#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmp n SER 3 N 0.00 3.94 -0.02 4.39 7.64 -1.26 -4.74 113.62 123.57 1xmp n SER 3 Ca 0.00 1.14 0.04 0.00 1.01 0.00 0.00 58.87 61.06 1xmp n SER 3 Cb 0.00 -1.60 -0.12 0.00 -1.01 0.00 0.00 64.21 61.48 1xmp n SER 3 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1xmp n LEU 4 N 2.40 0.00 -4.16 -3.43 4.77 -0.55 -4.04 117.00 111.99 1xmp n LEU 4 Ca 0.09 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.81 1xmp n LEU 4 Cb 0.37 0.08 -0.16 0.00 -2.33 0.00 0.00 43.42 41.38 1xmp n LEU 4 CO 0.64 0.08 -0.51 -0.69 -1.33 0.00 0.00 177.39 175.58 1xmp s VAL 5 N -2.94 1.49 -0.19 4.08 1.01 -1.17 -0.11 120.40 122.58 1xmp s VAL 5 Ca -0.06 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.10 1xmp s VAL 5 Cb 0.09 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 1xmp s VAL 5 CO 0.65 0.43 0.02 -0.83 0.00 0.00 0.00 175.10 175.37 1xmp s GLY 6 N -0.09 1.78 -0.26 4.51 0.00 -0.73 -1.74 107.32 110.78 1xmp s GLY 6 Ca -0.01 -0.91 -0.05 0.00 0.00 0.00 0.00 44.72 43.75 1xmp s GLY 6 CO 0.02 0.17 0.02 0.14 0.00 0.00 0.00 173.10 173.45 1xmp s VAL 7 N 0.79 3.67 0.15 1.40 1.01 0.38 -0.34 120.40 127.47 1xmp s VAL 7 Ca 0.01 -0.63 0.05 0.00 0.00 0.00 0.00 61.98 61.42 1xmp s VAL 7 Cb -0.14 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 1xmp s VAL 7 CO 0.02 0.22 -0.12 0.27 0.00 0.00 0.00 175.10 175.50 1xmp s ILE 8 N 1.48 1.27 0.00 2.22 -4.36 0.06 -0.88 121.20 121.00 1xmp s ILE 8 Ca 0.04 -1.98 -0.29 0.00 -0.26 0.00 0.00 60.65 58.16 1xmp s ILE 8 Cb -0.16 -1.77 0.07 0.00 1.25 0.00 0.00 42.46 41.84 1xmp s ILE 8 CO -0.00 -0.64 0.66 0.00 0.24 0.00 0.00 174.94 175.19 1xmp s MET 9 N -3.44 1.11 0.31 0.37 0.23 -0.99 -1.46 119.30 115.43 1xmp s MET 9 Ca 0.15 0.07 0.13 0.00 -1.03 0.00 0.00 55.69 55.01 1xmp s MET 9 Cb 0.00 0.52 0.46 0.00 -1.53 0.00 0.00 34.83 34.28 1xmp s MET 9 CO 0.02 -0.39 1.65 0.78 -2.03 0.00 0.00 175.02 175.05 1xmp h GLY 10 N 2.75 0.00 -3.73 3.16 0.00 -1.59 0.74 103.07 104.40 1xmp h GLY 10 Ca -0.29 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.93 1xmp h GLY 10 CO 0.39 0.00 -0.47 -1.35 0.00 0.00 0.00 176.54 175.11 1xmp s SER 11 N -6.71 0.16 0.49 0.19 1.04 -1.26 -4.21 113.70 103.40 1xmp s SER 11 Ca -0.01 -0.56 0.17 0.00 0.48 0.00 0.00 55.95 56.03 1xmp s SER 11 Cb 0.12 0.27 1.19 0.00 0.10 0.00 0.00 66.02 67.69 1xmp s SER 11 CO 0.74 -0.58 2.08 0.71 0.98 0.00 0.00 173.24 177.17 1xmp h THR 12 N 3.36 1.01 0.00 2.02 1.35 -2.00 -1.25 112.91 117.40 1xmp h THR 12 Ca -0.33 -0.32 -0.00 0.00 -0.55 0.00 0.00 66.41 65.21 1xmp h THR 12 Cb 1.19 1.17 -0.00 0.00 -1.73 0.00 0.00 68.15 68.78 1xmp h THR 12 CO 0.53 0.09 -0.01 0.77 -0.25 0.00 0.00 175.52 176.65 1xmp h SER 13 N 0.00 0.00 1.11 5.36 4.64 -2.00 -1.22 113.55 121.45 1xmp h SER 13 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1xmp h SER 13 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1xmp h SER 13 CO 0.01 0.01 0.00 0.44 -0.87 0.00 0.00 176.83 176.42 1xmp h ASP 14 N 0.00 0.00 -0.71 4.97 3.32 -1.64 -3.17 116.42 119.19 1xmp h ASP 14 Ca -0.00 0.00 0.16 0.00 0.02 0.00 0.00 57.03 57.21 1xmp h ASP 14 Cb 0.02 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.53 1xmp h ASP 14 CO 0.00 0.00 0.49 -0.25 -1.72 0.00 0.00 179.24 177.76 1xmp h TRP 15 N 0.00 0.32 -0.15 4.55 -0.00 -1.31 0.77 115.95 120.13 1xmp h TRP 15 Ca 0.00 0.01 0.04 0.00 -0.00 0.00 0.00 58.89 58.94 1xmp h TRP 15 Cb 0.56 -0.10 -0.01 0.00 -0.00 0.00 0.00 29.16 29.61 1xmp h TRP 15 CO 0.00 0.12 0.11 1.49 -0.00 0.00 0.00 178.44 180.16 1xmp h GLU 16 N 0.27 0.00 0.13 2.65 4.81 -1.74 -0.62 114.58 120.09 1xmp h GLU 16 Ca 0.35 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.27 1xmp h GLU 16 Cb 0.98 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.36 1xmp h GLU 16 CO -0.08 0.00 -1.58 1.15 -0.73 0.00 0.00 179.01 177.77 1xmp h THR 17 N 0.00 0.95 0.00 0.32 2.02 -1.14 -3.40 112.91 111.66 1xmp h THR 17 Ca 0.07 -2.42 0.00 0.00 0.77 0.00 0.00 66.41 64.84 1xmp h THR 17 Cb 0.29 2.69 0.00 0.00 -1.74 0.00 0.00 68.15 69.39 1xmp h THR 17 CO -0.00 0.76 0.00 0.23 0.37 0.00 0.00 175.52 176.88 1xmp n MET 18 N -3.79 0.22 -0.27 6.66 2.81 -0.52 -3.34 117.12 118.88 1xmp n MET 18 Ca -0.26 0.22 0.09 0.00 -1.81 0.00 0.00 57.70 55.93 1xmp n MET 18 Cb 0.96 -1.77 0.23 0.00 -0.71 0.00 0.00 33.22 31.93 1xmp n MET 18 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1xmp h LYS 19 N 0.00 0.32 -0.41 0.03 1.57 -1.35 -2.94 116.57 113.78 1xmp h LYS 19 Ca 0.00 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1xmp h LYS 19 Cb 0.66 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 1xmp h LYS 19 CO 0.00 0.21 0.25 1.88 -0.57 0.00 0.00 179.45 181.22 1xmp h TYR 20 N 0.33 0.47 -0.58 -1.35 -1.99 -1.85 0.27 116.97 112.27 1xmp h TYR 20 Ca 0.48 0.01 0.09 0.00 2.00 0.00 0.00 58.73 61.31 1xmp h TYR 20 Cb 0.85 -0.15 -0.07 0.00 2.00 0.00 0.00 36.73 39.36 1xmp h TYR 20 CO -0.21 0.27 0.19 0.00 -0.00 0.00 0.00 178.16 178.41 1xmp h ALA 21 N 1.18 0.72 -0.45 3.88 0.00 -1.40 -2.00 119.26 121.20 1xmp h ALA 21 Ca 0.16 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 1xmp h ALA 21 Cb -0.00 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1xmp h ALA 21 CO -0.07 -0.23 -0.20 0.00 0.00 0.00 0.00 179.25 178.75 1xmp h ASP 23 N 0.78 0.78 -0.48 0.00 3.32 -0.50 -0.83 116.42 119.49 1xmp h ASP 23 Ca 0.11 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 1xmp h ASP 23 Cb 0.74 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 1xmp h ASP 23 CO 0.06 0.56 0.08 0.40 -1.72 0.00 0.00 179.24 178.62 1xmp h ILE 24 N 0.92 1.25 -0.68 0.35 1.08 -0.84 -1.00 117.51 118.58 1xmp h ILE 24 Ca 0.26 -0.91 -0.08 0.00 -0.39 0.00 0.00 64.86 63.74 1xmp h ILE 24 Cb -0.07 0.91 -0.03 0.00 -3.07 0.00 0.00 36.82 34.56 1xmp h ILE 24 CO -0.06 0.32 0.10 -0.07 -0.69 0.00 0.00 178.15 177.75 1xmp h LEU 25 N 0.66 1.08 -0.46 1.44 3.38 -0.82 -1.46 115.31 119.14 1xmp h LEU 25 Ca 0.15 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1xmp h LEU 25 Cb 0.38 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1xmp h LEU 25 CO 0.01 1.07 0.20 0.44 0.09 0.00 0.00 178.44 180.25 1xmp h ASP 26 N 1.05 0.62 -0.97 -0.43 3.32 -1.02 -0.58 116.42 118.40 1xmp h ASP 26 Ca 0.20 -0.15 0.12 0.00 0.02 0.00 0.00 57.03 57.22 1xmp h ASP 26 Cb 0.45 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 39.77 1xmp h ASP 26 CO 0.01 0.60 0.62 -0.08 -1.72 0.00 0.00 179.24 178.67 1xmp h GLU 27 N 0.59 0.90 -0.49 3.56 4.81 -0.75 -1.23 114.58 121.97 1xmp h GLU 27 Ca 0.15 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1xmp h GLU 27 Cb 0.16 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1xmp h GLU 27 CO -0.02 0.59 0.00 1.28 -0.73 0.00 0.00 179.01 180.14 1xmp n LEU 28 N -4.60 2.77 -3.58 1.64 4.77 -0.59 -4.94 117.00 112.47 1xmp n LEU 28 Ca 0.18 -1.36 -0.26 0.00 -0.03 0.00 0.00 56.01 54.54 1xmp n LEU 28 Cb 0.37 -0.33 0.03 0.00 -2.33 0.00 0.00 43.42 41.17 1xmp n LEU 28 CO 0.28 0.68 0.07 0.59 -1.33 0.00 0.00 177.39 177.68 1xmp n ASN 29 N 1.01 -5.06 -4.60 -1.43 3.02 -0.46 -4.96 115.26 102.78 1xmp n ASN 29 Ca 0.18 -0.57 -0.38 0.00 -0.03 0.00 0.00 54.58 53.77 1xmp n ASN 29 Cb 0.44 -4.06 -0.10 0.00 -0.61 0.00 0.00 39.78 35.45 1xmp n ASN 29 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xmp s ILE 30 N -3.20 5.25 0.27 2.41 1.01 -0.31 -5.03 121.20 121.59 1xmp s ILE 30 Ca 0.53 0.36 -0.29 0.00 0.00 0.00 0.00 60.65 61.24 1xmp s ILE 30 Cb -0.26 -3.61 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 1xmp s ILE 30 CO 0.65 0.21 1.25 -2.16 0.00 0.00 0.00 174.94 174.90 1xmp s PRO 31 N 1.88 4.44 0.17 2.79 0.04 -1.26 -4.50 135.00 138.56 1xmp s PRO 31 Ca 0.11 2.05 -0.10 0.00 0.04 0.00 0.00 61.00 63.10 1xmp s PRO 31 Cb -0.16 -3.15 -0.01 0.00 0.04 0.00 0.00 34.50 31.23 1xmp s PRO 31 CO 0.10 -0.11 0.31 1.52 0.04 0.00 0.00 177.00 178.86 1xmp s TYR 32 N -0.65 0.36 0.15 0.56 1.13 -1.26 -1.48 117.35 116.15 1xmp s TYR 32 Ca 0.51 -0.72 0.10 0.00 -1.41 0.00 0.00 57.07 55.55 1xmp s TYR 32 Cb -0.36 -0.01 -0.04 0.00 -1.10 0.00 0.00 41.96 40.44 1xmp s TYR 32 CO 0.44 -0.74 -0.24 -1.83 -2.51 0.00 0.00 175.55 170.67 1xmp s GLU 33 N -3.96 1.37 -0.05 -3.49 -1.05 -0.71 -4.87 118.70 105.94 1xmp s GLU 33 Ca 0.17 -1.37 0.02 0.00 -0.15 0.00 0.00 54.97 53.63 1xmp s GLU 33 Cb 0.03 -1.73 0.02 0.00 -0.44 0.00 0.00 34.13 32.01 1xmp s GLU 33 CO 0.00 0.39 -0.08 -1.59 0.95 0.00 0.00 175.26 174.93 1xmp s LYS 34 N -2.29 1.18 0.03 -4.83 -2.85 -1.26 -0.47 119.74 109.26 1xmp s LYS 34 Ca 0.15 -0.24 -0.09 0.00 -1.00 0.00 0.00 55.97 54.78 1xmp s LYS 34 Cb -0.09 -1.06 0.00 0.00 -2.06 0.00 0.00 37.83 34.63 1xmp s LYS 34 CO 0.07 -0.02 0.19 0.15 0.10 0.00 0.00 175.35 175.84 1xmp s LYS 35 N 0.74 0.66 -0.19 1.78 1.02 -0.06 -4.98 119.74 118.70 1xmp s LYS 35 Ca -0.12 -0.57 -0.22 0.00 0.02 0.00 0.00 55.97 55.07 1xmp s LYS 35 Cb -0.15 0.27 -0.02 0.00 -0.52 0.00 0.00 37.83 37.42 1xmp s LYS 35 CO 0.02 -0.19 0.71 0.08 -0.92 0.00 0.00 175.35 175.05 1xmp s VAL 36 N -2.32 4.96 -0.18 3.17 1.01 -1.26 -2.33 120.40 123.45 1xmp s VAL 36 Ca -0.07 1.35 -0.04 0.00 0.00 0.00 0.00 61.98 63.21 1xmp s VAL 36 Cb -0.02 -4.02 0.08 0.00 0.00 0.00 0.00 36.38 32.42 1xmp s VAL 36 CO -0.03 0.07 0.16 -0.69 0.00 0.00 0.00 175.10 174.61 1xmp s VAL 37 N 2.08 -0.21 -0.22 2.92 1.01 0.25 -4.91 120.40 121.32 1xmp s VAL 37 Ca 0.32 -0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.11 1xmp s VAL 37 Cb -0.16 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 1xmp s VAL 37 CO 0.11 -0.22 0.08 -0.55 0.00 0.00 0.00 175.10 174.52 1xmp s SER 38 N 2.24 5.46 0.32 3.32 0.15 -1.26 -3.53 113.70 120.40 1xmp s SER 38 Ca 0.05 -0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.65 1xmp s SER 38 Cb -0.16 -1.97 0.52 0.00 -1.71 0.00 0.00 66.02 62.71 1xmp s SER 38 CO -0.10 0.06 1.90 0.00 1.20 0.00 0.00 173.24 176.30 1xmp h ALA 39 N 7.58 1.37 0.00 5.45 0.00 -1.89 -0.60 119.26 131.16 1xmp h ALA 39 Ca -0.37 -0.14 -0.31 0.00 0.00 0.00 0.00 54.91 54.09 1xmp h ALA 39 Cb 1.17 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1xmp h ALA 39 CO 0.63 0.48 -2.31 0.72 0.00 0.00 0.00 179.25 178.76 1xmp n HIS 40 N -4.34 0.00 -0.02 0.00 8.25 -1.26 -3.69 115.22 114.16 1xmp n HIS 40 Ca 0.04 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.59 1xmp n HIS 40 Cb 0.16 -0.91 -0.15 0.00 1.12 0.00 0.00 29.99 30.20 1xmp n HIS 40 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1xmp n ARG 41 N -2.67 0.63 -2.93 -0.41 1.74 -1.24 -4.60 116.66 107.18 1xmp n ARG 41 Ca -0.29 -0.17 -0.17 0.00 -0.77 0.00 0.00 57.85 56.46 1xmp n ARG 41 Cb 1.07 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 31.03 1xmp n ARG 41 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1xmp n THR 42 N -2.23 0.85 -0.19 0.55 -2.24 -0.24 -4.99 114.28 105.78 1xmp n THR 42 Ca -0.06 -4.27 -0.04 0.00 -2.27 0.00 0.00 64.05 57.41 1xmp n THR 42 Cb 0.57 -0.21 0.05 0.00 -2.10 0.00 0.00 70.33 68.64 1xmp n THR 42 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1xmp h PRO 43 N 2.96 0.59 -0.34 -0.78 0.13 -1.61 -0.83 132.00 132.13 1xmp h PRO 43 Ca 0.06 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1xmp h PRO 43 Cb 0.97 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.95 1xmp h PRO 43 CO 0.57 0.39 0.22 -0.44 -0.23 0.00 0.00 178.00 178.51 1xmp h ASP 44 N 0.61 0.39 -0.99 1.44 3.32 -1.90 -1.48 116.42 117.82 1xmp h ASP 44 Ca 0.23 -0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.29 1xmp h ASP 44 Cb 0.08 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.47 1xmp h ASP 44 CO -0.13 0.29 0.65 0.22 -1.72 0.00 0.00 179.24 178.55 1xmp h TYR 45 N 0.45 1.21 -0.21 4.55 3.20 -1.87 -1.19 116.97 123.11 1xmp h TYR 45 Ca 0.12 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.03 1xmp h TYR 45 Cb -0.04 -0.41 -0.01 0.00 1.54 0.00 0.00 36.73 37.81 1xmp h TYR 45 CO -0.05 0.71 0.12 1.98 -1.64 0.00 0.00 178.16 179.28 1xmp h MET 46 N 1.26 0.24 -0.60 1.82 4.05 -0.56 0.12 114.93 121.27 1xmp h MET 46 Ca 0.39 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.82 1xmp h MET 46 Cb -0.03 -0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 30.68 1xmp h MET 46 CO -0.12 0.16 0.37 0.74 0.23 0.00 0.00 176.91 178.29 1xmp h PHE 47 N 0.25 0.70 -0.31 1.39 -1.00 -0.93 -1.23 116.94 115.82 1xmp h PHE 47 Ca 0.08 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.88 1xmp h PHE 47 Cb 0.00 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.32 1xmp h PHE 47 CO -0.08 0.40 0.19 1.49 -1.61 0.00 0.00 178.31 178.71 1xmp h GLU 48 N 0.74 0.41 0.02 1.51 4.57 -0.83 0.63 114.58 121.64 1xmp h GLU 48 Ca 0.24 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.41 1xmp h GLU 48 Cb 0.00 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 1xmp h GLU 48 CO -0.09 0.30 -0.19 -0.92 -1.18 0.00 0.00 179.01 176.93 1xmp h TYR 49 N 0.41 -0.49 -0.10 0.92 5.03 -0.49 -2.08 116.97 120.17 1xmp h TYR 49 Ca 0.11 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.43 1xmp h TYR 49 Cb -0.01 0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.48 1xmp h TYR 49 CO -0.05 -0.27 0.05 0.00 -1.32 0.00 0.00 178.16 176.57 1xmp h ALA 50 N 0.57 0.13 -0.92 1.82 0.00 -1.12 -2.38 119.26 117.36 1xmp h ALA 50 Ca 0.05 -0.08 0.14 0.00 0.00 0.00 0.00 54.91 55.02 1xmp h ALA 50 Cb 0.38 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.04 1xmp h ALA 50 CO -0.16 -0.30 0.53 0.93 0.00 0.00 0.00 179.25 180.25 1xmp h GLU 51 N 0.03 0.76 -0.01 0.00 5.08 -0.77 -2.72 114.58 116.95 1xmp h GLU 51 Ca 0.03 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1xmp h GLU 51 Cb 0.13 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1xmp h GLU 51 CO -0.00 0.50 -0.45 0.25 -1.00 0.00 0.00 179.01 178.31 1xmp n THR 52 N -4.76 0.00 -0.17 1.13 -2.24 -0.79 -4.45 114.28 102.99 1xmp n THR 52 Ca 0.18 -0.15 -0.02 0.00 -2.27 0.00 0.00 64.05 61.79 1xmp n THR 52 Cb 0.42 0.77 0.04 0.00 -2.10 0.00 0.00 70.33 69.46 1xmp n THR 52 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xmp h ALA 53 N 3.61 0.36 0.18 6.98 0.00 -1.09 -1.10 119.26 128.20 1xmp h ALA 53 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1xmp h ALA 53 Cb 0.60 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1xmp h ALA 53 CO 0.00 -0.43 -0.09 -0.09 0.00 0.00 0.00 179.25 178.64 1xmp h ARG 54 N 0.01 -0.23 -0.97 0.00 2.43 -1.79 -2.10 114.38 111.73 1xmp h ARG 54 Ca 0.26 0.02 0.17 0.00 -0.81 0.00 0.00 59.98 59.62 1xmp h ARG 54 Cb 0.40 0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 29.91 1xmp h ARG 54 CO -0.55 0.02 0.61 0.93 -1.51 0.00 0.00 179.97 179.47 1xmp h GLU 55 N -0.46 0.71 0.00 0.20 5.08 -1.79 -1.23 114.58 117.09 1xmp h GLU 55 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xmp h GLU 55 Cb 0.35 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1xmp h GLU 55 CO 0.04 0.47 0.00 0.54 -1.00 0.00 0.00 179.01 179.06 1xmp n ARG 56 N -4.66 0.19 0.00 2.33 1.74 -0.44 -4.91 116.66 110.91 1xmp n ARG 56 Ca 0.21 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 1xmp n ARG 56 Cb 0.54 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.48 1xmp n ARG 56 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xmp n GLY 57 N 0.97 0.51 3.77 -0.13 0.00 -0.47 -4.88 105.19 104.97 1xmp n GLY 57 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1xmp n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xmp s LEU 58 N 0.00 3.76 -0.04 0.99 1.43 -0.82 -4.59 118.68 119.40 1xmp s LEU 58 Ca 0.00 2.20 0.05 0.00 -1.03 0.00 0.00 54.13 55.35 1xmp s LEU 58 Cb 0.00 -4.56 -0.07 0.00 0.03 0.00 0.00 46.19 41.59 1xmp s LEU 58 CO 0.00 -1.23 0.04 0.29 0.23 0.00 0.00 176.35 175.68 1xmp n LYS 59 N -1.27 2.61 -3.87 1.70 4.76 0.84 -4.50 118.16 118.43 1xmp n LYS 59 Ca 0.11 -0.01 -0.11 0.00 -2.87 0.00 0.00 58.31 55.43 1xmp n LYS 59 Cb 0.51 -1.14 -0.12 0.00 -1.84 0.00 0.00 35.03 32.44 1xmp n LYS 59 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1xmp s VAL 60 N -2.18 0.04 -0.10 -0.18 1.01 -1.10 -4.17 120.40 113.73 1xmp s VAL 60 Ca -0.03 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.64 1xmp s VAL 60 Cb 0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 36.38 36.15 1xmp s VAL 60 CO 0.22 -0.18 -0.14 -0.63 0.00 0.00 0.00 175.10 174.37 1xmp s ILE 61 N -0.57 2.99 -0.18 2.22 1.01 -0.74 -1.78 121.20 124.16 1xmp s ILE 61 Ca -0.06 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 59.84 1xmp s ILE 61 Cb -0.04 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.19 1xmp s ILE 61 CO 0.00 0.55 -0.03 -0.63 0.00 0.00 0.00 174.94 174.83 1xmp s ILE 62 N -0.04 3.79 -0.05 2.92 1.01 0.54 -0.77 121.20 128.61 1xmp s ILE 62 Ca -0.03 -0.38 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1xmp s ILE 62 Cb -0.14 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.65 1xmp s ILE 62 CO 0.04 0.46 -0.09 0.00 0.00 0.00 0.00 174.94 175.35 1xmp s ALA 63 N 0.78 0.95 0.02 9.38 0.00 0.62 -0.76 121.76 132.75 1xmp s ALA 63 Ca -0.01 -0.25 0.08 0.00 0.00 0.00 0.00 51.96 51.78 1xmp s ALA 63 Cb -0.14 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 1xmp s ALA 63 CO 0.02 0.07 -0.22 0.20 0.00 0.00 0.00 175.76 175.84 1xmp s GLY 64 N 0.67 1.47 -0.04 0.00 0.00 -0.54 -0.97 107.32 107.91 1xmp s GLY 64 Ca -0.11 -1.19 -0.29 0.00 0.00 0.00 0.00 44.72 43.13 1xmp s GLY 64 CO 0.02 -1.05 0.88 0.00 0.00 0.00 0.00 173.10 172.95 1xmp s ALA 65 N -0.82 -1.84 0.25 3.20 0.00 -1.00 -3.29 121.76 118.27 1xmp s ALA 65 Ca 0.13 1.17 0.06 0.00 0.00 0.00 0.00 51.96 53.32 1xmp s ALA 65 Cb -0.10 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.05 1xmp s ALA 65 CO 0.03 -0.56 -0.06 0.20 0.00 0.00 0.00 175.76 175.37 1xmp s GLY 66 N -1.99 1.65 0.00 0.00 0.00 -1.26 -1.12 107.32 104.60 1xmp s GLY 66 Ca 0.01 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.93 1xmp s GLY 66 CO -0.04 -1.77 0.00 0.61 0.00 0.00 0.00 173.10 171.89 1xmp n GLY 67 N -0.49 2.02 3.57 0.20 0.00 -1.26 -3.83 105.19 105.41 1xmp n GLY 67 Ca -0.06 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.14 1xmp n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xmp s ALA 68 N -1.86 2.87 -0.99 4.61 0.00 -1.26 -2.54 121.76 122.58 1xmp s ALA 68 Ca 0.00 -2.55 -0.16 0.00 0.00 0.00 0.00 51.96 49.25 1xmp s ALA 68 Cb 0.00 -4.61 0.16 0.00 0.00 0.00 0.00 23.12 18.67 1xmp s ALA 68 CO 0.00 -3.69 1.15 0.00 0.00 0.00 0.00 175.76 173.22 1xmp s ALA 69 N 5.52 3.70 -0.43 0.00 0.00 -1.25 -4.80 121.76 124.51 1xmp s ALA 69 Ca 0.54 -3.05 0.22 0.00 0.00 0.00 0.00 51.96 49.67 1xmp s ALA 69 Cb 0.02 -3.97 -0.07 0.00 0.00 0.00 0.00 23.12 19.10 1xmp s ALA 69 CO 0.02 -2.79 0.89 0.72 0.00 0.00 0.00 175.76 174.61 1xmp n HIS 70 N 5.75 0.32 -0.01 0.00 8.25 -1.26 -4.11 115.22 124.16 1xmp n HIS 70 Ca 0.26 0.09 -0.09 0.00 -0.26 0.00 0.00 57.72 57.72 1xmp n HIS 70 Cb 0.47 -0.53 -0.04 0.00 1.12 0.00 0.00 29.99 31.01 1xmp n HIS 70 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1xmp h LEU 71 N 0.00 -0.23 -0.52 2.41 5.85 -1.93 -1.03 115.31 119.87 1xmp h LEU 71 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1xmp h LEU 71 Cb 0.83 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 1xmp h LEU 71 CO 0.00 -0.10 0.34 -0.65 -0.34 0.00 0.00 178.44 177.69 1xmp h PRO 72 N -0.06 0.68 -0.23 5.25 0.11 -1.84 -1.82 132.00 134.09 1xmp h PRO 72 Ca 0.07 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.01 1xmp h PRO 72 Cb 0.17 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.12 1xmp h PRO 72 CO -0.17 0.46 -0.41 0.78 -0.21 0.00 0.00 178.00 178.45 1xmp h GLY 73 N 0.70 0.60 1.60 -0.55 0.00 -1.78 0.28 103.07 103.91 1xmp h GLY 73 Ca 0.19 -0.60 -0.21 0.00 0.00 0.00 0.00 47.33 46.71 1xmp h GLY 73 CO -0.04 0.54 -0.89 -0.33 0.00 0.00 0.00 176.54 175.82 1xmp h MET 74 N 0.45 0.37 -0.39 4.80 2.86 -1.11 -0.27 114.93 121.63 1xmp h MET 74 Ca 0.04 -0.38 -0.05 0.00 -2.06 0.00 0.00 59.70 57.25 1xmp h MET 74 Cb 0.91 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 1xmp h MET 74 CO 0.08 1.05 0.04 0.28 1.06 0.00 0.00 176.91 179.42 1xmp h VAL 75 N 0.21 1.25 -0.16 -2.22 2.07 -1.19 -3.02 116.25 113.18 1xmp h VAL 75 Ca -0.06 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1xmp h VAL 75 Cb 1.52 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1xmp h VAL 75 CO 0.15 0.31 0.01 0.00 0.02 0.00 0.00 177.57 178.06 1xmp h ALA 76 N 0.91 1.71 0.00 1.67 0.00 -0.78 -0.69 119.26 122.07 1xmp h ALA 76 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xmp h ALA 76 Cb 0.41 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1xmp h ALA 76 CO 0.01 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.49 1xmp h ALA 77 N 1.78 1.00 -0.02 0.00 0.00 -0.92 -3.26 119.26 117.85 1xmp h ALA 77 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xmp h ALA 77 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1xmp h ALA 77 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.88 1xmp n LYS 78 N -2.65 -0.05 -3.77 0.00 4.76 -0.30 -5.01 118.16 111.14 1xmp n LYS 78 Ca -0.00 -0.87 -0.13 0.00 -2.87 0.00 0.00 58.31 54.44 1xmp n LYS 78 Cb 0.17 -1.10 -0.09 0.00 -1.84 0.00 0.00 35.03 32.17 1xmp n LYS 78 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1xmp s THR 79 N -0.46 0.06 -1.50 -0.18 -1.32 -1.01 -3.94 115.64 107.29 1xmp s THR 79 Ca 0.06 -0.52 0.19 0.00 -1.21 0.00 0.00 61.69 60.21 1xmp s THR 79 Cb 0.04 -0.65 0.61 0.00 -1.51 0.00 0.00 72.50 70.99 1xmp s THR 79 CO 0.06 -0.29 1.52 0.59 -2.21 0.00 0.00 174.62 174.29 1xmp n ASN 80 N 1.18 4.04 -4.60 8.08 4.13 -1.26 -4.71 115.26 122.12 1xmp n ASN 80 Ca -0.21 -2.16 -0.42 0.00 1.68 0.00 0.00 54.58 53.46 1xmp n ASN 80 Cb 0.56 -0.48 0.00 0.00 -1.54 0.00 0.00 39.78 38.33 1xmp n ASN 80 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1xmp n LEU 81 N 1.25 2.26 -4.73 3.41 4.32 -1.26 -4.96 117.00 117.28 1xmp n LEU 81 Ca 0.23 1.06 -0.42 0.00 -0.02 0.00 0.00 56.01 56.86 1xmp n LEU 81 Cb 0.68 -1.32 -0.02 0.00 -1.62 0.00 0.00 43.42 41.13 1xmp n LEU 81 CO 0.17 -1.55 1.29 -2.65 -1.22 0.00 0.00 177.39 173.44 1xmp n PRO 82 N 0.32 2.70 -4.17 3.23 -0.02 -1.26 -4.88 135.00 130.92 1xmp n PRO 82 Ca 0.09 0.97 -0.34 0.00 -2.02 0.00 0.00 63.50 62.20 1xmp n PRO 82 Cb 0.38 -2.78 -0.15 0.00 -0.02 0.00 0.00 33.50 30.93 1xmp n PRO 82 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xmp s VAL 83 N 0.52 2.84 -0.25 -1.45 1.01 -1.26 -1.79 120.40 120.02 1xmp s VAL 83 Ca 0.69 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.89 1xmp s VAL 83 Cb -0.51 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1xmp s VAL 83 CO 0.41 0.48 0.13 -0.63 0.00 0.00 0.00 175.10 175.50 1xmp s ILE 84 N 1.19 4.98 -0.23 2.22 1.01 0.05 -0.65 121.20 129.77 1xmp s ILE 84 Ca 0.02 0.05 -0.08 0.00 0.00 0.00 0.00 60.65 60.64 1xmp s ILE 84 Cb -0.14 -3.33 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1xmp s ILE 84 CO -0.04 0.32 0.09 -0.83 0.00 0.00 0.00 174.94 174.47 1xmp s GLY 85 N 1.41 1.86 -0.33 6.18 0.00 0.01 -0.28 107.32 116.17 1xmp s GLY 85 Ca 0.06 -0.96 -0.09 0.00 0.00 0.00 0.00 44.72 43.73 1xmp s GLY 85 CO 0.06 0.35 0.15 0.14 0.00 0.00 0.00 173.10 173.81 1xmp s VAL 86 N 1.11 4.47 -0.23 1.40 1.01 -0.14 -2.14 120.40 125.87 1xmp s VAL 86 Ca 0.05 -0.61 -0.29 0.00 0.00 0.00 0.00 61.98 61.12 1xmp s VAL 86 Cb -0.14 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 1xmp s VAL 86 CO 0.04 -0.03 1.35 -2.84 0.00 0.00 0.00 175.10 173.62 1xmp s PRO 87 N 1.57 4.02 0.17 2.72 0.02 -1.26 -2.36 135.00 139.88 1xmp s PRO 87 Ca 0.03 1.50 -0.30 0.00 0.02 0.00 0.00 61.00 62.26 1xmp s PRO 87 Cb -0.18 -3.87 -0.07 0.00 0.02 0.00 0.00 34.50 30.40 1xmp s PRO 87 CO 0.06 -0.99 1.01 0.08 -0.33 0.00 0.00 177.00 176.83 1xmp s VAL 88 N 4.17 4.17 -0.24 3.83 1.01 -0.28 -0.97 120.40 132.09 1xmp s VAL 88 Ca 0.59 1.91 -0.29 0.00 0.00 0.00 0.00 61.98 64.19 1xmp s VAL 88 Cb -0.20 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 1xmp s VAL 88 CO 0.21 0.35 1.73 -1.58 0.00 0.00 0.00 175.10 175.81 1xmp s GLN 89 N -0.42 3.62 0.60 2.72 0.74 -1.26 -4.36 119.66 121.29 1xmp s GLN 89 Ca 0.46 1.65 -0.07 0.00 0.05 0.00 0.00 55.36 57.45 1xmp s GLN 89 Cb -0.26 -4.12 0.00 0.00 1.10 0.00 0.00 33.01 29.74 1xmp s GLN 89 CO 0.32 -1.51 0.93 -1.54 -0.55 0.00 0.00 175.29 172.94 1xmp s SER 90 N 5.09 5.68 -0.03 6.67 1.04 -1.26 -4.73 113.70 126.17 1xmp s SER 90 Ca 0.77 0.86 -0.21 0.00 0.48 0.00 0.00 55.95 57.85 1xmp s SER 90 Cb -0.25 -1.86 -0.14 0.00 0.10 0.00 0.00 66.02 63.87 1xmp s SER 90 CO 0.32 -1.05 0.92 0.50 0.98 0.00 0.00 173.24 174.91 1xmp h LYS 91 N -0.23 -0.38 -0.01 4.02 3.64 -1.97 -1.80 116.57 119.85 1xmp h LYS 91 Ca -0.45 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 58.92 1xmp h LYS 91 Cb 1.25 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 1xmp h LYS 91 CO 0.61 -0.05 -0.13 0.00 -2.27 0.00 0.00 179.45 177.62 1xmp h ALA 92 N -0.55 0.03 -0.38 5.00 0.00 -2.03 -3.36 119.26 117.97 1xmp h ALA 92 Ca -0.04 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1xmp h ALA 92 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1xmp h ALA 92 CO 0.07 -0.02 0.00 1.28 0.00 0.00 0.00 179.25 180.58 1xmp n LEU 93 N -4.62 3.17 -3.42 0.00 4.32 -1.26 -4.97 117.00 110.23 1xmp n LEU 93 Ca -0.09 -1.66 -0.25 0.00 -0.02 0.00 0.00 56.01 53.98 1xmp n LEU 93 Cb 0.43 -0.25 0.02 0.00 -1.62 0.00 0.00 43.42 41.99 1xmp n LEU 93 CO 0.37 0.73 0.02 0.59 -1.22 0.00 0.00 177.39 177.87 1xmp n ASN 94 N 1.10 -4.70 0.00 -1.43 3.02 -0.68 -1.79 115.26 110.79 1xmp n ASN 94 Ca 0.16 -0.46 0.00 0.00 -0.03 0.00 0.00 54.58 54.25 1xmp n ASN 94 Cb 0.51 -3.82 0.00 0.00 -0.61 0.00 0.00 39.78 35.86 1xmp n ASN 94 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xmp n GLY 95 N -1.42 0.81 0.20 7.41 0.00 -1.25 -4.54 105.19 106.40 1xmp n GLY 95 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1xmp n GLY 95 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xmp h LEU 96 N 0.00 0.63 -0.35 0.99 5.85 -1.70 0.21 115.31 120.93 1xmp h LEU 96 Ca 0.00 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.47 1xmp h LEU 96 Cb 0.00 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1xmp h LEU 96 CO 0.00 0.75 0.17 -2.24 -0.34 0.00 0.00 178.44 176.78 1xmp h ASP 97 N 0.48 0.24 -0.28 1.25 3.04 -1.84 -2.05 116.42 117.27 1xmp h ASP 97 Ca 0.11 0.02 0.04 0.00 -3.24 0.00 0.00 57.03 53.96 1xmp h ASP 97 Cb 0.41 -0.02 -0.04 0.00 -1.04 0.00 0.00 39.33 38.63 1xmp h ASP 97 CO 0.01 0.18 0.04 0.28 -2.04 0.00 0.00 179.24 177.71 1xmp h SER 98 N 0.35 -0.03 0.11 4.15 0.02 -1.20 -1.41 113.55 115.53 1xmp h SER 98 Ca 0.15 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1xmp h SER 98 Cb 0.07 0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1xmp h SER 98 CO -0.11 0.02 -0.05 0.25 -1.14 0.00 0.00 176.83 175.79 1xmp h LEU 99 N 0.13 -0.13 -0.89 5.07 5.85 -0.44 -2.66 115.31 122.24 1xmp h LEU 99 Ca 0.13 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1xmp h LEU 99 Cb 0.15 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1xmp h LEU 99 CO -0.19 -0.04 -0.36 -0.07 -0.34 0.00 0.00 178.44 177.44 1xmp h LEU 100 N -0.20 0.39 -1.80 2.25 3.38 -1.26 0.15 115.31 118.21 1xmp h LEU 100 Ca -0.02 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1xmp h LEU 100 Cb 0.16 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1xmp h LEU 100 CO 0.03 0.72 -0.15 0.28 0.09 0.00 0.00 178.44 179.41 1xmp h SER 101 N 0.32 0.00 0.01 -0.43 0.02 -1.23 -2.97 113.55 109.27 1xmp h SER 101 Ca 0.04 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.58 1xmp h SER 101 Cb 0.78 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.26 1xmp h SER 101 CO 0.06 0.15 -2.28 -0.38 -1.14 0.00 0.00 176.83 173.24 1xmp n ILE 102 N -3.99 1.54 0.10 3.27 5.41 -0.91 -4.65 119.36 120.13 1xmp n ILE 102 Ca -0.02 -0.36 -0.04 0.00 1.00 0.00 0.00 62.75 63.33 1xmp n ILE 102 Cb 0.24 -1.84 0.05 0.00 -0.71 0.00 0.00 39.64 37.38 1xmp n ILE 102 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 176.55 178.17 1xmp h VAL 103 N -0.82 1.54 -0.18 1.39 3.04 -0.80 -3.33 116.25 117.09 1xmp h VAL 103 Ca -0.61 -2.60 -0.09 0.00 -1.01 0.00 0.00 66.70 62.38 1xmp h VAL 103 Cb 1.62 2.41 -0.05 0.00 -2.01 0.00 0.00 31.29 33.25 1xmp h VAL 103 CO -0.32 0.75 0.12 0.00 -1.01 0.00 0.00 177.57 177.10 1xmp n GLN 104 N -3.64 1.23 -1.81 4.17 1.13 -1.12 -4.91 117.38 112.42 1xmp n GLN 104 Ca -0.01 -0.53 -0.39 0.00 -1.94 0.00 0.00 57.00 54.13 1xmp n GLN 104 Cb 0.74 -1.21 0.03 0.00 0.11 0.00 0.00 30.24 29.92 1xmp n GLN 104 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 1xmp s MET 105 N -0.59 3.26 0.68 -1.09 -1.94 -1.25 -4.98 119.30 113.39 1xmp s MET 105 Ca 0.10 2.24 -0.11 0.00 -1.71 0.00 0.00 55.69 56.21 1xmp s MET 105 Cb 0.08 -2.33 -0.00 0.00 2.01 0.00 0.00 34.83 34.59 1xmp s MET 105 CO 0.02 -1.09 1.06 -1.25 -0.01 0.00 0.00 175.02 173.74 1xmp s PRO 106 N -2.82 3.11 0.17 2.03 0.04 -1.26 -4.93 135.00 131.34 1xmp s PRO 106 Ca 0.69 0.79 -0.34 0.00 0.04 0.00 0.00 61.00 62.18 1xmp s PRO 106 Cb -0.40 -2.02 -0.14 0.00 0.04 0.00 0.00 34.50 31.98 1xmp s PRO 106 CO 0.48 -0.93 1.58 0.41 0.04 0.00 0.00 177.00 178.58 1xmp n GLY 107 N -2.42 1.13 0.00 0.56 0.00 -1.26 -2.16 105.19 101.04 1xmp n GLY 107 Ca 0.07 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.73 1xmp n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xmp n GLY 108 N 3.39 1.05 2.44 -0.02 0.00 -1.26 -5.02 105.19 105.77 1xmp n GLY 108 Ca 0.17 -0.23 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1xmp n GLY 108 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xmp n VAL 109 N 0.00 -0.17 -2.08 1.61 0.31 -0.92 -5.05 118.33 112.03 1xmp n VAL 109 Ca 0.00 -4.03 -0.39 0.00 -0.01 0.00 0.00 64.34 59.91 1xmp n VAL 109 Cb 0.00 -1.88 0.00 0.00 -0.91 0.00 0.00 33.84 31.05 1xmp n VAL 109 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1xmp s PRO 110 N -0.81 3.77 -0.09 5.55 0.04 -1.26 -4.53 135.00 137.67 1xmp s PRO 110 Ca 0.33 2.04 0.02 0.00 0.04 0.00 0.00 61.00 63.43 1xmp s PRO 110 Cb 0.07 -2.57 0.01 0.00 0.04 0.00 0.00 34.50 32.05 1xmp s PRO 110 CO -0.15 -0.62 -0.14 0.08 0.04 0.00 0.00 177.00 176.21 1xmp s VAL 111 N -1.36 1.37 -0.64 -0.36 1.01 -1.26 -4.70 120.40 114.47 1xmp s VAL 111 Ca 0.61 -0.58 -0.27 0.00 0.00 0.00 0.00 61.98 61.74 1xmp s VAL 111 Cb -0.35 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1xmp s VAL 111 CO 0.44 0.41 1.42 0.00 0.00 0.00 0.00 175.10 177.37 1xmp s ALA 112 N 0.89 2.70 -0.11 5.51 0.00 0.18 -4.86 121.76 126.07 1xmp s ALA 112 Ca -0.09 -0.94 -0.11 0.00 0.00 0.00 0.00 51.96 50.82 1xmp s ALA 112 Cb -0.15 -4.19 -0.05 0.00 0.00 0.00 0.00 23.12 18.73 1xmp s ALA 112 CO 0.00 -3.20 0.25 0.99 0.00 0.00 0.00 175.76 173.80 1xmp s THR 113 N 6.33 5.32 0.38 0.00 2.01 -1.26 -0.81 115.64 127.62 1xmp s THR 113 Ca 0.47 0.46 0.02 0.00 0.31 0.00 0.00 61.69 62.94 1xmp s THR 113 Cb -0.10 -3.55 0.02 0.00 0.01 0.00 0.00 72.50 68.88 1xmp s THR 113 CO 0.21 0.53 0.13 1.33 -0.69 0.00 0.00 174.62 176.12 1xmp n VAL 114 N 2.50 0.00 -1.41 3.82 0.24 -0.91 -4.96 118.33 117.61 1xmp n VAL 114 Ca -0.16 -1.68 -0.34 0.00 -2.04 0.00 0.00 64.34 60.12 1xmp n VAL 114 Cb 0.53 0.14 0.09 0.00 -1.47 0.00 0.00 33.84 33.13 1xmp n VAL 114 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xmp s ALA 115 N -2.61 2.12 0.24 2.33 0.00 -1.26 -4.40 121.76 118.18 1xmp s ALA 115 Ca 0.10 0.80 -0.31 0.00 0.00 0.00 0.00 51.96 52.54 1xmp s ALA 115 Cb -0.01 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 1xmp s ALA 115 CO 0.06 -1.86 1.58 0.42 0.00 0.00 0.00 175.76 175.95 1xmp s ILE 116 N -2.11 2.30 0.00 0.00 1.01 -1.26 -3.33 121.20 117.81 1xmp s ILE 116 Ca 0.72 0.24 0.00 0.00 0.00 0.00 0.00 60.65 61.61 1xmp s ILE 116 Cb -0.27 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.05 1xmp s ILE 116 CO 0.46 0.03 0.00 0.61 0.00 0.00 0.00 174.94 176.04 1xmp n GLY 117 N 2.84 -0.85 0.31 6.18 0.00 -0.14 -4.20 105.19 109.33 1xmp n GLY 117 Ca 0.10 -1.36 -0.02 0.00 0.00 0.00 0.00 46.02 44.74 1xmp n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xmp h LYS 118 N 0.00 0.85 -0.65 1.61 1.57 -1.88 -1.49 116.57 116.58 1xmp h LYS 118 Ca 0.00 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1xmp h LYS 118 Cb 0.00 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 1xmp h LYS 118 CO 0.00 0.73 0.43 0.00 -0.57 0.00 0.00 179.45 180.04 1xmp h ALA 119 N 1.38 0.83 -0.33 3.86 0.00 -1.89 -1.37 119.26 121.74 1xmp h ALA 119 Ca 0.19 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.06 1xmp h ALA 119 Cb 0.22 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1xmp h ALA 119 CO -0.01 0.26 0.21 0.78 0.00 0.00 0.00 179.25 180.49 1xmp h GLY 120 N 0.89 0.46 0.51 0.00 0.00 -1.38 -1.90 103.07 101.65 1xmp h GLY 120 Ca 0.24 -0.17 0.04 0.00 0.00 0.00 0.00 47.33 47.44 1xmp h GLY 120 CO -0.05 0.16 -0.14 0.23 0.00 0.00 0.00 176.54 176.73 1xmp h SER 121 N 0.43 -0.44 -0.50 0.19 0.87 -0.85 0.34 113.55 113.59 1xmp h SER 121 Ca 0.12 0.08 0.10 0.00 -1.23 0.00 0.00 61.79 60.86 1xmp h SER 121 Cb -0.04 0.21 -0.09 0.00 -0.44 0.00 0.00 62.40 62.04 1xmp h SER 121 CO -0.04 -0.19 -0.07 0.74 -0.53 0.00 0.00 176.83 176.75 1xmp h THR 122 N -0.19 0.55 0.00 2.23 2.02 -1.23 -2.26 112.91 114.02 1xmp h THR 122 Ca 0.08 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 67.19 1xmp h THR 122 Cb 0.31 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1xmp h THR 122 CO -0.22 0.01 -0.29 0.78 0.37 0.00 0.00 175.52 176.17 1xmp h ASN 123 N 0.05 0.00 -0.24 4.18 -0.26 -0.43 -1.86 115.58 117.02 1xmp h ASN 123 Ca 0.25 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.98 1xmp h ASN 123 Cb 0.38 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.63 1xmp h ASN 123 CO -0.47 0.29 0.12 0.00 -1.06 0.00 0.00 177.43 176.31 1xmp h ALA 124 N 1.71 0.31 -0.48 -0.83 0.00 0.22 0.21 119.26 120.40 1xmp h ALA 124 Ca -0.00 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1xmp h ALA 124 Cb 0.75 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1xmp h ALA 124 CO 0.04 -0.13 0.30 0.78 0.00 0.00 0.00 179.25 180.24 1xmp h GLY 125 N 0.26 0.67 0.90 0.00 0.00 -1.12 0.35 103.07 104.14 1xmp h GLY 125 Ca 0.08 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1xmp h GLY 125 CO -0.01 0.21 0.10 1.41 0.00 0.00 0.00 176.54 178.25 1xmp h LEU 126 N 0.60 0.38 -0.69 3.11 3.38 -1.20 -1.73 115.31 119.16 1xmp h LEU 126 Ca 0.18 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1xmp h LEU 126 Cb -0.02 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1xmp h LEU 126 CO -0.07 0.45 0.45 0.25 0.09 0.00 0.00 178.44 179.62 1xmp h LEU 127 N 0.28 0.77 -0.60 1.67 5.85 -0.40 0.16 115.31 123.04 1xmp h LEU 127 Ca 0.09 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1xmp h LEU 127 Cb 0.20 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1xmp h LEU 127 CO -0.01 0.55 0.34 0.00 -0.34 0.00 0.00 178.44 178.98 1xmp h ALA 128 N 1.27 0.78 -0.90 1.25 0.00 -0.78 -0.94 119.26 119.95 1xmp h ALA 128 Ca 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1xmp h ALA 128 Cb -0.06 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1xmp h ALA 128 CO -0.07 0.04 0.49 0.00 0.00 0.00 0.00 179.25 179.70 1xmp h ALA 129 N 1.29 1.15 -0.55 0.00 0.00 -0.67 -1.79 119.26 118.69 1xmp h ALA 129 Ca 0.25 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1xmp h ALA 129 Cb 0.09 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1xmp h ALA 129 CO -0.14 0.67 -0.01 1.96 0.00 0.00 0.00 179.25 181.73 1xmp h GLN 130 N 1.26 0.96 0.13 0.00 4.20 -0.10 0.44 115.11 122.00 1xmp h GLN 130 Ca 0.32 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 1xmp h GLN 130 Cb 0.04 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1xmp h GLN 130 CO -0.05 0.95 -0.06 0.82 -0.67 0.00 0.00 178.83 179.82 1xmp h ILE 131 N 0.88 0.88 -0.38 2.54 2.04 -0.85 -0.46 117.51 122.16 1xmp h ILE 131 Ca 0.16 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 1xmp h ILE 131 Cb 0.53 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1xmp h ILE 131 CO 0.03 0.00 0.18 -0.07 0.00 0.00 0.00 178.15 178.29 1xmp h LEU 132 N -0.18 0.50 -0.40 1.44 3.38 -1.16 -3.06 115.31 115.84 1xmp h LEU 132 Ca -0.02 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1xmp h LEU 132 Cb 0.14 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1xmp h LEU 132 CO 0.03 0.49 0.00 0.61 0.09 0.00 0.00 178.44 179.66 1xmp n GLY 133 N -0.86 -1.10 0.24 0.83 0.00 0.15 -1.57 105.19 102.89 1xmp n GLY 133 Ca -0.00 0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1xmp n GLY 133 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xmp h SER 134 N 0.00 0.00 0.00 1.61 4.64 -0.97 -3.24 113.55 115.59 1xmp h SER 134 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1xmp h SER 134 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1xmp h SER 134 CO 0.00 0.18 -1.34 0.49 -0.87 0.00 0.00 176.83 175.28 1xmp n PHE 135 N -3.48 0.00 -3.69 4.77 3.72 -0.97 -4.96 117.46 112.85 1xmp n PHE 135 Ca -0.01 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.01 1xmp n PHE 135 Cb 0.34 -0.22 -0.11 0.00 -0.94 0.00 0.00 39.48 38.55 1xmp n PHE 135 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1xmp s HIS 136 N -2.27 3.38 0.39 1.38 3.76 -0.61 -4.99 115.29 116.34 1xmp s HIS 136 Ca -0.03 -1.76 0.07 0.00 -0.15 0.00 0.00 55.06 53.19 1xmp s HIS 136 Cb 0.03 -2.86 0.82 0.00 1.11 0.00 0.00 32.58 31.68 1xmp s HIS 136 CO 0.24 -0.86 2.01 -0.44 -0.85 0.00 0.00 174.74 174.85 1xmp h ASP 137 N 8.26 0.55 -0.65 1.40 5.19 -1.89 -2.26 116.42 127.01 1xmp h ASP 137 Ca -0.20 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.20 1xmp h ASP 137 Cb 1.07 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 40.43 1xmp h ASP 137 CO 0.70 0.37 0.39 0.44 -3.12 0.00 0.00 179.24 178.03 1xmp h ASP 138 N 0.63 0.79 -0.15 6.45 3.32 -1.94 0.30 116.42 125.82 1xmp h ASP 138 Ca 0.23 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.17 1xmp h ASP 138 Cb 0.12 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 1xmp h ASP 138 CO -0.06 0.62 -0.08 0.40 -1.72 0.00 0.00 179.24 178.40 1xmp h ILE 139 N 0.89 1.32 -0.48 0.35 2.04 -1.76 -2.05 117.51 117.82 1xmp h ILE 139 Ca 0.23 -1.13 0.07 0.00 1.00 0.00 0.00 64.86 65.04 1xmp h ILE 139 Cb -0.02 1.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.73 1xmp h ILE 139 CO -0.04 0.33 0.13 -0.74 0.00 0.00 0.00 178.15 177.83 1xmp h HIS 140 N -0.01 0.22 -0.96 1.37 2.76 -1.26 -1.28 115.15 115.99 1xmp h HIS 140 Ca 0.03 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.25 1xmp h HIS 140 Cb 0.55 -0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.44 1xmp h HIS 140 CO 0.07 0.04 0.63 -0.44 -1.30 0.00 0.00 177.93 176.93 1xmp h ASP 141 N 0.28 1.08 -0.46 3.26 3.32 -0.83 -1.11 116.42 121.96 1xmp h ASP 141 Ca 0.24 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.20 1xmp h ASP 141 Cb 0.28 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1xmp h ASP 141 CO -0.28 0.77 0.06 0.00 -1.72 0.00 0.00 179.24 178.07 1xmp h ALA 142 N 1.42 0.61 -0.58 3.45 0.00 -0.63 -1.27 119.26 122.25 1xmp h ALA 142 Ca 0.36 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.06 1xmp h ALA 142 Cb -0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1xmp h ALA 142 CO -0.09 0.35 0.35 -0.07 0.00 0.00 0.00 179.25 179.79 1xmp h LEU 143 N 0.63 0.58 -0.54 0.00 3.38 -0.74 -1.20 115.31 117.42 1xmp h LEU 143 Ca 0.14 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 1xmp h LEU 143 Cb 0.41 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1xmp h LEU 143 CO 0.01 0.40 0.08 -0.33 0.09 0.00 0.00 178.44 178.69 1xmp h GLU 144 N 0.70 0.90 -0.53 1.13 4.39 -1.03 -1.61 114.58 118.53 1xmp h GLU 144 Ca 0.23 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1xmp h GLU 144 Cb 0.02 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 1xmp h GLU 144 CO -0.10 0.88 0.30 -0.07 -1.16 0.00 0.00 179.01 178.86 1xmp h LEU 145 N 0.79 0.66 -0.41 1.33 3.38 -1.02 -0.10 115.31 119.93 1xmp h LEU 145 Ca 0.16 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1xmp h LEU 145 Cb 0.42 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1xmp h LEU 145 CO 0.01 0.55 0.21 -0.09 0.09 0.00 0.00 178.44 179.21 1xmp h ARG 146 N 0.71 0.59 -0.43 1.13 2.43 -1.06 -1.21 114.38 116.54 1xmp h ARG 146 Ca 0.19 -0.08 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 1xmp h ARG 146 Cb 0.03 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1xmp h ARG 146 CO -0.03 0.49 -0.21 -0.09 -1.51 0.00 0.00 179.97 178.62 1xmp h ARG 147 N 0.53 0.90 -0.71 0.20 2.43 -1.18 -2.36 114.38 114.19 1xmp h ARG 147 Ca 0.14 -0.39 0.05 0.00 -0.81 0.00 0.00 59.98 58.97 1xmp h ARG 147 Cb 0.09 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.56 1xmp h ARG 147 CO -0.02 1.05 0.43 1.49 -1.51 0.00 0.00 179.97 181.40 1xmp h GLU 148 N 0.73 0.78 -0.44 0.20 4.81 -0.80 -1.08 114.58 118.79 1xmp h GLU 148 Ca 0.10 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.16 1xmp h GLU 148 Cb 0.78 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1xmp h GLU 148 CO 0.06 0.52 -0.21 0.00 -0.73 0.00 0.00 179.01 178.65 1xmp h ALA 149 N 1.34 0.81 -0.25 2.92 0.00 -1.05 -1.86 119.26 121.16 1xmp h ALA 149 Ca 0.30 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1xmp h ALA 149 Cb 0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xmp h ALA 149 CO -0.15 0.65 0.12 0.82 0.00 0.00 0.00 179.25 180.69 1xmp h ILE 150 N 0.76 1.15 -0.65 0.00 2.04 -1.22 -1.65 117.51 117.94 1xmp h ILE 150 Ca 0.10 -0.44 0.09 0.00 1.00 0.00 0.00 64.86 65.61 1xmp h ILE 150 Cb 0.75 0.98 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 1xmp h ILE 150 CO 0.06 0.15 0.29 -0.08 0.00 0.00 0.00 178.15 178.57 1xmp h GLU 151 N 0.27 0.48 -0.27 2.37 4.22 -0.87 -0.33 114.58 120.45 1xmp h GLU 151 Ca 0.09 -0.03 -0.04 0.00 0.08 0.00 0.00 59.36 59.46 1xmp h GLU 151 Cb 0.13 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1xmp h GLU 151 CO -0.01 0.32 0.01 -0.22 -2.18 0.00 0.00 179.01 176.93 1xmp h LYS 152 N 0.50 0.47 0.07 1.92 3.64 -1.26 -0.35 116.57 121.56 1xmp h LYS 152 Ca 0.32 -0.15 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 1xmp h LYS 152 Cb 0.37 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.11 1xmp h LYS 152 CO -0.28 0.62 -0.24 0.22 -2.27 0.00 0.00 179.45 177.50 1xmp h ASP 153 N 0.26 -0.68 -0.16 4.20 3.58 -0.83 -0.08 116.42 122.71 1xmp h ASP 153 Ca 0.08 0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.60 1xmp h ASP 153 Cb 0.41 0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 1xmp h ASP 153 CO 0.01 -0.32 0.04 0.58 -2.88 0.00 0.00 179.24 176.68 1xmp h VAL 154 N -0.41 1.20 -0.32 2.25 2.07 -1.01 -3.17 116.25 116.86 1xmp h VAL 154 Ca 0.04 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 1xmp h VAL 154 Cb 0.46 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1xmp h VAL 154 CO -0.17 0.19 0.11 -0.09 0.02 0.00 0.00 177.57 177.63 1xmp h ARG 155 N 0.07 0.50 -0.01 1.57 2.43 -1.00 -3.51 114.38 114.42 1xmp h ARG 155 Ca 0.05 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1xmp h ARG 155 Cb 0.25 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1xmp h ARG 155 CO 0.00 0.53 0.00 0.39 -1.51 0.00 0.00 179.97 179.38