 230 Ca 0.84 1.65 0.15 0.00 0.04 0.00 0.00 61.00 63.68 1hg1 s PRO 230 Cb -0.67 -2.89 0.32 0.00 0.04 0.00 0.00 34.50 31.30 1hg1 s PRO 230 CO 0.43 0.07 1.56 1.49 0.04 0.00 0.00 177.00 180.59 1hg1 h GLU 231 N 3.22 0.00 -0.03 4.56 4.81 -1.91 -3.28 114.58 121.95 1hg1 h GLU 231 Ca -0.47 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 58.77 1hg1 h GLU 231 Cb 1.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 1hg1 h GLU 231 CO 0.65 0.52 0.03 0.10 -0.73 0.00 0.00 179.01 179.58 1hg1 h TYR 232 N 0.00 0.00 -0.62 0.92 -0.00 -1.94 -1.78 116.97 113.56 1hg1 h TYR 232 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.67 1hg1 h TYR 232 Cb 1.20 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.91 1hg1 h TYR 232 CO 0.00 0.00 0.16 -0.07 -0.00 0.00 0.00 178.16 178.25 1hg1 h LEU 233 N 0.00 0.91 -0.43 0.10 -0.00 -1.99 0.38 115.31 114.28 1hg1 h LEU 233 Ca 0.01 -0.17 -0.06 0.00 -0.00 0.00 0.00 57.88 57.66 1hg1 h LEU 233 Cb 0.08 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.49 1hg1 h LEU 233 CO -0.00 0.87 0.02 1.88 -0.00 0.00 0.00 178.44 181.22 1hg1 h TYR 234 N 0.93 0.80 -0.33 1.13 -1.99 -1.55 -1.50 116.97 114.46 1hg1 h TYR 234 Ca 0.20 -0.13 0.03 0.00 2.00 0.00 0.00 58.73 60.83 1hg1 h TYR 234 Cb 0.32 -0.21 -0.03 0.00 2.00 0.00 0.00 36.73 38.80 1hg1 h TYR 234 CO 0.02 0.79 0.12 -0.44 -0.00 0.00 0.00 178.16 178.65 1hg1 h ASP 235 N 0.58 0.15 -0.05 3.88 3.32 -1.28 -0.01 116.42 123.01 1hg1 h ASP 235 Ca 0.12 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.21 1hg1 h ASP 235 Cb 0.45 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1hg1 h ASP 235 CO 0.02 0.12 -0.02 0.00 -1.72 0.00 0.00 179.24 177.64 1hg1 h ALA 236 N 1.20 0.03 -0.10 3.45 0.00 -0.75 0.12 119.26 123.21 1hg1 h ALA 236 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1hg1 h ALA 236 Cb 0.10 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1hg1 h ALA 236 CO -0.14 -0.50 0.07 0.00 0.00 0.00 0.00 179.25 178.68 1hg1 h ALA 237 N 1.04 0.13 -0.44 0.00 0.00 -1.04 -1.75 119.26 117.19 1hg1 h ALA 237 Ca 0.02 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1hg1 h ALA 237 Cb 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1hg1 h ALA 237 CO -0.05 -0.38 0.21 0.82 0.00 0.00 0.00 179.25 179.85 1hg1 h ILE 238 N 0.13 0.95 0.00 0.00 2.04 -0.82 -1.70 117.51 118.12 1hg1 h ILE 238 Ca 0.04 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1hg1 h ILE 238 Cb -0.01 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1hg1 h ILE 238 CO -0.01 0.08 0.00 1.56 0.00 0.00 0.00 178.15 179.78 1hg1 h GLN 239 N 0.42 0.00 -0.65 2.37 4.20 -0.47 -2.38 115.11 118.60 1hg1 h GLN 239 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1hg1 h GLN 239 Cb 0.11 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1hg1 h GLN 239 CO -0.14 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.74 1hg1 n HIS 240 N -2.95 1.29 -0.99 2.96 8.25 -0.65 -4.96 115.22 118.18 1hg1 n HIS 240 Ca -0.01 -0.53 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 1hg1 n HIS 240 Cb 0.17 -0.19 0.00 0.00 1.12 0.00 0.00 29.99 31.09 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 1.18 0.43 3.73 -1.41 0.00 -0.89 -5.03 105.19 103.20 1hg1 n GLY 241 Ca 0.24 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.00 2.09 -0.13 1.61 -7.23 -1.18 -4.80 120.40 108.77 1hg1 s VAL 242 Ca 0.00 0.06 0.22 0.00 -1.81 0.00 0.00 61.98 60.45 1hg1 s VAL 242 Cb 0.00 -3.02 -0.27 0.00 0.56 0.00 0.00 36.38 33.64 1hg1 s VAL 242 CO 0.00 -0.01 0.61 0.29 -0.31 0.00 0.00 175.10 175.68 1hg1 n LYS 243 N -1.85 0.60 -3.63 4.82 4.01 0.11 -4.85 118.16 117.36 1hg1 n LYS 243 Ca 0.16 -0.13 -0.12 0.00 -0.51 0.00 0.00 58.31 57.70 1hg1 n LYS 243 Cb 0.48 -1.57 -0.06 0.00 -0.51 0.00 0.00 35.03 33.38 1hg1 n LYS 243 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1hg1 s GLY 244 N -4.39 -0.32 -0.08 0.72 0.00 -1.06 -1.71 107.32 100.48 1hg1 s GLY 244 Ca -0.06 0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.97 1hg1 s GLY 244 CO 0.89 0.03 -0.07 -0.42 0.00 0.00 0.00 173.10 173.53 1hg1 s ILE 245 N -2.79 0.85 -0.17 0.90 1.01 0.29 -2.39 121.20 118.89 1hg1 s ILE 245 Ca -0.03 -0.22 -0.14 0.00 0.00 0.00 0.00 60.65 60.26 1hg1 s ILE 245 Cb -0.00 -0.87 -0.05 0.00 0.01 0.00 0.00 42.46 41.55 1hg1 s ILE 245 CO -0.05 0.32 0.30 -0.69 0.00 0.00 0.00 174.94 174.83 1hg1 s VAL 246 N 1.42 5.29 -0.32 2.92 1.01 0.64 -0.79 120.40 130.58 1hg1 s VAL 246 Ca -0.02 0.55 -0.09 0.00 0.00 0.00 0.00 61.98 62.43 1hg1 s VAL 246 Cb -0.13 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.62 1hg1 s VAL 246 CO -0.04 0.36 0.13 -0.47 0.00 0.00 0.00 175.10 175.09 1hg1 s TYR 247 N 0.64 3.18 -1.30 5.22 5.04 0.92 -1.00 117.35 130.05 1hg1 s TYR 247 Ca 0.16 -0.85 -0.13 0.00 -2.44 0.00 0.00 57.07 53.81 1hg1 s TYR 247 Cb -0.13 -2.33 0.13 0.00 0.35 0.00 0.00 41.96 39.98 1hg1 s TYR 247 CO 0.04 -0.55 1.81 0.00 -1.34 0.00 0.00 175.55 175.51 1hg1 n ALA 248 N 4.93 4.73 -1.21 3.97 0.00 -0.33 0.52 120.51 133.13 1hg1 n ALA 248 Ca -0.14 -4.14 -0.29 0.00 0.00 0.00 0.00 53.44 48.88 1hg1 n ALA 248 Cb 0.48 -3.21 0.17 0.00 0.00 0.00 0.00 19.45 16.89 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 2.36 1.57 0.09 0.00 0.00 -1.00 -1.40 107.32 108.94 1hg1 s GLY 249 Ca 0.44 -0.35 -0.30 0.00 0.00 0.00 0.00 44.72 44.51 1hg1 s GLY 249 CO -0.00 0.25 1.08 1.06 0.00 0.00 0.00 173.10 175.48 1hg1 s MET 250 N -4.99 4.55 4.50 2.90 -1.94 -1.23 -0.59 119.30 122.49 1hg1 s MET 250 Ca 0.65 1.63 0.00 0.00 -1.71 0.00 0.00 55.69 56.26 1hg1 s MET 250 Cb -0.18 -3.35 0.00 0.00 2.01 0.00 0.00 34.83 33.31 1hg1 s MET 250 CO 0.57 -0.03 0.00 0.41 -0.01 0.00 0.00 175.02 175.96 1hg1 n GLY 251 N 2.62 2.73 2.26 -0.03 0.00 -1.26 -0.69 105.19 110.81 1hg1 n GLY 251 Ca 0.05 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 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 8.65 7.09 -1.86 4.61 0.00 -1.26 -4.49 120.51 133.25 1hg1 n ALA 252 Ca 0.00 -3.02 -0.14 0.00 0.00 0.00 0.00 53.44 50.28 1hg1 n ALA 252 Cb 0.00 -3.11 -0.03 0.00 0.00 0.00 0.00 19.45 16.31 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 3.34 0.58 3.77 0.00 0.00 -1.11 -4.75 105.19 107.01 1hg1 n GLY 253 Ca 0.68 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.97 1hg1 n GLY 253 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hg1 s SER 254 N -2.60 6.12 -0.05 1.61 0.01 0.13 -4.82 113.70 114.09 1hg1 s SER 254 Ca 0.00 2.76 0.05 0.00 1.31 0.00 0.00 55.95 60.07 1hg1 s SER 254 Cb 0.00 -2.64 -0.00 0.00 0.21 0.00 0.00 66.02 63.58 1hg1 s SER 254 CO 0.00 -0.99 -0.20 -0.69 0.41 0.00 0.00 173.24 171.77 1hg1 s VAL 255 N -1.24 1.67 0.96 3.43 1.01 -1.26 -3.55 120.40 121.42 1hg1 s VAL 255 Ca 0.59 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 61.57 1hg1 s VAL 255 Cb -0.40 -1.43 0.18 0.00 0.00 0.00 0.00 36.38 34.73 1hg1 s VAL 255 CO 0.52 0.47 1.22 -0.94 0.00 0.00 0.00 175.10 176.37 1hg1 s SER 256 N 0.01 3.09 0.26 3.32 1.04 -1.26 -4.75 113.70 115.40 1hg1 s SER 256 Ca -0.05 0.59 -0.04 0.00 0.48 0.00 0.00 55.95 56.93 1hg1 s SER 256 Cb -0.13 -0.88 0.31 0.00 0.10 0.00 0.00 66.02 65.42 1hg1 s SER 256 CO 0.03 -2.78 1.84 -0.37 0.98 0.00 0.00 173.24 172.94 1hg1 h VAL 257 N -1.66 1.24 -0.63 5.02 -1.51 -1.99 0.75 116.25 117.46 1hg1 h VAL 257 Ca -0.46 -0.72 -0.09 0.00 -1.23 0.00 0.00 66.70 64.20 1hg1 h VAL 257 Cb 1.29 0.36 -0.02 0.00 -2.13 0.00 0.00 31.29 30.78 1hg1 h VAL 257 CO 0.48 0.30 0.04 0.03 -1.23 0.00 0.00 177.57 177.19 1hg1 h ARG 258 N 1.03 1.09 -0.50 5.19 -0.00 -1.93 -1.61 114.38 117.65 1hg1 h ARG 258 Ca 0.24 -0.32 -0.08 0.00 -0.50 0.00 0.00 59.98 59.33 1hg1 h ARG 258 Cb 0.16 -0.11 -0.02 0.00 0.00 0.00 0.00 29.97 30.00 1hg1 h ARG 258 CO -0.02 1.03 0.01 0.78 0.00 0.00 0.00 179.97 181.76 1hg1 h GLY 259 N 1.02 0.94 1.00 0.04 0.00 -1.67 -0.21 103.07 104.20 1hg1 h GLY 259 Ca 0.19 -0.69 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1hg1 h GLY 259 CO 0.02 0.63 0.35 -2.22 0.00 0.00 0.00 176.54 175.33 1hg1 h ILE 260 N 0.74 1.15 -0.56 2.60 1.08 -0.69 0.17 117.51 121.99 1hg1 h ILE 260 Ca 0.14 -0.29 -0.03 0.00 -0.39 0.00 0.00 64.86 64.29 1hg1 h ILE 260 Cb 0.51 0.37 -0.03 0.00 -3.07 0.00 0.00 36.82 34.60 1hg1 h ILE 260 CO 0.02 0.15 0.25 0.00 -0.69 0.00 0.00 178.15 177.88 1hg1 h ALA 261 N 1.19 0.73 -0.50 1.87 0.00 -1.12 -1.50 119.26 119.93 1hg1 h ALA 261 Ca 0.20 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1hg1 h ALA 261 Cb -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1hg1 h ALA 261 CO -0.04 0.32 0.16 0.78 0.00 0.00 0.00 179.25 180.47 1hg1 h GLY 262 N 0.77 0.84 1.28 0.00 0.00 -0.42 -2.65 103.07 102.90 1hg1 h GLY 262 Ca 0.19 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 1hg1 h GLY 262 CO -0.02 0.47 -0.01 -0.33 0.00 0.00 0.00 176.54 176.65 1hg1 h MET 263 N 0.69 0.87 -0.48 4.80 2.07 -0.51 -2.41 114.93 119.96 1hg1 h MET 263 Ca 0.16 -0.25 -0.00 0.00 -2.07 0.00 0.00 59.70 57.54 1hg1 h MET 263 Cb 0.28 -0.09 -0.02 0.00 -1.87 0.00 0.00 31.60 29.89 1hg1 h MET 263 CO -0.00 0.87 0.29 0.00 1.07 0.00 0.00 176.91 179.14 1hg1 h ARG 264 N 0.80 0.65 -0.65 1.72 2.47 -1.13 0.13 114.38 118.38 1hg1 h ARG 264 Ca 0.15 -0.06 0.03 0.00 -1.26 0.00 0.00 59.98 58.84 1hg1 h ARG 264 Cb 0.49 -0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 28.63 1hg1 h ARG 264 CO 0.02 0.47 0.40 0.87 0.56 0.00 0.00 179.97 182.30 1hg1 h LYS 265 N 0.64 0.76 -0.25 0.04 1.57 -1.24 0.32 116.57 118.41 1hg1 h LYS 265 Ca 0.17 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1hg1 h LYS 265 Cb -0.01 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1hg1 h LYS 265 CO -0.03 0.51 0.13 0.00 -0.57 0.00 0.00 179.45 179.48 1hg1 h ALA 266 N 1.28 0.32 -0.21 3.86 0.00 -0.92 -1.88 119.26 121.70 1hg1 h ALA 266 Ca 0.26 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1hg1 h ALA 266 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1hg1 h ALA 266 CO -0.10 -0.14 -0.01 -0.07 0.00 0.00 0.00 179.25 178.93 1hg1 h LEU 267 N 0.28 0.29 -0.71 0.00 3.38 -0.27 0.82 115.31 119.10 1hg1 h LEU 267 Ca 0.09 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 1hg1 h LEU 267 Cb 0.09 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1hg1 h LEU 267 CO -0.01 0.35 -0.54 -0.33 0.09 0.00 0.00 178.44 178.00 1hg1 h GLU 268 N 0.31 0.29 -0.09 1.13 5.08 -0.57 -2.68 114.58 118.04 1hg1 h GLU 268 Ca 0.07 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1hg1 h GLU 268 Cb 0.23 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1hg1 h GLU 268 CO 0.01 0.76 0.00 1.63 -1.00 0.00 0.00 179.01 180.40 1hg1 n LYS 269 N -3.93 1.35 -0.84 2.33 4.76 -0.74 -4.89 118.16 116.20 1hg1 n LYS 269 Ca -0.02 -0.53 0.00 0.00 -2.87 0.00 0.00 58.31 54.88 1hg1 n LYS 269 Cb 0.57 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 32.46 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 0.92 0.53 3.77 0.72 0.00 -0.97 -5.04 105.19 105.11 1hg1 n GLY 270 Ca 0.13 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.00 4.69 -0.14 1.61 1.01 0.21 -4.98 120.40 120.80 1hg1 s VAL 271 Ca 0.00 1.45 -0.26 0.00 0.00 0.00 0.00 61.98 63.17 1hg1 s VAL 271 Cb 0.00 -4.02 -0.02 0.00 0.00 0.00 0.00 36.38 32.34 1hg1 s VAL 271 CO 0.00 0.46 0.86 -0.69 0.00 0.00 0.00 175.10 175.73 1hg1 s VAL 272 N -0.60 4.87 -0.22 2.92 1.01 -0.70 -3.95 120.40 123.74 1hg1 s VAL 272 Ca 0.34 1.72 -0.08 0.00 0.00 0.00 0.00 61.98 63.96 1hg1 s VAL 272 Cb -0.20 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1hg1 s VAL 272 CO 0.21 0.05 0.08 -0.69 0.00 0.00 0.00 175.10 174.75 1hg1 s VAL 273 N 1.96 4.64 -0.24 2.92 1.01 -1.26 -0.55 120.40 128.88 1hg1 s VAL 273 Ca 0.41 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.32 1hg1 s VAL 273 Cb -0.17 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 33.11 1hg1 s VAL 273 CO 0.15 0.39 -0.10 -0.32 0.00 0.00 0.00 175.10 175.22 1hg1 s MET 274 N 1.03 2.70 -0.40 2.72 0.00 0.03 -0.35 119.30 125.04 1hg1 s MET 274 Ca 0.04 -1.06 -0.23 0.00 0.00 0.00 0.00 55.69 54.45 1hg1 s MET 274 Cb -0.14 -2.90 0.01 0.00 0.00 0.00 0.00 34.83 31.81 1hg1 s MET 274 CO 0.03 -0.42 0.77 1.03 0.00 0.00 0.00 175.02 176.43 1hg1 s ARG 275 N 1.26 3.61 0.00 4.11 0.52 0.54 -0.06 118.95 128.93 1hg1 s ARG 275 Ca -0.01 0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.31 1hg1 s ARG 275 Cb -0.17 -3.86 0.00 0.00 0.52 0.00 0.00 34.95 31.44 1hg1 s ARG 275 CO -0.06 -0.94 0.00 0.45 0.02 0.00 0.00 175.30 174.77 1hg1 n SER 276 N 6.50 0.94 -3.99 0.23 2.88 0.19 -1.36 113.62 119.01 1hg1 n SER 276 Ca 0.02 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.46 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 1.62 0.19 -0.96 2.46 -1.32 -1.25 -2.36 115.64 114.02 1hg1 s THR 277 Ca 0.00 -0.87 0.25 0.00 -1.21 0.00 0.00 61.69 59.86 1hg1 s THR 277 Cb 0.00 -0.31 0.01 0.00 -1.51 0.00 0.00 72.50 70.69 1hg1 s THR 277 CO 0.00 -0.43 1.41 -2.11 -2.21 0.00 0.00 174.62 171.28 1hg1 n ARG 278 N 1.70 0.03 -0.34 7.08 1.85 0.24 -4.29 116.66 122.93 1hg1 n ARG 278 Ca -0.23 0.01 0.01 0.00 -1.00 0.00 0.00 57.85 56.64 1hg1 n ARG 278 Cb 0.55 -1.52 0.15 0.00 -1.05 0.00 0.00 32.46 30.59 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 1.11 0.00 8.89 1.35 -1.84 -3.47 112.91 118.94 1hg1 h THR 279 Ca 0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1hg1 h THR 279 Cb 0.53 -0.12 0.00 0.00 -1.73 0.00 0.00 68.15 66.83 1hg1 h THR 279 CO 0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 1hg1 n GLY 280 N -1.35 2.07 3.39 5.82 0.00 -1.26 -5.09 105.19 108.78 1hg1 n GLY 280 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.88 -0.33 0.00 1.61 0.01 -1.26 -4.97 114.94 108.11 1hg1 s ASN 281 Ca 0.00 -0.27 0.00 0.00 -0.71 0.00 0.00 52.86 51.88 1hg1 s ASN 281 Cb 0.00 0.53 0.00 0.00 0.41 0.00 0.00 41.25 42.19 1hg1 s ASN 281 CO 0.00 -0.93 0.00 0.61 -1.51 0.00 0.00 177.10 175.27 1hg1 n GLY 282 N -0.30 1.15 3.72 0.66 0.00 -1.26 -5.01 105.19 104.16 1hg1 n GLY 282 Ca -0.15 -2.07 -0.36 0.00 0.00 0.00 0.00 46.02 43.44 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 -1.63 5.31 -0.45 -0.61 -1.09 -1.26 -4.10 121.20 117.37 1hg1 s ILE 283 Ca 0.00 0.51 -0.15 0.00 -2.23 0.00 0.00 60.65 58.79 1hg1 s ILE 283 Cb 0.00 -3.62 0.06 0.00 -1.58 0.00 0.00 42.46 37.32 1hg1 s ILE 283 CO 0.00 0.38 0.36 -0.69 -1.23 0.00 0.00 174.94 173.76 1hg1 s VAL 284 N 0.56 5.15 0.68 2.92 1.01 -0.69 -4.92 120.40 125.12 1hg1 s VAL 284 Ca 0.16 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 61.04 1hg1 s VAL 284 Cb -0.13 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.23 1hg1 s VAL 284 CO 0.04 -0.50 1.06 -2.16 0.00 0.00 0.00 175.10 173.54 1hg1 s PRO 285 N 1.63 3.02 0.69 2.72 0.04 -1.26 -3.70 135.00 138.14 1hg1 s PRO 285 Ca 0.04 0.96 -0.16 0.00 0.04 0.00 0.00 61.00 61.88 1hg1 s PRO 285 Cb -0.23 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.33 1hg1 s PRO 285 CO 0.07 -1.03 1.20 -2.14 0.04 0.00 0.00 177.00 175.14 1hg1 s PRO 286 N -4.98 2.39 -0.29 0.56 0.02 -1.26 -4.91 135.00 126.53 1hg1 s PRO 286 Ca 0.58 1.73 0.04 0.00 0.02 0.00 0.00 61.00 63.37 1hg1 s PRO 286 Cb -0.14 -1.87 0.20 0.00 0.02 0.00 0.00 34.50 32.71 1hg1 s PRO 286 CO 0.54 -1.64 0.65 0.34 -0.33 0.00 0.00 177.00 176.56 1hg1 s ASP 287 N -2.00 -1.47 0.16 2.53 -1.08 -1.26 -5.02 116.67 108.51 1hg1 s ASP 287 Ca 0.74 0.18 0.17 0.00 -0.52 0.00 0.00 52.55 53.12 1hg1 s ASP 287 Cb -0.28 1.94 0.76 0.00 -1.46 0.00 0.00 42.92 43.87 1hg1 s ASP 287 CO 0.42 -0.27 1.52 -1.84 0.52 0.00 0.00 175.17 175.52 1hg1 n GLU 288 N 5.38 0.10 0.00 4.34 0.00 -1.26 -1.64 120.64 127.56 1hg1 n GLU 288 Ca 0.05 0.43 0.14 0.00 0.00 0.00 0.00 57.16 57.79 1hg1 n GLU 288 Cb 0.54 -1.72 0.63 0.00 0.00 0.00 0.00 31.44 30.89 1hg1 n GLU 288 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1hg1 n GLU 289 N -1.92 0.24 -4.33 3.44 1.02 -1.26 -4.81 120.64 113.02 1hg1 n GLU 289 Ca 0.01 -0.03 -0.29 0.00 -0.02 0.00 0.00 57.16 56.83 1hg1 n GLU 289 Cb 0.14 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 29.94 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 -2.78 2.60 0.67 -4.62 1.43 -0.65 -5.13 118.68 110.20 1hg1 s LEU 290 Ca 0.21 -0.64 -0.11 0.00 -1.03 0.00 0.00 54.13 52.56 1hg1 s LEU 290 Cb 0.19 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.97 1hg1 s LEU 290 CO 0.51 0.17 1.06 -2.16 0.23 0.00 0.00 176.35 176.16 1hg1 s PRO 291 N -2.22 3.12 0.32 1.29 0.04 -1.26 -4.89 135.00 131.40 1hg1 s PRO 291 Ca 0.18 0.77 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1hg1 s PRO 291 Cb -0.10 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1hg1 s PRO 291 CO 0.09 -0.92 0.00 0.41 0.04 0.00 0.00 177.00 176.63 1hg1 n GLY 292 N -2.45 -2.20 4.01 0.56 0.00 -1.26 -4.88 105.19 98.96 1hg1 n GLY 292 Ca 0.07 -1.49 -0.19 0.00 0.00 0.00 0.00 46.02 44.41 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 0.00 3.35 0.05 0.99 1.43 0.53 -4.93 118.68 120.10 1hg1 s LEU 293 Ca 0.00 -0.67 0.08 0.00 -1.03 0.00 0.00 54.13 52.51 1hg1 s LEU 293 Cb 0.00 -2.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 1hg1 s LEU 293 CO 0.00 -1.04 -0.20 0.68 0.23 0.00 0.00 176.35 176.02 1hg1 s VAL 294 N -2.52 2.65 -2.04 -1.59 -7.23 -1.26 -0.34 120.40 108.07 1hg1 s VAL 294 Ca 0.57 -1.27 0.09 0.00 -1.81 0.00 0.00 61.98 59.57 1hg1 s VAL 294 Cb -0.07 -2.11 0.25 0.00 0.56 0.00 0.00 36.38 35.00 1hg1 s VAL 294 CO 0.35 0.32 1.26 -1.54 -0.31 0.00 0.00 175.10 175.18 1hg1 n SER 295 N 1.52 0.95 0.00 4.85 3.41 -0.46 -4.84 113.62 119.05 1hg1 n SER 295 Ca -0.16 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.56 1hg1 n SER 295 Cb 0.52 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 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 -0.03 0.00 -1.46 4.04 -0.08 -1.24 -1.08 116.55 116.69 1hg1 n ASP 296 Ca 0.08 0.00 0.11 0.00 -1.51 0.00 0.00 54.79 53.47 1hg1 n ASP 296 Cb 0.17 0.00 0.34 0.00 2.34 0.00 0.00 41.12 43.97 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 4.61 4.34 -4.71 1.67 3.41 -1.26 -1.70 113.62 119.97 1hg1 n SER 297 Ca 0.00 -2.20 -0.42 0.00 -0.26 0.00 0.00 58.87 55.99 1hg1 n SER 297 Cb 0.00 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.39 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 -1.38 4.38 0.94 1.04 1.02 -0.24 -4.72 118.68 119.72 1hg1 s LEU 298 Ca 0.50 1.81 -0.14 0.00 0.02 0.00 0.00 54.13 56.32 1hg1 s LEU 298 Cb 0.29 -3.57 0.17 0.00 0.02 0.00 0.00 46.19 43.09 1hg1 s LEU 298 CO 0.30 -0.33 1.20 0.54 0.02 0.00 0.00 176.35 178.08 1hg1 s ASN 299 N 0.96 3.25 0.20 2.29 2.20 -1.26 -4.65 114.94 117.93 1hg1 s ASN 299 Ca 0.54 0.66 -0.13 0.00 -0.94 0.00 0.00 52.86 52.99 1hg1 s ASN 299 Cb -0.25 -1.00 0.23 0.00 -2.00 0.00 0.00 41.25 38.23 1hg1 s ASN 299 CO 0.29 -2.68 1.66 -0.65 -2.94 0.00 0.00 177.10 172.77 1hg1 h PRO 300 N -1.60 0.07 -0.32 3.55 0.11 -1.93 0.64 132.00 132.52 1hg1 h PRO 300 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1hg1 h PRO 300 Cb 1.30 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 1hg1 h PRO 300 CO 0.52 0.04 0.21 0.00 -0.21 0.00 0.00 178.00 178.56 1hg1 h ALA 301 N 1.53 0.40 -0.35 -0.75 0.00 -1.96 -1.17 119.26 116.96 1hg1 h ALA 301 Ca 0.29 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 1hg1 h ALA 301 Cb 0.45 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1hg1 h ALA 301 CO -0.52 -0.14 -0.32 0.45 0.00 0.00 0.00 179.25 178.72 1hg1 h HIS 302 N 0.42 0.90 -0.64 0.00 3.86 -1.84 -2.94 115.15 114.91 1hg1 h HIS 302 Ca 0.12 -0.24 0.02 0.00 -1.16 0.00 0.00 60.37 59.11 1hg1 h HIS 302 Cb -0.04 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.19 1hg1 h HIS 302 CO -0.06 0.99 0.41 0.00 0.86 0.00 0.00 177.93 180.13 1hg1 h ALA 303 N 0.99 0.82 -0.56 2.45 0.00 -0.55 -1.45 119.26 120.96 1hg1 h ALA 303 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1hg1 h ALA 303 Cb 0.86 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1hg1 h ALA 303 CO 0.07 0.18 0.36 -0.09 0.00 0.00 0.00 179.25 179.78 1hg1 h ARG 304 N 0.81 0.74 -0.42 0.00 2.43 -1.14 0.80 114.38 117.60 1hg1 h ARG 304 Ca 0.25 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 1hg1 h ARG 304 Cb -0.03 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1hg1 h ARG 304 CO -0.08 0.51 0.28 0.82 -1.51 0.00 0.00 179.97 179.98 1hg1 h ILE 305 N 0.76 1.10 -0.23 1.20 1.08 -1.26 -0.99 117.51 119.17 1hg1 h ILE 305 Ca 0.20 -0.19 -0.14 0.00 -0.39 0.00 0.00 64.86 64.34 1hg1 h ILE 305 Cb -0.06 0.49 -0.01 0.00 -3.07 0.00 0.00 36.82 34.16 1hg1 h ILE 305 CO -0.04 0.10 -0.45 0.25 -0.69 0.00 0.00 178.15 177.32 1hg1 h LEU 306 N 0.57 0.63 -0.60 1.44 5.85 -1.00 -2.66 115.31 119.53 1hg1 h LEU 306 Ca 0.16 -0.30 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 1hg1 h LEU 306 Cb -0.06 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 1hg1 h LEU 306 CO -0.04 0.99 0.04 0.25 -0.34 0.00 0.00 178.44 179.34 1hg1 h LEU 307 N 0.47 1.01 -0.09 2.25 5.85 -0.60 0.75 115.31 124.96 1hg1 h LEU 307 Ca 0.03 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.46 1hg1 h LEU 307 Cb 0.97 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 1hg1 h LEU 307 CO 0.09 1.05 0.05 0.24 -0.34 0.00 0.00 178.44 179.53 1hg1 h MET 308 N 0.94 0.11 -0.49 1.25 2.86 -1.10 -0.69 114.93 117.82 1hg1 h MET 308 Ca 0.18 -0.01 -0.07 0.00 -2.06 0.00 0.00 59.70 57.73 1hg1 h MET 308 Cb 0.50 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 1hg1 h MET 308 CO 0.02 0.10 0.00 -0.07 1.06 0.00 0.00 176.91 178.03 1hg1 h LEU 309 N 0.09 0.78 -0.94 1.22 3.38 -1.34 -2.56 115.31 115.93 1hg1 h LEU 309 Ca 0.03 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 1hg1 h LEU 309 Cb 0.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 1hg1 h LEU 309 CO -0.01 0.84 0.31 0.00 0.09 0.00 0.00 178.44 179.68 1hg1 h ALA 310 N 1.25 1.16 0.00 1.53 0.00 -0.51 -2.27 119.26 120.42 1hg1 h ALA 310 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1hg1 h ALA 310 Cb 0.45 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1hg1 h ALA 310 CO 0.02 0.61 0.00 1.28 0.00 0.00 0.00 179.25 181.16 1hg1 n LEU 311 N -4.30 0.22 0.02 0.00 4.77 -0.29 -1.52 117.00 115.90 1hg1 n LEU 311 Ca 0.07 0.56 0.13 0.00 -0.03 0.00 0.00 56.01 56.74 1hg1 n LEU 311 Cb 0.17 -0.54 0.43 0.00 -2.33 0.00 0.00 43.42 41.15 1hg1 n LEU 311 CO 0.40 -0.41 0.74 0.35 -1.33 0.00 0.00 177.39 177.14 1hg1 n THR 312 N -1.75 0.14 0.00 -5.08 -2.24 -0.85 -4.11 114.28 100.38 1hg1 n THR 312 Ca 0.02 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1hg1 n THR 312 Cb 0.16 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 1hg1 n THR 312 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hg1 n ARG 313 N -1.69 1.46 -3.61 -0.78 1.74 -0.59 -5.11 116.66 108.08 1hg1 n ARG 313 Ca 0.06 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.09 1hg1 n ARG 313 Cb 0.37 -0.89 -0.02 0.00 -1.02 0.00 0.00 32.46 30.90 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 -1.75 0.00 0.00 0.55 -1.32 -0.58 -5.01 115.64 107.53 1hg1 s THR 314 Ca 0.00 -0.23 0.00 0.00 -1.21 0.00 0.00 61.69 60.25 1hg1 s THR 314 Cb 0.00 -1.44 0.00 0.00 -1.51 0.00 0.00 72.50 69.55 1hg1 s THR 314 CO 0.00 0.00 0.26 -1.54 -2.21 0.00 0.00 174.62 171.13 1hg1 n SER 315 N -0.32 0.53 -4.64 8.08 3.41 -1.26 -4.07 113.62 115.35 1hg1 n SER 315 Ca -0.06 -0.84 -0.43 0.00 -0.26 0.00 0.00 58.87 57.28 1hg1 n SER 315 Cb 0.61 0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.72 1hg1 n SER 315 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hg1 s ASP 316 N -0.18 6.44 0.37 4.04 -1.08 -1.26 -4.90 116.67 120.11 1hg1 s ASP 316 Ca 0.00 1.72 0.11 0.00 -0.52 0.00 0.00 52.55 53.86 1hg1 s ASP 316 Cb 0.00 -2.53 0.90 0.00 -1.46 0.00 0.00 42.92 39.83 1hg1 s ASP 316 CO 0.00 -1.19 1.87 -0.65 0.52 0.00 0.00 175.17 175.72 1hg1 h PRO 317 N 10.47 0.58 0.58 4.34 0.11 -1.99 -2.04 132.00 144.05 1hg1 h PRO 317 Ca -0.34 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.71 1hg1 h PRO 317 Cb 1.15 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 1hg1 h PRO 317 CO 0.99 0.39 -0.32 0.87 -0.21 0.00 0.00 178.00 179.72 1hg1 h LYS 318 N 0.60 -0.81 -0.29 1.05 1.79 -1.99 -0.56 116.57 116.36 1hg1 h LYS 318 Ca 0.45 0.06 0.01 0.00 -2.18 0.00 0.00 60.65 58.98 1hg1 h LYS 318 Cb 0.83 0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.65 1hg1 h LYS 318 CO -0.20 -0.54 0.16 0.28 -1.08 0.00 0.00 179.45 178.08 1hg1 h VAL 319 N -0.84 1.03 -0.92 0.50 2.07 -1.86 -1.77 116.25 114.45 1hg1 h VAL 319 Ca -0.07 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.35 1hg1 h VAL 319 Cb 0.67 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.05 1hg1 h VAL 319 CO 0.10 0.06 0.61 0.40 0.02 0.00 0.00 177.57 178.76 1hg1 h ILE 320 N 0.34 1.19 -0.51 4.57 2.04 -1.34 -1.11 117.51 122.69 1hg1 h ILE 320 Ca 0.11 -0.41 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 1hg1 h ILE 320 Cb 0.00 -0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 35.95 1hg1 h ILE 320 CO -0.06 0.22 -0.07 -0.61 0.00 0.00 0.00 178.15 177.63 1hg1 h GLN 321 N 1.20 0.92 -0.59 2.37 5.75 -0.64 -2.18 115.11 121.94 1hg1 h GLN 321 Ca 0.35 -0.30 -0.08 0.00 -0.15 0.00 0.00 58.65 58.47 1hg1 h GLN 321 Cb -0.06 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.39 1hg1 h GLN 321 CO -0.09 0.95 0.05 1.49 -2.65 0.00 0.00 178.83 178.57 1hg1 h GLU 322 N 0.83 0.99 -0.33 1.69 4.22 -0.65 -2.56 114.58 118.78 1hg1 h GLU 322 Ca 0.14 -0.28 0.05 0.00 0.08 0.00 0.00 59.36 59.36 1hg1 h GLU 322 Cb 0.59 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 1hg1 h GLU 322 CO 0.04 0.95 0.05 1.88 -2.18 0.00 0.00 179.01 179.74 1hg1 h TYR 323 N 0.92 0.07 0.00 0.92 0.05 -0.84 -1.35 116.97 116.75 1hg1 h TYR 323 Ca 0.18 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.98 1hg1 h TYR 323 Cb 0.47 0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.23 1hg1 h TYR 323 CO 0.03 -0.00 0.00 0.74 -1.05 0.00 0.00 178.16 177.88 1hg1 h PHE 324 N 0.15 0.00 -0.01 4.88 -1.00 -1.01 0.11 116.94 120.06 1hg1 h PHE 324 Ca 0.16 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.94 1hg1 h PHE 324 Cb 0.19 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.75 1hg1 h PHE 324 CO -0.20 0.00 -0.60 0.72 -1.61 0.00 0.00 178.31 176.63 1hg1 n HIS 325 N -2.77 0.00 0.00 -0.55 8.25 -0.58 -4.49 115.22 115.08 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 0.16 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.21 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 -0.86 0.00 0.68 1.59 -2.24 -0.61 -5.07 114.28 107.76 1hg1 n THR 326 Ca 0.08 -0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.88 1hg1 n THR 326 Cb 0.38 0.52 0.07 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