#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1axd s PRO 2 N 0.00 1.44 0.63 0.00 0.04 -1.26 -4.94 135.00 130.90 1axd s PRO 2 Ca 0.00 1.05 -0.13 0.00 0.04 0.00 0.00 61.00 61.96 1axd s PRO 2 Cb 0.00 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.70 1axd s PRO 2 CO 0.00 -2.18 1.05 -1.64 0.04 0.00 0.00 177.00 174.27 1axd s MET 3 N -4.85 3.26 -0.21 4.56 -1.94 0.78 -4.81 119.30 116.08 1axd s MET 3 Ca 0.63 1.04 -0.02 0.00 -1.71 0.00 0.00 55.69 55.64 1axd s MET 3 Cb -0.19 -2.03 0.01 0.00 2.01 0.00 0.00 34.83 34.63 1axd s MET 3 CO 0.57 -0.85 -0.09 0.15 -0.01 0.00 0.00 175.02 174.80 1axd s LYS 4 N -4.54 3.18 -0.31 2.03 1.02 -0.11 0.01 119.74 121.02 1axd s LYS 4 Ca 0.60 -0.74 -0.08 0.00 0.02 0.00 0.00 55.97 55.77 1axd s LYS 4 Cb -0.14 -2.89 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 1axd s LYS 4 CO 0.45 -0.24 0.12 -1.17 -0.92 0.00 0.00 175.35 173.59 1axd s LEU 5 N 1.40 4.00 -0.21 3.17 2.96 -0.30 -0.94 118.68 128.77 1axd s LEU 5 Ca 0.05 -0.63 -0.17 0.00 -0.22 0.00 0.00 54.13 53.15 1axd s LEU 5 Cb -0.14 -1.94 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1axd s LEU 5 CO -0.06 -0.20 0.47 -0.31 -1.32 0.00 0.00 176.35 174.93 1axd s TYR 6 N 1.56 3.36 0.00 5.38 2.02 0.45 0.05 117.35 130.16 1axd s TYR 6 Ca 0.04 0.70 0.00 0.00 -0.37 0.00 0.00 57.07 57.43 1axd s TYR 6 Cb -0.17 -2.62 0.00 0.00 -0.40 0.00 0.00 41.96 38.77 1axd s TYR 6 CO 0.04 -0.08 0.00 0.41 -1.57 0.00 0.00 175.55 174.35 1axd n GLY 7 N 3.95 3.71 3.74 0.71 0.00 0.41 -3.00 105.19 114.71 1axd n GLY 7 Ca -0.06 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 1axd n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1axd s ALA 8 N -2.00 3.30 0.63 4.61 0.00 -1.26 -4.05 121.76 122.99 1axd s ALA 8 Ca 0.00 0.60 0.31 0.00 0.00 0.00 0.00 51.96 52.88 1axd s ALA 8 Cb 0.00 -3.24 1.72 0.00 0.00 0.00 0.00 23.12 21.60 1axd s ALA 8 CO 0.00 0.10 2.04 -0.39 0.00 0.00 0.00 175.76 177.52 1axd h VAL 9 N 3.54 0.24 -0.34 0.00 -1.51 -1.98 -2.44 116.25 113.76 1axd h VAL 9 Ca -0.44 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 1axd h VAL 9 Cb 1.20 0.77 -0.02 0.00 -2.13 0.00 0.00 31.29 31.11 1axd h VAL 9 CO 0.70 0.00 0.22 -0.03 -1.23 0.00 0.00 177.57 177.23 1axd h MET 10 N 0.00 0.45 -6.30 5.19 1.85 -1.91 -3.43 114.93 110.78 1axd h MET 10 Ca 0.07 -0.03 -0.54 0.00 -0.61 0.00 0.00 59.70 58.59 1axd h MET 10 Cb 0.60 -0.10 -0.03 0.00 0.43 0.00 0.00 31.60 32.50 1axd h MET 10 CO -0.00 0.30 0.23 -1.54 -0.40 0.00 0.00 176.91 175.50 1axd s SER 11 N -6.75 7.24 0.08 1.39 1.04 -0.92 -4.93 113.70 110.85 1axd s SER 11 Ca -0.08 1.50 0.20 0.00 0.48 0.00 0.00 55.95 58.05 1axd s SER 11 Cb 0.17 -2.50 0.83 0.00 0.10 0.00 0.00 66.02 64.62 1axd s SER 11 CO 0.72 -0.11 1.63 -2.67 0.98 0.00 0.00 173.24 173.79 1axd n TRP 12 N 3.35 0.27 0.08 5.02 2.14 -1.26 -1.54 117.44 125.50 1axd n TRP 12 Ca 0.01 0.10 -0.09 0.00 2.07 0.00 0.00 57.50 59.58 1axd n TRP 12 Cb 0.51 -0.66 -0.06 0.00 -0.81 0.00 0.00 31.31 30.29 1axd n TRP 12 CO 0.00 0.00 0.00 -0.91 2.07 0.00 0.00 177.69 178.85 1axd h ASN 13 N 0.00 0.20 -0.02 -0.67 2.35 -1.94 -1.88 115.58 113.63 1axd h ASN 13 Ca 0.00 -0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1axd h ASN 13 Cb 0.36 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1axd h ASN 13 CO 0.00 1.06 -0.03 0.25 -1.65 0.00 0.00 177.43 177.05 1axd h LEU 14 N 0.06 0.06 -1.01 1.61 6.46 -1.59 -3.03 115.31 117.88 1axd h LEU 14 Ca -0.05 -0.57 0.00 0.00 -0.12 0.00 0.00 57.88 57.14 1axd h LEU 14 Cb 1.65 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 41.57 1axd h LEU 14 CO 0.14 0.62 0.00 0.74 -0.62 0.00 0.00 178.44 179.32 1axd h THR 15 N -0.50 0.00 -0.91 1.05 2.02 -1.46 -2.91 112.91 110.19 1axd h THR 15 Ca 0.00 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.69 1axd h THR 15 Cb 0.61 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 68.40 1axd h THR 15 CO 0.01 0.00 0.59 -0.09 0.37 0.00 0.00 175.52 176.40 1axd h ARG 16 N 0.00 1.21 -0.36 6.66 2.43 -1.20 -1.76 114.38 121.36 1axd h ARG 16 Ca 0.00 -0.08 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 1axd h ARG 16 Cb 0.54 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1axd h ARG 16 CO 0.00 0.82 -0.07 0.00 -1.51 0.00 0.00 179.97 179.21 1axd h ALA 18 N 0.83 1.14 -0.50 0.00 0.00 -1.40 0.14 119.26 119.47 1axd h ALA 18 Ca 0.09 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.09 1axd h ALA 18 Cb 0.57 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1axd h ALA 18 CO 0.03 0.08 0.22 1.15 0.00 0.00 0.00 179.25 180.73 1axd h THR 19 N 0.76 0.91 -0.37 0.00 2.02 -1.19 0.20 112.91 115.24 1axd h THR 19 Ca 0.39 -0.15 -0.10 0.00 0.77 0.00 0.00 66.41 67.31 1axd h THR 19 Cb 0.35 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1axd h THR 19 CO -0.24 0.08 -0.18 0.00 0.37 0.00 0.00 175.52 175.55 1axd h ALA 20 N 1.29 0.52 -0.61 6.16 0.00 -1.15 -2.09 119.26 123.39 1axd h ALA 20 Ca 0.23 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1axd h ALA 20 Cb 0.18 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1axd h ALA 20 CO -0.19 0.46 0.24 -0.07 0.00 0.00 0.00 179.25 179.69 1axd h LEU 21 N 0.57 0.84 0.47 0.00 3.38 -0.27 -2.17 115.31 118.13 1axd h LEU 21 Ca 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1axd h LEU 21 Cb 0.72 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1axd h LEU 21 CO 0.05 0.78 -0.22 -0.08 0.09 0.00 0.00 178.44 179.07 1axd h GLU 22 N 0.85 -0.60 0.00 1.13 4.57 -0.53 -0.30 114.58 119.70 1axd h GLU 22 Ca 0.20 0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.41 1axd h GLU 22 Cb 0.20 0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 1axd h GLU 22 CO -0.02 -0.38 -0.06 0.93 -1.18 0.00 0.00 179.01 178.31 1axd h GLU 23 N -0.67 0.00 -0.23 1.92 4.39 -1.32 -1.00 114.58 117.67 1axd h GLU 23 Ca -0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1axd h GLU 23 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1axd h GLU 23 CO 0.11 0.06 0.00 0.00 -1.16 0.00 0.00 179.01 178.01 1axd n ALA 24 N -2.34 2.49 -1.83 3.43 0.00 -0.82 -4.91 120.51 116.53 1axd n ALA 24 Ca -0.03 -0.61 -0.19 0.00 0.00 0.00 0.00 53.44 52.62 1axd n ALA 24 Cb 0.15 -1.04 -0.06 0.00 0.00 0.00 0.00 19.45 18.50 1axd n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1axd n GLY 25 N 1.18 1.04 3.77 0.00 0.00 -0.38 -4.55 105.19 106.25 1axd n GLY 25 Ca 0.16 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1axd n GLY 25 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1axd s SER 26 N -2.57 6.55 -0.75 1.61 0.01 -0.15 -4.94 113.70 113.45 1axd s SER 26 Ca 0.00 2.73 -0.22 0.00 1.31 0.00 0.00 55.95 59.77 1axd s SER 26 Cb 0.00 -2.65 0.08 0.00 0.21 0.00 0.00 66.02 63.66 1axd s SER 26 CO 0.00 -0.69 1.06 -0.62 0.41 0.00 0.00 173.24 173.40 1axd s ASP 27 N -0.52 6.29 0.35 2.44 2.15 -1.26 -4.77 116.67 121.35 1axd s ASP 27 Ca 0.52 -1.21 0.03 0.00 0.43 0.00 0.00 52.55 52.33 1axd s ASP 27 Cb -0.40 -2.44 -0.04 0.00 -0.30 0.00 0.00 42.92 39.74 1axd s ASP 27 CO 0.53 -1.40 0.10 -0.72 -0.17 0.00 0.00 175.17 173.51 1axd s TYR 28 N 3.96 1.81 -0.13 -5.34 1.13 -1.26 -0.16 117.35 117.36 1axd s TYR 28 Ca 0.27 -1.16 -0.09 0.00 -1.41 0.00 0.00 57.07 54.69 1axd s TYR 28 Cb -0.12 -1.15 0.05 0.00 -1.10 0.00 0.00 41.96 39.63 1axd s TYR 28 CO 0.05 -0.20 0.33 -2.00 -2.51 0.00 0.00 175.55 171.21 1axd s GLU 29 N -3.83 0.33 -0.08 -3.49 2.12 0.10 -4.73 118.70 109.12 1axd s GLU 29 Ca 0.31 0.59 -0.25 0.00 0.36 0.00 0.00 54.97 55.97 1axd s GLU 29 Cb 0.06 0.02 -0.03 0.00 0.26 0.00 0.00 34.13 34.44 1axd s GLU 29 CO 0.15 -0.12 0.80 0.42 -0.54 0.00 0.00 175.26 175.97 1axd s ILE 30 N 0.91 4.96 -0.32 -3.70 1.01 -1.26 -1.15 121.20 121.64 1axd s ILE 30 Ca -0.06 1.64 0.02 0.00 0.00 0.00 0.00 60.65 62.25 1axd s ILE 30 Cb -0.07 -4.13 0.08 0.00 0.01 0.00 0.00 42.46 38.35 1axd s ILE 30 CO -0.07 0.16 0.01 -0.69 0.00 0.00 0.00 174.94 174.36 1axd s VAL 31 N 1.25 2.53 0.88 2.92 1.01 0.11 -4.92 120.40 124.18 1axd s VAL 31 Ca 0.41 -1.89 -0.12 0.00 0.00 0.00 0.00 61.98 60.38 1axd s VAL 31 Cb -0.18 -2.64 0.08 0.00 0.00 0.00 0.00 36.38 33.63 1axd s VAL 31 CO 0.19 -0.33 0.84 -2.65 0.00 0.00 0.00 175.10 173.14 1axd n PRO 32 N 4.43 -0.18 -3.80 2.72 -0.02 -1.26 -0.45 135.00 136.45 1axd n PRO 32 Ca -0.06 0.01 -0.20 0.00 -2.02 0.00 0.00 63.50 61.23 1axd n PRO 32 Cb 0.42 -2.15 -0.17 0.00 -0.02 0.00 0.00 33.50 31.58 1axd n PRO 32 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1axd s ILE 33 N -2.36 0.18 -0.37 4.25 -1.09 -1.26 -4.53 121.20 116.02 1axd s ILE 33 Ca 0.65 0.20 -0.18 0.00 -2.23 0.00 0.00 60.65 59.09 1axd s ILE 33 Cb -0.25 -0.34 0.00 0.00 -1.58 0.00 0.00 42.46 40.29 1axd s ILE 33 CO 0.60 0.20 0.48 0.21 -1.23 0.00 0.00 174.94 175.20 1axd s ASN 34 N 1.72 6.27 0.35 3.58 2.47 -1.26 -4.47 114.94 123.60 1axd s ASN 34 Ca 0.00 -0.19 0.14 0.00 0.42 0.00 0.00 52.86 53.23 1axd s ASN 34 Cb -0.13 -2.25 0.65 0.00 -1.45 0.00 0.00 41.25 38.08 1axd s ASN 34 CO -0.03 -0.49 1.76 -0.26 -3.72 0.00 0.00 177.10 174.36 1axd h PHE 35 N 8.53 0.00 0.00 0.43 0.04 -1.97 -2.37 116.94 121.60 1axd h PHE 35 Ca -0.28 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.49 1axd h PHE 35 Cb 1.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.27 1axd h PHE 35 CO 0.70 0.43 0.00 0.00 -0.60 0.00 0.00 178.31 178.84 1axd h ALA 36 N 1.57 1.00 -0.31 2.45 0.00 -2.03 0.96 119.26 122.90 1axd h ALA 36 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1axd h ALA 36 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1axd h ALA 36 CO 0.06 0.00 0.00 2.41 0.00 0.00 0.00 179.25 181.72 1axd n THR 37 N -2.68 1.11 -2.49 0.00 -1.04 -1.18 -4.94 114.28 103.05 1axd n THR 37 Ca -0.02 -1.08 -0.16 0.00 -2.04 0.00 0.00 64.05 60.76 1axd n THR 37 Cb 0.09 0.44 -0.01 0.00 -1.82 0.00 0.00 70.33 69.03 1axd n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1axd n ALA 38 N 0.34 -0.75 0.24 2.41 0.00 0.33 -4.82 120.51 118.26 1axd n ALA 38 Ca 0.11 0.13 0.06 0.00 0.00 0.00 0.00 53.44 53.74 1axd n ALA 38 Cb 0.45 -1.83 0.56 0.00 0.00 0.00 0.00 19.45 18.63 1axd n ALA 38 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1axd h GLU 39 N -0.09 0.00 0.00 0.00 4.81 -1.63 -0.29 114.58 117.39 1axd h GLU 39 Ca -0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1axd h GLU 39 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1axd h GLU 39 CO 0.43 0.11 0.00 -2.39 -0.73 0.00 0.00 179.01 176.43 1axd n HIS 40 N -4.41 0.79 -0.27 0.92 1.44 -1.26 -2.08 115.22 110.35 1axd n HIS 40 Ca -0.03 0.29 0.06 0.00 -2.01 0.00 0.00 57.72 56.03 1axd n HIS 40 Cb 0.18 -0.97 0.17 0.00 0.12 0.00 0.00 29.99 29.50 1axd n HIS 40 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1axd n LYS 41 N -2.20 2.89 -2.44 -1.40 4.76 -0.15 -4.39 118.16 115.22 1axd n LYS 41 Ca 0.03 -2.17 -0.35 0.00 -2.87 0.00 0.00 58.31 52.95 1axd n LYS 41 Cb 0.27 -1.35 -0.02 0.00 -1.84 0.00 0.00 35.03 32.09 1axd n LYS 41 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1axd s SER 42 N -1.09 6.16 0.60 4.39 1.04 -0.88 -4.85 113.70 119.08 1axd s SER 42 Ca 0.27 2.03 0.31 0.00 0.48 0.00 0.00 55.95 59.04 1axd s SER 42 Cb 0.15 -2.57 1.81 0.00 0.10 0.00 0.00 66.02 65.51 1axd s SER 42 CO 0.16 -0.91 2.19 -0.65 0.98 0.00 0.00 173.24 175.01 1axd h PRO 43 N 1.53 0.00 -0.04 4.02 0.11 -1.93 -0.29 132.00 135.40 1axd h PRO 43 Ca -0.50 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1axd h PRO 43 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1axd h PRO 43 CO 0.59 0.00 -0.03 0.93 -0.21 0.00 0.00 178.00 179.28 1axd h GLU 44 N 0.00 0.09 -0.05 1.05 5.08 -1.91 -3.15 114.58 115.68 1axd h GLU 44 Ca 0.04 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1axd h GLU 44 Cb 0.24 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1axd h GLU 44 CO -0.00 0.52 -0.39 1.25 -1.00 0.00 0.00 179.01 179.39 1axd h HIS 45 N -0.35 0.13 0.00 4.33 2.76 -1.48 -2.47 115.15 118.07 1axd h HIS 45 Ca 0.01 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 1axd h HIS 45 Cb 0.50 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.43 1axd h HIS 45 CO 0.08 0.49 0.00 -0.07 -1.30 0.00 0.00 177.93 177.14 1axd h LEU 46 N 0.09 0.00 0.00 0.26 4.07 -1.06 0.14 115.31 118.81 1axd h LEU 46 Ca 0.01 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.89 1axd h LEU 46 Cb 0.74 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.47 1axd h LEU 46 CO 0.06 0.00 -0.53 -0.37 -1.08 0.00 0.00 178.44 176.51 1axd h VAL 47 N 0.00 0.52 0.02 1.22 -1.51 -1.43 -3.18 116.25 111.89 1axd h VAL 47 Ca 0.00 -1.77 -0.31 0.00 -1.23 0.00 0.00 66.70 63.40 1axd h VAL 47 Cb 0.06 2.18 -0.05 0.00 -2.13 0.00 0.00 31.29 31.36 1axd h VAL 47 CO 0.00 0.29 -1.77 0.54 -1.23 0.00 0.00 177.57 175.40 1axd n ARG 48 N -3.10 0.65 -3.38 5.19 1.74 0.37 -4.77 116.66 113.36 1axd n ARG 48 Ca 0.01 0.28 -0.14 0.00 -0.77 0.00 0.00 57.85 57.24 1axd n ARG 48 Cb 0.68 -1.77 -0.09 0.00 -1.02 0.00 0.00 32.46 30.26 1axd n ARG 48 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1axd s ASN 49 N -6.21 1.00 0.49 0.55 3.84 -0.41 -4.52 114.94 109.68 1axd s ASN 49 Ca -0.07 -0.36 0.26 0.00 0.21 0.00 0.00 52.86 52.89 1axd s ASN 49 Cb 0.08 0.77 1.33 0.00 -0.55 0.00 0.00 41.25 42.88 1axd s ASN 49 CO 0.82 -0.35 1.89 -0.65 -2.79 0.00 0.00 177.10 176.01 1axd h PRO 50 N 8.23 0.14 -0.04 0.43 0.11 -1.82 0.26 132.00 139.31 1axd h PRO 50 Ca -0.14 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.96 1axd h PRO 50 Cb 1.12 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1axd h PRO 50 CO 0.30 0.09 0.00 1.19 -0.21 0.00 0.00 178.00 179.37 1axd n PHE 51 N -4.37 0.04 -3.63 0.65 3.72 -1.26 -4.94 117.46 107.67 1axd n PHE 51 Ca 0.18 -0.02 -0.22 0.00 -0.05 0.00 0.00 57.45 57.34 1axd n PHE 51 Cb 0.83 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 39.41 1axd n PHE 51 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1axd n GLY 52 N 1.01 -0.52 3.35 1.37 0.00 0.92 -5.01 105.19 106.30 1axd n GLY 52 Ca 0.18 0.24 -0.18 0.00 0.00 0.00 0.00 46.02 46.26 1axd n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1axd s GLN 53 N -5.75 1.48 0.08 1.61 -0.21 -1.26 -4.68 119.66 110.93 1axd s GLN 53 Ca 0.14 -1.80 0.09 0.00 0.02 0.00 0.00 55.36 53.80 1axd s GLN 53 Cb -0.04 -0.41 -0.03 0.00 1.00 0.00 0.00 33.01 33.54 1axd s GLN 53 CO 0.81 -0.27 -0.23 0.14 -2.12 0.00 0.00 175.29 173.61 1axd s VAL 54 N -3.64 1.89 0.84 1.09 -7.23 -1.26 -4.58 120.40 107.51 1axd s VAL 54 Ca 0.37 -1.47 -0.12 0.00 -1.81 0.00 0.00 61.98 58.95 1axd s VAL 54 Cb 0.08 -1.67 0.09 0.00 0.56 0.00 0.00 36.38 35.44 1axd s VAL 54 CO 0.14 0.11 1.12 -2.16 -0.31 0.00 0.00 175.10 174.00 1axd s PRO 55 N -1.64 1.74 -0.10 4.82 0.04 -1.26 -4.81 135.00 133.79 1axd s PRO 55 Ca 0.09 0.46 -0.09 0.00 0.04 0.00 0.00 61.00 61.50 1axd s PRO 55 Cb -0.10 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.58 1axd s PRO 55 CO 0.04 -1.82 0.27 0.00 0.04 0.00 0.00 177.00 175.53 1axd s ALA 56 N -3.24 -0.67 -0.04 8.56 0.00 -1.16 -4.03 121.76 121.19 1axd s ALA 56 Ca 0.62 0.80 0.05 0.00 0.00 0.00 0.00 51.96 53.43 1axd s ALA 56 Cb -0.14 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 1axd s ALA 56 CO 0.53 -0.14 -0.19 -1.17 0.00 0.00 0.00 175.76 174.79 1axd s LEU 57 N 0.26 1.98 -0.09 0.00 2.96 0.85 -0.41 118.68 124.23 1axd s LEU 57 Ca -0.01 -0.38 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 1axd s LEU 57 Cb -0.03 -1.05 -0.01 0.00 0.50 0.00 0.00 46.19 45.60 1axd s LEU 57 CO -0.01 0.20 -0.23 -1.58 -1.32 0.00 0.00 176.35 173.41 1axd s GLN 58 N -0.16 2.92 -0.43 1.98 0.74 -0.12 -0.89 119.66 123.70 1axd s GLN 58 Ca 0.00 -0.86 0.02 0.00 0.05 0.00 0.00 55.36 54.57 1axd s GLN 58 Cb -0.11 -2.30 0.14 0.00 1.10 0.00 0.00 33.01 31.85 1axd s GLN 58 CO 0.01 0.26 0.24 0.34 -0.55 0.00 0.00 175.29 175.59 1axd s ASP 59 N 0.16 3.46 0.42 6.67 2.15 -0.47 -0.93 116.67 128.14 1axd s ASP 59 Ca -0.13 -2.58 0.00 0.00 0.43 0.00 0.00 52.55 50.27 1axd s ASP 59 Cb -0.16 -0.90 0.00 0.00 -0.30 0.00 0.00 42.92 41.56 1axd s ASP 59 CO 0.07 -0.27 0.00 0.61 -0.17 0.00 0.00 175.17 175.41 1axd n GLY 60 N 3.58 1.42 0.05 2.66 0.00 -1.26 -1.51 105.19 110.12 1axd n GLY 60 Ca 0.10 0.18 0.02 0.00 0.00 0.00 0.00 46.02 46.32 1axd n GLY 60 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1axd n ASP 61 N 7.52 0.51 -4.75 1.61 8.00 -1.26 -4.99 116.55 123.18 1axd n ASP 61 Ca 0.00 -0.75 -0.40 0.00 0.71 0.00 0.00 54.79 54.35 1axd n ASP 61 Cb 0.00 0.75 -0.06 0.00 -0.02 0.00 0.00 41.12 41.80 1axd n ASP 61 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1axd s LEU 62 N -1.76 4.60 -0.09 0.64 2.96 -0.57 -5.04 118.68 119.41 1axd s LEU 62 Ca 0.03 2.01 0.01 0.00 -0.22 0.00 0.00 54.13 55.96 1axd s LEU 62 Cb 0.04 -3.65 0.02 0.00 0.50 0.00 0.00 46.19 43.10 1axd s LEU 62 CO 0.15 0.08 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.84 1axd s TYR 63 N -1.21 1.56 0.11 5.38 2.02 -1.26 -1.37 117.35 122.59 1axd s TYR 63 Ca 0.42 -0.70 0.06 0.00 -0.37 0.00 0.00 57.07 56.49 1axd s TYR 63 Cb -0.27 -1.20 -0.04 0.00 -0.40 0.00 0.00 41.96 40.06 1axd s TYR 63 CO 0.33 -0.42 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.23 1axd s LEU 64 N 1.17 2.35 0.23 -1.29 1.43 -0.07 -4.97 118.68 117.53 1axd s LEU 64 Ca -0.05 -0.74 -0.02 0.00 -1.03 0.00 0.00 54.13 52.29 1axd s LEU 64 Cb -0.14 -0.63 -0.03 0.00 0.03 0.00 0.00 46.19 45.42 1axd s LEU 64 CO -0.03 -0.08 0.22 0.72 0.23 0.00 0.00 176.35 177.41 1axd s PHE 65 N -1.72 1.12 -0.00 0.29 -0.71 -1.26 -0.11 117.98 115.58 1axd s PHE 65 Ca 0.06 -1.32 -0.00 0.00 -1.04 0.00 0.00 56.93 54.63 1axd s PHE 65 Cb -0.07 -0.45 0.00 0.00 -1.21 0.00 0.00 43.02 41.29 1axd s PHE 65 CO 0.03 -0.75 0.01 -1.91 -1.34 0.00 0.00 175.22 171.27 1axd n GLU 66 N -0.35 -0.61 -0.24 1.99 4.07 -1.26 -4.46 120.64 119.79 1axd n GLU 66 Ca 0.02 0.89 -0.11 0.00 -0.06 0.00 0.00 57.16 57.89 1axd n GLU 66 Cb 0.65 -1.14 -0.08 0.00 -0.06 0.00 0.00 31.44 30.80 1axd n GLU 66 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1axd h SER 67 N 0.51 -1.85 0.00 4.31 4.64 -1.87 -1.08 113.55 118.21 1axd h SER 67 Ca -0.02 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1axd h SER 67 Cb 0.04 0.80 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1axd h SER 67 CO 0.00 -0.34 0.05 0.03 -0.87 0.00 0.00 176.83 175.71 1axd h ARG 68 N -0.24 0.00 0.19 4.77 3.08 -1.92 -0.25 114.38 120.01 1axd h ARG 68 Ca 0.13 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.84 1axd h ARG 68 Cb 0.54 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.60 1axd h ARG 68 CO -0.72 0.00 -1.69 0.00 -1.07 0.00 0.00 179.97 176.48 1axd h ALA 69 N 1.88 0.13 -0.96 0.04 0.00 -1.48 -2.98 119.26 115.89 1axd h ALA 69 Ca 0.00 -1.11 0.01 0.00 0.00 0.00 0.00 54.91 53.81 1axd h ALA 69 Cb 0.11 0.44 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1axd h ALA 69 CO 0.00 0.97 0.63 0.82 0.00 0.00 0.00 179.25 181.67 1axd h ILE 70 N 0.07 1.25 -0.40 0.00 2.04 -0.64 -2.06 117.51 117.76 1axd h ILE 70 Ca -0.33 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1axd h ILE 70 Cb 2.07 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 1axd h ILE 70 CO 0.18 0.24 0.25 0.00 0.00 0.00 0.00 178.15 178.82 1axd h LYS 72 N 0.54 0.87 0.33 0.00 1.57 -1.30 -2.66 116.57 115.91 1axd h LYS 72 Ca 0.15 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1axd h LYS 72 Cb -0.03 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.15 1axd h LYS 72 CO -0.03 0.77 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.53 1axd h TYR 73 N 0.84 -0.45 -0.83 -1.35 3.20 -1.04 0.23 116.97 117.57 1axd h TYR 73 Ca 0.18 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.06 1axd h TYR 73 Cb 0.29 0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.67 1axd h TYR 73 CO 0.02 -0.28 0.55 0.00 -1.64 0.00 0.00 178.16 176.81 1axd h ALA 74 N 0.20 1.44 -0.04 1.82 0.00 -1.36 0.20 119.26 121.52 1axd h ALA 74 Ca -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1axd h ALA 74 Cb 0.37 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1axd h ALA 74 CO 0.06 0.50 -0.03 0.00 0.00 0.00 0.00 179.25 179.78 1axd h ALA 75 N 1.50 0.06 -0.86 0.00 0.00 -1.29 -0.21 119.26 118.45 1axd h ALA 75 Ca 0.31 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1axd h ALA 75 Cb -0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1axd h ALA 75 CO -0.08 -0.18 0.51 -0.09 0.00 0.00 0.00 179.25 179.41 1axd h ARG 76 N -0.34 1.18 -0.11 0.00 2.43 -0.19 0.62 114.38 117.98 1axd h ARG 76 Ca 0.01 -0.12 -0.09 0.00 -0.81 0.00 0.00 59.98 58.97 1axd h ARG 76 Cb 0.51 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1axd h ARG 76 CO 0.01 0.84 -0.28 -0.22 -1.51 0.00 0.00 179.97 178.82 1axd h LYS 77 N 1.19 0.38 0.00 0.20 3.64 -0.59 -3.37 116.57 118.03 1axd h LYS 77 Ca 0.31 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1axd h LYS 77 Cb -0.02 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1axd h LYS 77 CO -0.06 0.87 -1.40 0.09 -2.27 0.00 0.00 179.45 176.69 1axd n ASN 78 N -4.44 2.26 -2.95 4.20 5.03 -0.09 -4.86 115.26 114.40 1axd n ASN 78 Ca -0.07 -0.08 -0.15 0.00 0.87 0.00 0.00 54.58 55.15 1axd n ASN 78 Cb 0.46 1.45 0.01 0.00 -1.02 0.00 0.00 39.78 40.68 1axd n ASN 78 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 1axd n LYS 79 N -1.82 0.81 0.20 3.52 4.81 0.20 -4.93 118.16 120.94 1axd n LYS 79 Ca -0.02 -2.44 0.09 0.00 -0.87 0.00 0.00 58.31 55.07 1axd n LYS 79 Cb 0.28 -1.35 0.47 0.00 0.02 0.00 0.00 35.03 34.44 1axd n LYS 79 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1axd h PRO 80 N 3.76 0.00 0.00 1.64 0.13 -1.19 -1.06 132.00 135.28 1axd h PRO 80 Ca -0.04 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.06 1axd h PRO 80 Cb 0.98 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 1axd h PRO 80 CO 0.37 0.00 -0.16 0.93 -0.23 0.00 0.00 178.00 178.91 1axd h GLU 81 N 0.00 0.00 0.00 0.86 3.07 -1.94 -1.65 114.58 114.92 1axd h GLU 81 Ca 0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 1axd h GLU 81 Cb 0.55 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1axd h GLU 81 CO 0.00 0.16 -0.14 -0.07 -1.40 0.00 0.00 179.01 177.56 1axd h LEU 82 N 0.00 0.00 0.00 1.33 3.38 -1.48 -2.73 115.31 115.80 1axd h LEU 82 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1axd h LEU 82 Cb 0.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1axd h LEU 82 CO 0.02 0.14 -1.78 0.18 0.09 0.00 0.00 178.44 177.09 1axd n LEU 83 N -3.56 0.34 -2.84 1.67 4.77 -0.67 -1.80 117.00 114.90 1axd n LEU 83 Ca -0.01 0.14 -0.18 0.00 -0.03 0.00 0.00 56.01 55.93 1axd n LEU 83 Cb 0.28 0.11 0.06 0.00 -2.33 0.00 0.00 43.42 41.54 1axd n LEU 83 CO 0.30 0.10 0.19 -1.14 -1.33 0.00 0.00 177.39 175.51 1axd n ARG 84 N -2.57 -6.01 -0.26 3.23 3.00 -0.88 -4.33 116.66 108.83 1axd n ARG 84 Ca -0.10 0.63 -0.00 0.00 -0.00 0.00 0.00 57.85 58.37 1axd n ARG 84 Cb 0.74 -5.06 0.07 0.00 0.00 0.00 0.00 32.46 28.21 1axd n ARG 84 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1axd h GLU 85 N -2.03 -0.04 0.00 -0.14 4.39 -1.87 -2.50 114.58 112.40 1axd h GLU 85 Ca -0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.27 1axd h GLU 85 Cb 1.28 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1axd h GLU 85 CO 0.42 -0.03 0.00 0.41 -1.16 0.00 0.00 179.01 178.65 1axd n GLY 85 N -1.49 -0.58 2.80 -3.84 0.00 -1.26 -4.53 105.19 96.30 1axd n GLY 85 Ca 0.09 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1axd n GLY 85 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1axd s ASN 86 N -1.70 4.02 0.24 1.61 3.84 -0.94 -5.02 114.94 116.99 1axd s ASN 86 Ca 0.13 -1.58 -0.13 0.00 0.21 0.00 0.00 52.86 51.49 1axd s ASN 86 Cb 0.06 -0.99 0.32 0.00 -0.55 0.00 0.00 41.25 40.09 1axd s ASN 86 CO 0.10 -0.38 1.58 0.25 -2.79 0.00 0.00 177.10 175.87 1axd h LEU 87 N 8.01 -0.93 -0.98 3.21 5.85 -1.84 0.29 115.31 128.93 1axd h LEU 87 Ca -0.13 0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.75 1axd h LEU 87 Cb 1.03 0.57 -0.01 0.00 0.37 0.00 0.00 40.66 42.62 1axd h LEU 87 CO 0.46 -0.29 -0.33 -0.33 -0.34 0.00 0.00 178.44 177.62 1axd h GLU 88 N -0.02 0.33 0.15 1.25 3.07 -1.95 -1.98 114.58 115.44 1axd h GLU 88 Ca 0.38 -0.14 -0.29 0.00 -0.50 0.00 0.00 59.36 58.81 1axd h GLU 88 Cb 0.61 -0.01 0.02 0.00 -0.84 0.00 0.00 28.75 28.53 1axd h GLU 88 CO -0.87 0.63 -1.28 0.93 -1.40 0.00 0.00 179.01 177.02 1axd h GLU 91 N 0.29 0.46 -0.61 2.33 5.08 -1.12 -2.62 114.58 118.40 1axd h GLU 91 Ca 0.04 -0.70 -0.07 0.00 -1.00 0.00 0.00 59.36 57.63 1axd h GLU 91 Cb 0.72 0.25 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 1axd h GLU 91 CO 0.05 1.31 0.10 0.00 -1.00 0.00 0.00 179.01 179.48 1axd h ALA 92 N 0.40 1.03 -0.53 3.43 0.00 -0.49 -1.87 119.26 121.23 1axd h ALA 92 Ca -0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1axd h ALA 92 Cb 1.97 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 1axd h ALA 92 CO 0.23 0.62 0.24 0.00 0.00 0.00 0.00 179.25 180.34 1axd h ALA 93 N 1.17 0.68 -0.59 0.00 0.00 -1.38 -0.94 119.26 118.20 1axd h ALA 93 Ca 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1axd h ALA 93 Cb 0.40 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1axd h ALA 93 CO 0.01 0.26 0.36 1.98 0.00 0.00 0.00 179.25 181.86 1axd h MET 94 N 0.71 0.80 -0.04 0.00 -1.53 -1.06 -1.62 114.93 112.19 1axd h MET 94 Ca 0.18 -0.06 -0.01 0.00 -3.44 0.00 0.00 59.70 56.37 1axd h MET 94 Cb 0.15 -0.17 -0.00 0.00 -0.55 0.00 0.00 31.60 31.03 1axd h MET 94 CO -0.02 0.55 -0.02 0.28 0.14 0.00 0.00 176.91 177.85 1axd h VAL 95 N 0.81 1.32 -0.74 -5.77 2.07 -0.58 -2.93 116.25 110.44 1axd h VAL 95 Ca 0.21 -0.99 0.08 0.00 0.82 0.00 0.00 66.70 66.83 1axd h VAL 95 Cb -0.04 1.92 -0.07 0.00 -1.52 0.00 0.00 31.29 31.58 1axd h VAL 95 CO -0.04 0.27 0.40 0.44 0.02 0.00 0.00 177.57 178.66 1axd h ASP 96 N -0.32 0.56 -0.16 0.57 3.32 -0.75 -0.59 116.42 119.06 1axd h ASP 96 Ca 0.01 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.14 1axd h ASP 96 Cb 0.44 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.90 1axd h ASP 96 CO 0.00 0.33 -0.06 0.58 -1.72 0.00 0.00 179.24 178.37 1axd h VAL 97 N 0.69 0.78 0.00 -1.35 2.07 -1.28 -2.03 116.25 115.13 1axd h VAL 97 Ca 0.35 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.87 1axd h VAL 97 Cb 0.32 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1axd h VAL 97 CO -0.24 0.00 0.00 -0.50 0.02 0.00 0.00 177.57 176.85 1axd h TRP 98 N -0.04 0.00 -0.12 1.57 4.06 -1.22 -2.17 115.95 118.03 1axd h TRP 98 Ca 0.08 0.00 -0.15 0.00 2.06 0.00 0.00 58.89 60.88 1axd h TRP 98 Cb 0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 1axd h TRP 98 CO -0.21 0.00 -0.58 0.82 -3.56 0.00 0.00 178.44 174.91 1axd h ILE 99 N 0.00 1.36 -0.25 1.49 2.04 -0.54 -2.61 117.51 119.00 1axd h ILE 99 Ca 0.00 -1.89 -0.19 0.00 1.00 0.00 0.00 64.86 63.78 1axd h ILE 99 Cb 0.70 1.90 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 1axd h ILE 99 CO 0.00 0.57 -0.58 -0.33 0.00 0.00 0.00 178.15 177.81 1axd h GLU 100 N 0.28 0.80 -0.73 2.37 4.39 -0.83 -3.14 114.58 117.73 1axd h GLU 100 Ca -0.00 -0.53 0.00 0.00 0.34 0.00 0.00 59.36 59.17 1axd h GLU 100 Cb 1.10 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.78 1axd h GLU 100 CO 0.10 1.15 0.46 0.28 -1.16 0.00 0.00 179.01 179.84 1axd h VAL 101 N 0.61 1.20 -0.02 3.13 2.07 -1.22 0.21 116.25 122.23 1axd h VAL 101 Ca 0.00 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1axd h VAL 101 Cb 1.18 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1axd h VAL 101 CO 0.12 0.20 -0.01 -0.08 0.02 0.00 0.00 177.57 177.82 1axd h GLU 102 N 1.00 -0.01 -0.19 1.57 4.22 -1.43 -0.21 114.58 119.53 1axd h GLU 102 Ca 0.26 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.57 1axd h GLU 102 Cb -0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1axd h GLU 102 CO -0.05 -0.01 -0.40 0.00 -2.18 0.00 0.00 179.01 176.37 1axd h ALA 103 N 1.01 0.31 0.00 2.92 0.00 -1.42 0.28 119.26 122.35 1axd h ALA 103 Ca 0.01 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1axd h ALA 103 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1axd h ALA 103 CO -0.02 0.41 -0.65 0.09 0.00 0.00 0.00 179.25 179.07 1axd n ASN 104 N -4.25 0.61 0.08 0.00 3.02 0.71 -3.68 115.26 111.75 1axd n ASN 104 Ca -0.06 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 1axd n ASN 104 Cb 0.53 0.43 0.00 0.00 -0.61 0.00 0.00 39.78 40.14 1axd n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1axd n GLN 105 N -1.60 0.00 0.41 3.52 1.13 -0.15 -4.68 117.38 116.01 1axd n GLN 105 Ca 0.05 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.94 1axd n GLN 105 Cb 0.35 -0.31 -0.08 0.00 0.11 0.00 0.00 30.24 30.31 1axd n GLN 105 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 1axd h TYR 106 N 0.00 -0.98 0.00 1.08 3.20 -1.32 -2.77 116.97 116.19 1axd h TYR 106 Ca 0.00 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1axd h TYR 106 Cb 0.03 0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1axd h TYR 106 CO 0.00 -0.61 0.00 1.15 -1.64 0.00 0.00 178.16 177.06 1axd h THR 107 N -1.21 0.00 -0.52 1.81 2.02 -0.65 -1.70 112.91 112.65 1axd h THR 107 Ca -0.11 -0.52 -0.08 0.00 0.77 0.00 0.00 66.41 66.47 1axd h THR 107 Cb 0.81 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 1axd h THR 107 CO 0.18 0.00 0.01 0.00 0.37 0.00 0.00 175.52 176.08 1axd h ALA 108 N 2.22 1.04 0.08 6.16 0.00 -1.62 -0.49 119.26 126.65 1axd h ALA 108 Ca 0.00 -0.27 -0.31 0.00 0.00 0.00 0.00 54.91 54.32 1axd h ALA 108 Cb 0.63 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1axd h ALA 108 CO 0.00 0.60 -1.69 0.00 0.00 0.00 0.00 179.25 178.16 1axd h ALA 109 N 1.20 0.49 -0.05 0.00 0.00 -1.30 -3.39 119.26 116.20 1axd h ALA 109 Ca 0.16 -1.30 -0.18 0.00 0.00 0.00 0.00 54.91 53.59 1axd h ALA 109 Cb 0.47 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1axd h ALA 109 CO 0.02 1.34 -0.74 1.25 0.00 0.00 0.00 179.25 181.12 1axd h LEU 110 N 0.04 0.37 -0.32 0.00 5.85 -1.24 -3.35 115.31 116.67 1axd h LEU 110 Ca -0.29 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.22 1axd h LEU 110 Cb 2.01 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 42.89 1axd h LEU 110 CO 0.11 0.99 0.08 0.78 -0.34 0.00 0.00 178.44 180.06 1axd h ASN 111 N 0.21 0.04 -0.67 1.25 2.35 -1.28 -2.03 115.58 115.46 1axd h ASN 111 Ca -0.03 0.05 0.05 0.00 -0.55 0.00 0.00 56.30 55.82 1axd h ASN 111 Cb 1.31 0.06 -0.05 0.00 0.05 0.00 0.00 38.32 39.69 1axd h ASN 111 CO 0.12 0.06 0.38 -0.65 -1.65 0.00 0.00 177.43 175.69 1axd h PRO 112 N 0.19 0.70 -0.78 0.81 0.11 -1.80 -1.41 132.00 129.82 1axd h PRO 112 Ca 0.15 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.17 1axd h PRO 112 Cb 0.15 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.07 1axd h PRO 112 CO -0.18 0.46 0.30 0.82 -0.21 0.00 0.00 178.00 179.19 1axd h ILE 113 N 0.72 1.26 -0.36 4.15 2.04 -1.68 -1.95 117.51 121.69 1axd h ILE 113 Ca 0.29 -0.84 -0.11 0.00 1.00 0.00 0.00 64.86 65.19 1axd h ILE 113 Cb 0.14 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1axd h ILE 113 CO -0.16 0.34 -0.24 -0.07 0.00 0.00 0.00 178.15 178.02 1axd h LEU 114 N 1.15 0.74 0.23 1.44 3.38 -0.84 -0.59 115.31 120.81 1axd h LEU 114 Ca 0.26 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1axd h LEU 114 Cb 0.24 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1axd h LEU 114 CO -0.02 0.95 -0.11 0.15 0.09 0.00 0.00 178.44 179.50 1axd h PHE 115 N 0.63 -0.29 0.26 1.13 3.57 -1.03 -0.81 116.94 120.41 1axd h PHE 115 Ca 0.09 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 1axd h PHE 115 Cb 0.74 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 1axd h PHE 115 CO 0.04 0.01 -0.20 1.96 -2.23 0.00 0.00 178.31 177.89 1axd h GLN 116 N -0.57 -0.44 -0.07 1.11 1.08 -1.29 0.17 115.11 115.09 1axd h GLN 116 Ca -0.03 0.03 -0.19 0.00 -1.45 0.00 0.00 58.65 57.01 1axd h GLN 116 Cb 0.42 0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.95 1axd h GLN 116 CO 0.05 -0.29 -0.75 0.28 -0.95 0.00 0.00 178.83 177.17 1axd h VAL 117 N -0.46 1.39 0.00 -0.54 2.07 -1.20 -3.36 116.25 114.14 1axd h VAL 117 Ca -0.02 -2.19 -0.30 0.00 0.82 0.00 0.00 66.70 65.01 1axd h VAL 117 Cb 0.40 2.15 -0.05 0.00 -1.52 0.00 0.00 31.29 32.28 1axd h VAL 117 CO -0.01 0.66 -1.97 0.18 0.02 0.00 0.00 177.57 176.45 1axd n LEU 118 N -3.82 1.54 0.01 2.57 4.77 -0.32 -4.70 117.00 117.05 1axd n LEU 118 Ca -0.04 0.26 -0.11 0.00 -0.03 0.00 0.00 56.01 56.09 1axd n LEU 118 Cb 0.72 -0.63 -0.09 0.00 -2.33 0.00 0.00 43.42 41.09 1axd n LEU 118 CO 0.48 0.31 0.41 0.40 -1.33 0.00 0.00 177.39 177.66 1axd h ILE 119 N -0.77 1.07 -0.67 -0.08 1.08 -0.89 -3.28 117.51 113.97 1axd h ILE 119 Ca -0.46 -1.38 0.11 0.00 -0.39 0.00 0.00 64.86 62.75 1axd h ILE 119 Cb 1.36 1.85 -0.12 0.00 -3.07 0.00 0.00 36.82 36.85 1axd h ILE 119 CO -0.28 0.30 -0.36 -1.28 -0.69 0.00 0.00 178.15 175.84 1axd h SER 120 N -0.84 -1.25 -0.04 1.72 0.87 -0.90 0.17 113.55 113.27 1axd h SER 120 Ca -0.01 0.25 -0.03 0.00 -1.23 0.00 0.00 61.79 60.77 1axd h SER 120 Cb 0.58 0.62 -0.01 0.00 -0.44 0.00 0.00 62.40 63.16 1axd h SER 120 CO 0.02 -0.30 -0.03 -0.65 -0.53 0.00 0.00 176.83 175.34 1axd h PRO 121 N -0.13 0.20 -0.25 2.24 0.11 -1.71 0.50 132.00 132.96 1axd h PRO 121 Ca 0.25 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.24 1axd h PRO 121 Cb 0.56 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1axd h PRO 121 CO -0.74 0.25 -0.24 1.98 -0.21 0.00 0.00 178.00 179.03 1axd h MET 122 N 0.20 0.46 0.00 1.05 4.05 -0.76 -1.87 114.93 118.06 1axd h MET 122 Ca 0.05 -0.17 -0.04 0.00 -0.28 0.00 0.00 59.70 59.25 1axd h MET 122 Cb 0.19 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.95 1axd h MET 122 CO 0.01 0.67 -0.20 -0.07 0.23 0.00 0.00 176.91 177.55 1axd h LEU 123 N 0.41 0.00 0.00 3.39 3.38 -0.99 -3.46 115.31 118.03 1axd h LEU 123 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1axd h LEU 123 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1axd h LEU 123 CO 0.05 0.20 0.00 0.61 0.09 0.00 0.00 178.44 179.39 1axd n GLY 124 N 0.63 1.64 0.49 0.83 0.00 -0.70 -5.12 105.19 102.97 1axd n GLY 124 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.01 1axd n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1axd n GLY 125 N -0.13 2.62 3.33 -0.02 0.00 0.14 -4.97 105.19 106.15 1axd n GLY 125 Ca 0.00 -2.17 -0.26 0.00 0.00 0.00 0.00 46.02 43.59 1axd n GLY 125 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1axd s THR 126 N -0.02 1.92 0.07 2.61 -4.23 -1.26 -3.56 115.64 111.17 1axd s THR 126 Ca 0.05 -1.66 -0.31 0.00 -1.18 0.00 0.00 61.69 58.60 1axd s THR 126 Cb -0.00 -1.74 -0.07 0.00 1.34 0.00 0.00 72.50 72.03 1axd s THR 126 CO 0.03 -0.03 1.39 -0.89 -0.54 0.00 0.00 174.62 174.58 1axd s THR 127 N -1.21 3.51 -0.74 3.99 2.01 -1.26 -4.83 115.64 117.11 1axd s THR 127 Ca 0.10 1.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.91 1axd s THR 127 Cb -0.10 -3.66 0.09 0.00 0.01 0.00 0.00 72.50 68.85 1axd s THR 127 CO 0.05 0.05 1.00 -0.62 -0.69 0.00 0.00 174.62 174.41 1axd s ASP 128 N 1.43 6.31 0.40 3.53 2.15 -1.26 -4.90 116.67 124.34 1axd s ASP 128 Ca 0.64 -1.35 0.15 0.00 0.43 0.00 0.00 52.55 52.42 1axd s ASP 128 Cb -0.34 -2.40 1.01 0.00 -0.30 0.00 0.00 42.92 40.88 1axd s ASP 128 CO 0.29 -1.30 1.86 1.56 -0.17 0.00 0.00 175.17 177.41 1axd h GLN 129 N 9.32 0.47 -0.49 4.34 1.08 -1.98 -2.53 115.11 125.32 1axd h GLN 129 Ca -0.15 -0.03 0.10 0.00 -1.45 0.00 0.00 58.65 57.12 1axd h GLN 129 Cb 1.06 -0.11 -0.10 0.00 -0.05 0.00 0.00 27.48 28.28 1axd h GLN 129 CO 1.16 0.31 -0.16 -0.22 -0.95 0.00 0.00 178.83 178.97 1axd h LYS 130 N 0.49 -0.05 0.00 1.46 3.64 -2.00 0.19 116.57 120.31 1axd h LYS 130 Ca 0.46 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.82 1axd h LYS 130 Cb 1.02 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1axd h LYS 130 CO -0.19 -0.03 -0.07 -0.39 -2.27 0.00 0.00 179.45 176.50 1axd h VAL 131 N -0.05 0.19 -0.08 2.00 -1.51 -1.88 -1.81 116.25 113.11 1axd h VAL 131 Ca 0.24 -0.73 -0.21 0.00 -1.23 0.00 0.00 66.70 64.76 1axd h VAL 131 Cb 0.41 1.61 0.01 0.00 -2.13 0.00 0.00 31.29 31.19 1axd h VAL 131 CO -0.53 0.07 -0.77 0.58 -1.23 0.00 0.00 177.57 175.69 1axd h VAL 132 N 0.00 1.31 -0.25 7.19 2.07 -0.66 -2.41 116.25 123.50 1axd h VAL 132 Ca -0.00 -2.03 -0.18 0.00 0.82 0.00 0.00 66.70 65.31 1axd h VAL 132 Cb 0.61 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 1axd h VAL 132 CO 0.01 0.63 -0.56 0.44 0.02 0.00 0.00 177.57 178.11 1axd h ASP 133 N 0.33 0.92 -0.10 0.57 3.32 -0.76 -1.02 116.42 119.69 1axd h ASP 133 Ca -0.07 -0.55 -0.01 0.00 0.02 0.00 0.00 57.03 56.42 1axd h ASP 133 Cb 1.42 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.70 1axd h ASP 133 CO 0.16 1.31 0.04 -0.33 -1.72 0.00 0.00 179.24 178.69 1axd h GLU 134 N 0.58 0.15 0.00 3.56 5.08 -1.40 -1.81 114.58 120.73 1axd h GLU 134 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1axd h GLU 134 Cb 1.17 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1axd h GLU 134 CO 0.12 0.26 0.00 -0.91 -1.00 0.00 0.00 179.01 177.48 1axd h ASN 135 N 0.01 0.00 0.37 1.42 4.21 -1.47 -1.56 115.58 118.56 1axd h ASN 135 Ca 0.03 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.42 1axd h ASN 135 Cb 0.16 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.35 1axd h ASN 135 CO -0.00 0.00 -0.53 0.25 -1.29 0.00 0.00 177.43 175.86 1axd h LEU 136 N 0.00 0.20 -0.10 1.61 5.85 -0.81 -1.10 115.31 120.96 1axd h LEU 136 Ca 0.00 -0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.55 1axd h LEU 136 Cb 0.69 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1axd h LEU 136 CO 0.00 0.70 -0.19 -0.33 -0.34 0.00 0.00 178.44 178.28 1axd h GLU 137 N 0.14 0.31 -0.92 1.25 5.08 -0.44 -2.58 114.58 117.42 1axd h GLU 137 Ca 0.00 -0.20 0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1axd h GLU 137 Cb 0.99 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.21 1axd h GLU 137 CO 0.08 0.78 0.60 0.87 -1.00 0.00 0.00 179.01 180.34 1axd h LYS 138 N -0.14 1.09 -0.47 2.33 1.57 -1.27 -2.82 116.57 116.87 1axd h LYS 138 Ca 0.00 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 1axd h LYS 138 Cb 0.77 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 1axd h LYS 138 CO 0.04 0.72 0.01 1.25 -0.57 0.00 0.00 179.45 180.91 1axd h LEU 139 N 1.13 0.81 -1.25 2.94 5.85 -1.13 -3.02 115.31 120.65 1axd h LEU 139 Ca 0.37 -0.30 0.10 0.00 0.84 0.00 0.00 57.88 58.89 1axd h LEU 139 Cb 0.06 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 1axd h LEU 139 CO -0.12 0.91 0.56 0.11 -0.34 0.00 0.00 178.44 179.56 1axd h LYS 140 N 0.69 0.81 -0.16 1.25 1.57 -1.20 0.13 116.57 119.65 1axd h LYS 140 Ca 0.14 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 1axd h LYS 140 Cb 0.49 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1axd h LYS 140 CO 0.02 0.53 -0.12 0.87 -0.57 0.00 0.00 179.45 180.19 1axd h LYS 141 N 0.83 0.26 0.09 3.15 1.57 -1.48 0.40 116.57 121.39 1axd h LYS 141 Ca 0.40 -0.06 -0.27 0.00 -1.87 0.00 0.00 60.65 58.85 1axd h LYS 141 Cb 0.43 -0.04 0.03 0.00 0.08 0.00 0.00 32.23 32.73 1axd h LYS 141 CO -0.17 0.39 -1.09 0.28 -0.57 0.00 0.00 179.45 178.29 1axd h VAL 142 N 0.25 1.32 -0.73 0.50 2.07 -0.89 -3.25 116.25 115.52 1axd h VAL 142 Ca 0.05 -2.38 -0.03 0.00 0.82 0.00 0.00 66.70 65.16 1axd h VAL 142 Cb 0.36 2.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 1axd h VAL 142 CO 0.02 0.72 0.34 -0.07 0.02 0.00 0.00 177.57 178.60 1axd h LEU 143 N 0.19 0.97 -2.02 2.57 3.38 -0.19 -0.19 115.31 120.02 1axd h LEU 143 Ca -0.16 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 1axd h LEU 143 Cb 1.78 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1axd h LEU 143 CO 0.21 0.84 -0.09 1.05 0.09 0.00 0.00 178.44 180.54 1axd h GLU 144 N 1.03 0.00 0.17 1.13 4.11 -1.02 0.25 114.58 120.24 1axd h GLU 144 Ca 0.25 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 59.38 1axd h GLU 144 Cb 0.14 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.40 1axd h GLU 144 CO -0.03 0.09 -1.32 0.28 0.07 0.00 0.00 179.01 178.11 1axd h VAL 145 N 0.00 1.43 -0.77 -1.06 2.07 -1.35 -2.57 116.25 114.00 1axd h VAL 145 Ca -0.00 -2.96 -0.05 0.00 0.82 0.00 0.00 66.70 64.51 1axd h VAL 145 Cb 0.22 2.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.94 1axd h VAL 145 CO 0.01 0.87 0.27 1.88 0.02 0.00 0.00 177.57 180.63 1axd h TYR 146 N 0.10 1.21 0.05 1.57 -1.99 0.10 -1.36 116.97 116.64 1axd h TYR 146 Ca -0.17 -0.11 0.01 0.00 2.00 0.00 0.00 58.73 60.46 1axd h TYR 146 Cb 2.04 -0.35 -0.02 0.00 2.00 0.00 0.00 36.73 40.39 1axd h TYR 146 CO 0.08 0.93 -0.12 1.49 -0.00 0.00 0.00 178.16 180.54 1axd h GLU 147 N 1.13 -0.22 -0.70 4.88 4.57 -0.52 0.14 114.58 123.86 1axd h GLU 147 Ca 0.25 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.48 1axd h GLU 147 Cb 0.26 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.86 1axd h GLU 147 CO -0.01 -0.15 0.44 0.00 -1.18 0.00 0.00 179.01 178.11 1axd h ALA 148 N 0.69 0.92 -0.11 2.92 0.00 -1.24 -2.25 119.26 120.18 1axd h ALA 148 Ca 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1axd h ALA 148 Cb 0.26 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1axd h ALA 148 CO -0.08 0.21 0.04 -0.09 0.00 0.00 0.00 179.25 179.33 1axd h ARG 149 N 0.86 0.17 0.00 0.00 9.65 -0.84 -3.00 114.38 121.22 1axd h ARG 149 Ca 0.28 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.13 1axd h ARG 149 Cb 0.03 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 1axd h ARG 149 CO -0.11 0.29 0.00 1.28 2.80 0.00 0.00 179.97 184.23 1axd n LEU 150 N -4.90 0.06 0.03 3.80 4.77 0.45 -1.15 117.00 120.07 1axd n LEU 150 Ca -0.05 0.52 -0.20 0.00 -0.03 0.00 0.00 56.01 56.25 1axd n LEU 150 Cb 0.12 -0.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.56 1axd n LEU 150 CO 0.34 -0.34 -0.01 0.74 -1.33 0.00 0.00 177.39 176.79 1axd h THR 151 N 0.00 1.45 -0.17 -5.08 2.02 -1.27 -3.36 112.91 106.49 1axd h THR 151 Ca 0.00 -2.50 -0.10 0.00 0.77 0.00 0.00 66.41 64.59 1axd h THR 151 Cb 0.20 3.13 -0.00 0.00 -1.74 0.00 0.00 68.15 69.74 1axd h THR 151 CO 0.00 0.70 -0.28 0.11 0.37 0.00 0.00 175.52 176.42 1axd h LYS 152 N -0.43 0.49 -6.38 6.66 1.79 -1.39 -3.45 116.57 113.86 1axd h LYS 152 Ca -0.16 -0.30 -0.61 0.00 -2.18 0.00 0.00 60.65 57.40 1axd h LYS 152 Cb 1.60 0.03 -0.12 0.00 -1.58 0.00 0.00 32.23 32.16 1axd h LYS 152 CO 0.12 0.90 -0.69 0.00 -1.08 0.00 0.00 179.45 178.70 1axd h LYS 154 N 2.80 0.33 0.00 0.00 3.64 -1.79 -3.39 116.57 118.16 1axd h LYS 154 Ca -0.47 -0.19 -0.30 0.00 -1.27 0.00 0.00 60.65 58.43 1axd h LYS 154 Cb 1.20 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.96 1axd h LYS 154 CO 0.56 0.75 -0.27 0.66 -2.27 0.00 0.00 179.45 178.88 1axd n TYR 155 N -3.97 -0.24 -0.13 1.91 4.01 0.76 -4.94 117.16 114.57 1axd n TYR 155 Ca -0.02 -1.59 -0.11 0.00 -0.16 0.00 0.00 57.90 56.02 1axd n TYR 155 Cb 0.54 0.10 -0.02 0.00 -0.31 0.00 0.00 39.34 39.65 1axd n TYR 155 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 1axd h LEU 156 N 0.00 0.66 -1.75 7.72 3.38 -1.88 -3.16 115.31 120.27 1axd h LEU 156 Ca -0.16 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1axd h LEU 156 Cb 0.70 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1axd h LEU 156 CO 0.24 0.83 0.00 0.00 0.09 0.00 0.00 178.44 179.60 1axd n ALA 157 N -2.41 2.46 0.00 1.53 0.00 -1.26 -4.97 120.51 115.85 1axd n ALA 157 Ca -0.02 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.63 1axd n ALA 157 Cb 0.30 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1axd n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1axd n GLY 158 N 1.32 0.16 2.74 0.00 0.00 -1.20 -4.74 105.19 103.46 1axd n GLY 158 Ca 0.18 -1.17 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 1axd n GLY 158 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1axd n ASP 159 N 0.00 7.22 -3.61 1.61 8.00 -1.26 -0.17 116.55 128.34 1axd n ASP 159 Ca 0.00 -3.82 -0.16 0.00 0.71 0.00 0.00 54.79 51.53 1axd n ASP 159 Cb 0.00 -0.97 -0.07 0.00 -0.02 0.00 0.00 41.12 40.06 1axd n ASP 159 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1axd s PHE 160 N -3.96 -0.56 0.22 1.24 -0.71 -1.26 -4.90 117.98 108.05 1axd s PHE 160 Ca 0.54 1.09 -0.30 0.00 -1.04 0.00 0.00 56.93 57.22 1axd s PHE 160 Cb 0.45 0.30 -0.08 0.00 -1.21 0.00 0.00 43.02 42.47 1axd s PHE 160 CO -0.30 -0.49 1.06 -1.17 -1.34 0.00 0.00 175.22 172.97 1axd s LEU 161 N -0.81 4.55 0.25 -1.99 2.96 -1.26 -4.62 118.68 117.75 1axd s LEU 161 Ca -0.09 2.10 0.00 0.00 -0.22 0.00 0.00 54.13 55.93 1axd s LEU 161 Cb -0.02 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 1axd s LEU 161 CO 0.06 -0.10 0.23 -0.94 -1.32 0.00 0.00 176.35 174.29 1axd s SER 162 N -0.61 0.64 0.51 3.68 1.04 -1.26 -4.76 113.70 112.94 1axd s SER 162 Ca 0.46 -1.47 0.21 0.00 0.48 0.00 0.00 55.95 55.63 1axd s SER 162 Cb -0.29 0.47 1.29 0.00 0.10 0.00 0.00 66.02 67.59 1axd s SER 162 CO 0.36 -0.97 2.02 0.25 0.98 0.00 0.00 173.24 175.88 1axd h LEU 163 N 2.40 0.08 -0.79 2.42 5.85 -1.72 -1.96 115.31 121.59 1axd h LEU 163 Ca -0.31 0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.54 1axd h LEU 163 Cb 1.24 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 42.17 1axd h LEU 163 CO 0.45 0.05 0.38 0.00 -0.34 0.00 0.00 178.44 178.98 1axd h ALA 164 N 1.78 1.14 0.19 1.25 0.00 -1.85 -0.15 119.26 121.63 1axd h ALA 164 Ca 0.21 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1axd h ALA 164 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1axd h ALA 164 CO -0.02 -0.10 -0.09 -0.44 0.00 0.00 0.00 179.25 178.60 1axd h ASP 165 N 0.58 -0.22 -0.97 0.00 3.32 -1.72 -3.27 116.42 114.14 1axd h ASP 165 Ca 0.42 -0.30 0.17 0.00 0.02 0.00 0.00 57.03 57.33 1axd h ASP 165 Cb 0.56 0.06 -0.09 0.00 0.22 0.00 0.00 39.33 40.07 1axd h ASP 165 CO -0.34 0.25 0.61 -0.07 -1.72 0.00 0.00 179.24 177.97 1axd h LEU 166 N -0.76 0.74 -1.05 1.55 3.38 -1.37 -0.82 115.31 116.97 1axd h LEU 166 Ca -0.03 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1axd h LEU 166 Cb 0.51 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1axd h LEU 166 CO 0.04 0.31 0.00 0.59 0.09 0.00 0.00 178.44 179.48 1axd n ASN 167 N -4.66 0.48 -0.10 -0.43 3.02 -0.11 -0.87 115.26 112.59 1axd n ASN 167 Ca 0.21 0.70 0.12 0.00 -0.03 0.00 0.00 54.58 55.58 1axd n ASN 167 Cb 0.53 -0.77 0.27 0.00 -0.61 0.00 0.00 39.78 39.20 1axd n ASN 167 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1axd n HIS 168 N -2.12 0.00 0.17 3.10 8.25 -0.31 -4.58 115.22 119.73 1axd n HIS 168 Ca -0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.36 1axd n HIS 168 Cb 0.07 -0.18 -0.05 0.00 1.12 0.00 0.00 29.99 30.94 1axd n HIS 168 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1axd h VAL 169 N 0.50 0.00 -0.44 1.59 2.07 -1.12 -2.70 116.25 116.16 1axd h VAL 169 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1axd h VAL 169 Cb 0.51 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.19 1axd h VAL 169 CO 0.00 0.00 -0.15 0.77 0.02 0.00 0.00 177.57 178.21 1axd h SER 170 N -0.56 -0.55 -0.44 0.57 4.64 -1.81 0.89 113.55 116.30 1axd h SER 170 Ca -0.04 0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.36 1axd h SER 170 Cb 0.48 0.32 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 1axd h SER 170 CO -0.02 -0.19 0.01 -0.37 -0.87 0.00 0.00 176.83 175.39 1axd h VAL 171 N -0.06 1.26 -0.66 0.95 -1.51 -1.84 -2.67 116.25 111.72 1axd h VAL 171 Ca 0.21 -1.02 -0.08 0.00 -1.23 0.00 0.00 66.70 64.58 1axd h VAL 171 Cb 0.38 1.05 -0.03 0.00 -2.13 0.00 0.00 31.29 30.56 1axd h VAL 171 CO -0.48 0.35 0.09 0.74 -1.23 0.00 0.00 177.57 177.04 1axd h THR 172 N 0.62 1.26 -0.68 7.19 2.02 -1.11 -1.31 112.91 120.89 1axd h THR 172 Ca 0.13 -1.05 0.10 0.00 0.77 0.00 0.00 66.41 66.36 1axd h THR 172 Cb 0.48 0.65 -0.08 0.00 -1.74 0.00 0.00 68.15 67.46 1axd h THR 172 CO 0.02 0.39 0.30 0.25 0.37 0.00 0.00 175.52 176.85 1axd h LEU 173 N 1.02 0.34 -0.96 2.58 5.85 -0.74 0.12 115.31 123.52 1axd h LEU 173 Ca 0.20 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 1axd h LEU 173 Cb 0.45 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1axd h LEU 173 CO 0.01 0.18 -0.04 0.00 -0.34 0.00 0.00 178.44 178.26 1axd h LEU 175 N 0.67 0.89 -0.22 0.00 7.12 0.30 -0.99 115.31 123.07 1axd h LEU 175 Ca 0.13 -0.07 0.00 0.00 0.13 0.00 0.00 57.88 58.07 1axd h LEU 175 Cb 0.47 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 40.37 1axd h LEU 175 CO 0.02 0.72 0.00 0.49 -0.13 0.00 0.00 178.44 179.54 1axd n PHE 176 N -4.36 0.00 -0.01 1.25 3.01 -0.43 -1.36 117.46 115.55 1axd n PHE 176 Ca 0.07 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.54 1axd n PHE 176 Cb 0.10 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 39.58 1axd n PHE 176 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1axd n ALA 177 N -0.35 2.10 -2.52 4.37 0.00 -0.38 -4.94 120.51 118.79 1axd n ALA 177 Ca 0.00 -0.93 -0.25 0.00 0.00 0.00 0.00 53.44 52.26 1axd n ALA 177 Cb 0.04 -0.06 -0.11 0.00 0.00 0.00 0.00 19.45 19.33 1axd n ALA 177 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1axd s THR 178 N -0.85 2.04 -1.97 0.00 -4.23 -0.47 -5.00 115.64 105.16 1axd s THR 178 Ca 0.03 -2.16 0.14 0.00 -1.18 0.00 0.00 61.69 58.53 1axd s THR 178 Cb 0.02 -2.65 0.40 0.00 1.34 0.00 0.00 72.50 71.61 1axd s THR 178 CO 0.02 -0.19 1.29 -0.81 -0.54 0.00 0.00 174.62 174.39 1axd n PRO 179 N -0.77 0.44 -0.06 3.99 -0.04 -1.26 -2.83 135.00 134.48 1axd n PRO 179 Ca -0.05 0.01 0.12 0.00 -0.04 0.00 0.00 63.50 63.54 1axd n PRO 179 Cb 0.64 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.98 1axd n PRO 179 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1axd n TYR 180 N -1.02 0.14 0.16 0.54 4.01 -1.26 -4.18 117.16 115.56 1axd n TYR 180 Ca 0.11 -0.07 0.09 0.00 -0.16 0.00 0.00 57.90 57.87 1axd n TYR 180 Cb 0.05 0.00 0.48 0.00 -0.31 0.00 0.00 39.34 39.56 1axd n TYR 180 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1axd n ALA 181 N 0.53 1.10 0.38 -0.72 0.00 -1.13 -1.82 120.51 118.86 1axd n ALA 181 Ca 0.17 0.15 0.14 0.00 0.00 0.00 0.00 53.44 53.90 1axd n ALA 181 Cb 0.40 -1.27 0.45 0.00 0.00 0.00 0.00 19.45 19.04 1axd n ALA 181 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1axd h SER 182 N 0.00 0.00 -0.81 0.00 4.64 -1.87 -3.27 113.55 112.24 1axd h SER 182 Ca 0.00 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.43 1axd h SER 182 Cb 0.04 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.07 1axd h SER 182 CO 0.00 0.00 0.53 -0.37 -0.87 0.00 0.00 176.83 176.12 1axd h VAL 183 N 0.00 0.90 0.00 0.95 -1.51 -1.70 -1.06 116.25 113.84 1axd h VAL 183 Ca 0.00 -0.23 -0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1axd h VAL 183 Cb 0.64 0.16 -0.00 0.00 -2.13 0.00 0.00 31.29 29.96 1axd h VAL 183 CO 0.00 0.12 -0.02 -0.07 -1.23 0.00 0.00 177.57 176.37 1axd h LEU 184 N 0.68 0.00 -1.94 4.19 4.07 -1.81 -2.75 115.31 117.75 1axd h LEU 184 Ca 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.33 1axd h LEU 184 Cb 0.56 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.30 1axd h LEU 184 CO -0.15 0.02 -0.07 0.44 -1.08 0.00 0.00 178.44 177.60 1axd h ASP 185 N 0.00 0.00 0.70 -0.43 5.19 -1.43 0.50 116.42 120.95 1axd h ASP 185 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1axd h ASP 185 Cb 0.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.64 1axd h ASP 185 CO 0.00 0.07 -0.02 0.00 -3.12 0.00 0.00 179.24 176.17 1axd n ALA 186 N -2.48 2.48 -3.86 3.45 0.00 -1.04 -4.30 120.51 114.76 1axd n ALA 186 Ca -0.03 -0.14 -0.29 0.00 0.00 0.00 0.00 53.44 52.98 1axd n ALA 186 Cb 0.15 -1.46 -0.13 0.00 0.00 0.00 0.00 19.45 18.00 1axd n ALA 186 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1axd s TYR 187 N -2.72 2.99 0.17 0.00 2.02 0.17 -5.00 117.35 114.97 1axd s TYR 187 Ca 0.23 -3.05 -0.18 0.00 -0.37 0.00 0.00 57.07 53.70 1axd s TYR 187 Cb 0.20 -2.53 0.10 0.00 -0.40 0.00 0.00 41.96 39.33 1axd s TYR 187 CO 0.49 -0.69 1.64 -1.35 -1.57 0.00 0.00 175.55 174.07 1axd h PRO 188 N 6.15 -0.08 -0.05 -1.71 0.11 -1.75 0.88 132.00 135.55 1axd h PRO 188 Ca 0.02 0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.99 1axd h PRO 188 Cb 0.86 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.97 1axd h PRO 188 CO 0.65 -0.06 -0.63 0.45 -0.21 0.00 0.00 178.00 178.20 1axd h HIS 189 N -0.09 0.25 -0.31 0.65 3.86 -1.92 -0.85 115.15 116.74 1axd h HIS 189 Ca 0.20 -0.10 -0.16 0.00 -1.16 0.00 0.00 60.37 59.15 1axd h HIS 189 Cb 0.39 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 1axd h HIS 189 CO -0.41 0.77 -0.45 0.28 0.86 0.00 0.00 177.93 178.98 1axd h VAL 190 N 0.14 1.28 -0.43 2.45 2.07 -1.80 -1.36 116.25 118.60 1axd h VAL 190 Ca -0.01 -1.63 -0.10 0.00 0.82 0.00 0.00 66.70 65.78 1axd h VAL 190 Cb 1.14 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 1axd h VAL 190 CO 0.09 0.53 -0.12 0.50 0.02 0.00 0.00 177.57 178.60 1axd h LYS 191 N 0.65 0.84 -0.47 1.57 3.64 -0.63 -1.62 116.57 120.54 1axd h LYS 191 Ca 0.04 -0.33 -0.02 0.00 -1.27 0.00 0.00 60.65 59.08 1axd h LYS 191 Cb 1.03 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1axd h LYS 191 CO 0.10 0.96 0.23 0.00 -2.27 0.00 0.00 179.45 178.47 1axd h ALA 192 N 0.86 0.61 -0.77 5.00 0.00 -1.08 -1.54 119.26 122.32 1axd h ALA 192 Ca 0.11 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1axd h ALA 192 Cb 0.66 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1axd h ALA 192 CO 0.05 0.16 0.45 2.35 0.00 0.00 0.00 179.25 182.26 1axd h TRP 193 N 0.62 0.83 -0.24 0.00 7.01 -1.05 0.09 115.95 123.19 1axd h TRP 193 Ca 0.16 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.15 1axd h TRP 193 Cb 0.11 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 1axd h TRP 193 CO -0.01 0.39 -0.00 2.35 -2.79 0.00 0.00 178.44 178.37 1axd h TRP 194 N 0.80 0.47 -0.86 2.65 -0.00 -0.88 -2.49 115.95 115.64 1axd h TRP 194 Ca 0.35 -0.08 0.00 0.00 -0.00 0.00 0.00 58.89 59.16 1axd h TRP 194 Cb 0.23 -0.12 -0.04 0.00 -0.00 0.00 0.00 29.16 29.23 1axd h TRP 194 CO -0.06 0.60 0.55 0.77 -0.00 0.00 0.00 178.44 180.31 1axd h SER 195 N 0.20 1.00 -0.67 2.65 0.02 -0.70 -0.25 113.55 115.81 1axd h SER 195 Ca 0.07 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.96 1axd h SER 195 Cb 0.42 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 1axd h SER 195 CO 0.01 0.74 0.35 1.23 -1.14 0.00 0.00 176.83 178.02 1axd h GLY 196 N 1.18 1.02 1.19 -3.77 0.00 -0.82 -2.92 103.07 98.95 1axd h GLY 196 Ca 0.31 -0.48 -0.12 0.00 0.00 0.00 0.00 47.33 47.04 1axd h GLY 196 CO -0.06 0.46 -0.20 1.41 0.00 0.00 0.00 176.54 178.15 1axd h LEU 197 N 0.92 0.95 -2.29 3.11 3.38 -0.90 -3.03 115.31 117.45 1axd h LEU 197 Ca 0.23 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1axd h LEU 197 Cb 0.08 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1axd h LEU 197 CO -0.03 1.11 0.13 -0.03 0.09 0.00 0.00 178.44 179.71 1axd h MET 198 N 0.81 0.00 -0.01 1.13 4.05 -0.88 -1.66 114.93 118.37 1axd h MET 198 Ca 0.11 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.53 1axd h MET 198 Cb 0.76 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.56 1axd h MET 198 CO 0.06 0.00 0.00 0.39 0.23 0.00 0.00 176.91 177.59 1axd n GLU 199 N -3.86 1.18 -3.09 0.39 -0.58 -1.14 -4.57 120.64 108.96 1axd n GLU 199 Ca -0.00 -0.26 -0.37 0.00 -0.42 0.00 0.00 57.16 56.11 1axd n GLU 199 Cb 0.23 -1.45 -0.06 0.00 -0.57 0.00 0.00 31.44 29.60 1axd n GLU 199 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 1axd s ARG 200 N -1.98 4.30 0.35 3.49 0.52 -0.62 -4.97 118.95 120.03 1axd s ARG 200 Ca 0.41 0.91 0.08 0.00 -0.52 0.00 0.00 55.73 56.61 1axd s ARG 200 Cb 0.20 -2.95 0.66 0.00 0.52 0.00 0.00 34.95 33.38 1axd s ARG 200 CO 0.32 0.43 1.85 -1.00 0.02 0.00 0.00 175.30 176.92 1axd h PRO 201 N 3.60 0.28 -0.39 3.54 0.13 -1.88 -2.67 132.00 134.61 1axd h PRO 201 Ca -0.48 -0.08 0.04 0.00 -0.87 0.00 0.00 66.00 64.62 1axd h PRO 201 Cb 1.20 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 1axd h PRO 201 CO 0.65 0.47 0.14 0.66 -0.23 0.00 0.00 178.00 179.69 1axd h SER 202 N 0.26 0.15 0.97 1.44 4.64 -1.93 0.11 113.55 119.20 1axd h SER 202 Ca 0.05 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 61.32 1axd h SER 202 Cb 0.49 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1axd h SER 202 CO 0.03 0.12 -0.42 -0.37 -0.87 0.00 0.00 176.83 175.33 1axd h VAL 203 N 0.30 0.90 0.00 0.95 -1.51 -1.82 -2.66 116.25 112.41 1axd h VAL 203 Ca 0.18 -1.70 -0.11 0.00 -1.23 0.00 0.00 66.70 63.84 1axd h VAL 203 Cb 0.15 2.05 -0.02 0.00 -2.13 0.00 0.00 31.29 31.34 1axd h VAL 203 CO -0.18 0.41 -0.50 1.56 -1.23 0.00 0.00 177.57 177.63 1axd h GLN 204 N 0.00 0.00 0.14 5.19 4.20 -1.00 -1.84 115.11 121.80 1axd h GLN 204 Ca -0.00 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.42 1axd h GLN 204 Cb 1.01 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.81 1axd h GLN 204 CO 0.05 0.50 -1.25 -0.22 -0.67 0.00 0.00 178.83 177.24 1axd h LYS 205 N 0.00 0.45 -0.12 1.46 1.63 -0.50 -2.70 116.57 116.80 1axd h LYS 205 Ca -0.01 -0.67 -0.19 0.00 -0.85 0.00 0.00 60.65 58.94 1axd h LYS 205 Cb 1.15 0.23 -0.00 0.00 -0.60 0.00 0.00 32.23 33.01 1axd h LYS 205 CO 0.07 1.30 -0.70 -0.39 -3.45 0.00 0.00 179.45 176.27 1axd h VAL 206 N 0.17 1.34 -0.73 2.00 -1.51 -1.46 -1.05 116.25 115.01 1axd h VAL 206 Ca -0.17 -2.02 -0.01 0.00 -1.23 0.00 0.00 66.70 63.26 1axd h VAL 206 Cb 1.94 2.00 -0.04 0.00 -2.13 0.00 0.00 31.29 33.07 1axd h VAL 206 CO 0.22 0.62 0.40 0.00 -1.23 0.00 0.00 177.57 177.59 1axd h ALA 207 N 0.84 1.34 -0.54 5.19 0.00 -1.41 -1.29 119.26 123.40 1axd h ALA 207 Ca -0.03 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1axd h ALA 207 Cb 1.29 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1axd h ALA 207 CO 0.13 0.55 -0.01 0.00 0.00 0.00 0.00 179.25 179.92 1axd h ALA 208 N 1.43 0.73 -0.17 0.00 0.00 -1.12 -2.44 119.26 117.69 1axd h ALA 208 Ca 0.26 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1axd h ALA 208 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1axd h ALA 208 CO -0.04 0.56 0.30 -0.07 0.00 0.00 0.00 179.25 180.00 1axd h LEU 209 N 0.84 0.00 -1.76 0.00 3.38 0.01 -3.51 115.31 114.26 1axd h LEU 209 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1axd h LEU 209 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1axd h LEU 209 CO 0.03 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.79