#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmp s SER -6 N 0.00 4.35 -0.08 4.04 1.04 -1.26 -5.01 113.70 116.79 1xmp s SER -6 Ca 0.00 1.96 0.19 0.00 0.48 0.00 0.00 55.95 58.57 1xmp s SER -6 Cb 0.00 -2.54 0.39 0.00 0.10 0.00 0.00 66.02 63.97 1xmp s SER -6 CO 0.00 -2.14 1.17 0.00 0.98 0.00 0.00 173.24 173.25 1xmp n HIS -5 N -3.36 0.00 0.12 5.02 1.44 -1.26 -4.81 115.22 112.37 1xmp n HIS -5 Ca 0.10 -0.82 0.19 0.00 -2.01 0.00 0.00 57.72 55.18 1xmp n HIS -5 Cb 0.52 -0.18 0.76 0.00 0.12 0.00 0.00 29.99 31.22 1xmp n HIS -5 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1xmp h HIS -4 N 0.87 0.00 -0.00 -1.40 -0.00 -1.98 -1.00 115.15 111.64 1xmp h HIS -4 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.25 1xmp h HIS -4 Cb 1.52 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.93 1xmp h HIS -4 CO 0.36 0.00 -0.00 -2.39 -0.00 0.00 0.00 177.93 175.89 1xmp n HIS -3 N -3.95 0.00 -3.94 2.45 1.44 -1.26 -4.59 115.22 105.38 1xmp n HIS -3 Ca 0.05 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.46 1xmp n HIS -3 Cb 0.48 -0.10 -0.15 0.00 0.12 0.00 0.00 29.99 30.34 1xmp n HIS -3 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1xmp s HIS -2 N -2.20 2.94 0.24 -1.40 3.76 -0.38 -4.99 115.29 113.25 1xmp s HIS -2 Ca 0.41 -2.38 -0.06 0.00 -0.15 0.00 0.00 55.06 52.87 1xmp s HIS -2 Cb 0.21 -2.27 0.30 0.00 1.11 0.00 0.00 32.58 31.93 1xmp s HIS -2 CO 0.40 -0.89 1.86 0.45 -0.85 0.00 0.00 174.74 175.72 1xmp h HIS -1 N 7.81 1.01 0.00 1.40 -0.00 -1.81 -1.90 115.15 121.66 1xmp h HIS -1 Ca -0.10 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.29 1xmp h HIS -1 Cb 1.03 -0.33 0.00 0.00 -0.00 0.00 0.00 27.41 28.11 1xmp h HIS -1 CO 0.46 0.55 0.00 -2.39 -0.00 0.00 0.00 177.93 176.54 1xmp n HIS 0 N -4.59 0.00 1.00 2.45 1.44 -1.26 -2.29 115.22 111.98 1xmp n HIS 0 Ca 0.12 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.93 1xmp n HIS 0 Cb 0.14 -0.37 -0.08 0.00 0.12 0.00 0.00 29.99 29.80 1xmp n HIS 0 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1xmp n MET 1 N -1.37 0.31 -2.60 -1.40 2.00 -0.72 -4.73 117.12 108.62 1xmp n MET 1 Ca 0.05 -0.26 -0.39 0.00 0.00 0.00 0.00 57.70 57.10 1xmp n MET 1 Cb 0.12 -1.49 -0.05 0.00 0.00 0.00 0.00 33.22 31.79 1xmp n MET 1 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1xmp s LYS 2 N -2.86 4.57 0.23 0.03 1.02 -0.97 -4.78 119.74 116.99 1xmp s LYS 2 Ca 0.11 1.59 -0.32 0.00 0.02 0.00 0.00 55.97 57.37 1xmp s LYS 2 Cb 0.17 -3.00 -0.13 0.00 -0.52 0.00 0.00 37.83 34.35 1xmp s LYS 2 CO 0.79 0.22 1.52 0.43 -0.92 0.00 0.00 175.35 177.39 1xmp n SER 3 N 0.87 3.23 -0.02 2.83 7.64 -1.26 -4.71 113.62 122.20 1xmp n SER 3 Ca 0.01 1.12 0.04 0.00 1.01 0.00 0.00 58.87 61.05 1xmp n SER 3 Cb 0.47 -1.48 -0.10 0.00 -1.01 0.00 0.00 64.21 62.09 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 2.62 0.00 -4.11 -3.43 4.77 -0.40 -3.99 117.00 112.47 1xmp n LEU 4 Ca 0.12 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.86 1xmp n LEU 4 Cb 0.32 0.06 -0.16 0.00 -2.33 0.00 0.00 43.42 41.32 1xmp n LEU 4 CO 0.63 0.06 -0.49 -0.69 -1.33 0.00 0.00 177.39 175.58 1xmp s VAL 5 N -2.78 1.25 -0.19 4.08 1.01 -1.20 -0.60 120.40 121.98 1xmp s VAL 5 Ca -0.05 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 1xmp s VAL 5 Cb 0.07 -1.07 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 1xmp s VAL 5 CO 0.53 0.36 -0.01 -0.83 0.00 0.00 0.00 175.10 175.16 1xmp s GLY 6 N -0.01 1.72 -0.31 4.51 0.00 -0.79 -1.45 107.32 110.99 1xmp s GLY 6 Ca -0.02 -0.95 -0.04 0.00 0.00 0.00 0.00 44.72 43.71 1xmp s GLY 6 CO 0.01 0.18 0.04 0.14 0.00 0.00 0.00 173.10 173.47 1xmp s VAL 7 N 0.87 3.39 0.19 1.40 1.01 0.37 0.16 120.40 127.79 1xmp s VAL 7 Ca 0.01 -1.19 0.07 0.00 0.00 0.00 0.00 61.98 60.87 1xmp s VAL 7 Cb -0.14 -2.90 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 1xmp s VAL 7 CO 0.02 -0.09 -0.14 0.27 0.00 0.00 0.00 175.10 175.15 1xmp s ILE 8 N 1.34 1.66 0.05 2.22 -4.36 0.23 -1.15 121.20 121.20 1xmp s ILE 8 Ca -0.03 -2.14 -0.27 0.00 -0.26 0.00 0.00 60.65 57.95 1xmp s ILE 8 Cb -0.19 -1.97 0.07 0.00 1.25 0.00 0.00 42.46 41.61 1xmp s ILE 8 CO 0.01 -0.58 0.64 0.00 0.24 0.00 0.00 174.94 175.25 1xmp s MET 9 N -3.52 1.16 0.26 0.37 0.23 -0.96 -1.49 119.30 115.36 1xmp s MET 9 Ca 0.20 -0.09 0.13 0.00 -1.03 0.00 0.00 55.69 54.90 1xmp s MET 9 Cb -0.01 0.54 0.25 0.00 -1.53 0.00 0.00 34.83 34.08 1xmp s MET 9 CO 0.06 -0.44 1.53 0.78 -2.03 0.00 0.00 175.02 174.92 1xmp h GLY 10 N 2.53 0.00 -4.19 3.16 0.00 -1.59 0.17 103.07 103.14 1xmp h GLY 10 Ca -0.30 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 46.90 1xmp h GLY 10 CO 0.39 0.00 -0.47 -1.35 0.00 0.00 0.00 176.54 175.10 1xmp s SER 11 N -6.61 0.09 0.54 0.19 1.04 -1.26 -4.33 113.70 103.36 1xmp s SER 11 Ca 0.01 -0.39 0.20 0.00 0.48 0.00 0.00 55.95 56.25 1xmp s SER 11 Cb 0.10 0.24 1.41 0.00 0.10 0.00 0.00 66.02 67.87 1xmp s SER 11 CO 0.75 -0.49 2.15 0.71 0.98 0.00 0.00 173.24 177.35 1xmp h THR 12 N 3.76 0.86 0.00 2.02 1.35 -2.00 -0.64 112.91 118.26 1xmp h THR 12 Ca -0.32 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.53 1xmp h THR 12 Cb 1.19 0.97 -0.00 0.00 -1.73 0.00 0.00 68.15 68.58 1xmp h THR 12 CO 0.47 0.00 -0.04 0.77 -0.25 0.00 0.00 175.52 176.47 1xmp h SER 13 N 0.00 0.00 0.79 5.36 4.64 -2.00 -1.13 113.55 121.22 1xmp h SER 13 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1xmp h SER 13 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1xmp h SER 13 CO -0.00 0.04 0.00 0.44 -0.87 0.00 0.00 176.83 176.44 1xmp h ASP 14 N 0.00 0.00 -0.61 4.97 3.32 -1.53 -3.21 116.42 119.36 1xmp h ASP 14 Ca -0.00 0.00 0.11 0.00 0.02 0.00 0.00 57.03 57.16 1xmp h ASP 14 Cb 0.09 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 1xmp h ASP 14 CO 0.01 0.00 0.41 -0.25 -1.72 0.00 0.00 179.24 177.69 1xmp h TRP 15 N 0.00 0.40 -0.59 4.55 -0.00 -1.30 -0.63 115.95 118.38 1xmp h TRP 15 Ca 0.00 0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.89 1xmp h TRP 15 Cb 0.40 -0.13 -0.03 0.00 -0.00 0.00 0.00 29.16 29.40 1xmp h TRP 15 CO 0.00 0.18 0.31 0.93 -0.00 0.00 0.00 178.44 179.86 1xmp h GLU 16 N 0.37 0.81 0.15 2.65 4.39 -1.75 -0.40 114.58 120.80 1xmp h GLU 16 Ca 0.29 -0.09 -0.21 0.00 0.34 0.00 0.00 59.36 59.69 1xmp h GLU 16 Cb 0.64 -0.16 0.02 0.00 -0.10 0.00 0.00 28.75 29.15 1xmp h GLU 16 CO -0.08 0.61 -0.92 1.15 -1.16 0.00 0.00 179.01 178.61 1xmp h THR 17 N 0.82 1.45 0.00 1.13 2.02 -1.53 -3.38 112.91 113.42 1xmp h THR 17 Ca 0.21 -2.54 0.00 0.00 0.77 0.00 0.00 66.41 64.85 1xmp h THR 17 Cb 0.04 3.15 0.00 0.00 -1.74 0.00 0.00 68.15 69.60 1xmp h THR 17 CO -0.03 0.72 0.00 0.24 0.37 0.00 0.00 175.52 176.82 1xmp h MET 18 N -0.32 0.00 -0.27 6.66 2.86 -0.62 -3.12 114.93 120.12 1xmp h MET 18 Ca -0.17 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.52 1xmp h MET 18 Cb 1.70 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.35 1xmp h MET 18 CO 0.16 0.00 0.19 -0.22 1.06 0.00 0.00 176.91 178.09 1xmp h LYS 19 N 0.00 0.16 -0.94 1.72 3.64 -1.27 -2.61 116.57 117.27 1xmp h LYS 19 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1xmp h LYS 19 Cb 0.75 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.49 1xmp h LYS 19 CO 0.00 0.11 0.59 1.88 -2.27 0.00 0.00 179.45 179.75 1xmp h TYR 20 N 0.17 1.22 -0.45 1.91 -1.99 -1.80 0.70 116.97 116.72 1xmp h TYR 20 Ca 0.12 0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.91 1xmp h TYR 20 Cb 0.27 -0.40 -0.05 0.00 2.00 0.00 0.00 36.73 38.55 1xmp h TYR 20 CO -0.00 0.79 0.19 0.00 -0.00 0.00 0.00 178.16 179.14 1xmp h ALA 21 N 1.32 0.55 -0.10 3.88 0.00 -1.42 -2.71 119.26 120.78 1xmp h ALA 21 Ca 0.34 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.19 1xmp h ALA 21 Cb -0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1xmp h ALA 21 CO -0.07 -0.19 -0.39 0.00 0.00 0.00 0.00 179.25 178.61 1xmp h ASP 23 N 0.18 0.88 -0.55 0.00 3.32 -0.62 -0.89 116.42 118.74 1xmp h ASP 23 Ca 0.02 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 1xmp h ASP 23 Cb 0.77 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.06 1xmp h ASP 23 CO 0.06 0.87 0.34 0.40 -1.72 0.00 0.00 179.24 179.19 1xmp h ILE 24 N 0.84 1.16 -0.60 0.35 1.08 -1.22 -0.60 117.51 118.53 1xmp h ILE 24 Ca 0.19 -0.35 -0.06 0.00 -0.39 0.00 0.00 64.86 64.25 1xmp h ILE 24 Cb 0.32 0.40 -0.02 0.00 -3.07 0.00 0.00 36.82 34.45 1xmp h ILE 24 CO -0.00 0.17 0.16 -0.07 -0.69 0.00 0.00 178.15 177.71 1xmp h LEU 25 N 0.75 0.90 -0.07 1.44 3.38 -1.14 -1.18 115.31 119.39 1xmp h LEU 25 Ca 0.20 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1xmp h LEU 25 Cb -0.03 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 1xmp h LEU 25 CO -0.04 0.89 -0.15 0.44 0.09 0.00 0.00 178.44 179.67 1xmp h ASP 26 N 0.87 -0.46 -0.95 -0.43 3.32 -0.99 -0.34 116.42 117.43 1xmp h ASP 26 Ca 0.19 0.08 0.11 0.00 0.02 0.00 0.00 57.03 57.43 1xmp h ASP 26 Cb 0.33 0.21 -0.08 0.00 0.22 0.00 0.00 39.33 40.01 1xmp h ASP 26 CO -0.00 -0.20 0.58 -0.08 -1.72 0.00 0.00 179.24 177.82 1xmp h GLU 27 N -0.22 0.91 -0.21 3.56 4.81 -0.74 -0.65 114.58 122.04 1xmp h GLU 27 Ca 0.08 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1xmp h GLU 27 Cb 0.32 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1xmp h GLU 27 CO -0.20 0.60 0.00 1.28 -0.73 0.00 0.00 179.01 179.96 1xmp n LEU 28 N -4.66 1.76 -3.31 1.64 4.77 -0.48 -4.93 117.00 111.79 1xmp n LEU 28 Ca 0.17 -0.77 -0.24 0.00 -0.03 0.00 0.00 56.01 55.14 1xmp n LEU 28 Cb 0.33 -0.14 0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1xmp n LEU 28 CO 0.27 0.38 0.03 0.59 -1.33 0.00 0.00 177.39 177.34 1xmp n ASN 29 N 0.40 -5.25 -4.64 -1.43 3.02 -0.25 -4.97 115.26 102.14 1xmp n ASN 29 Ca 0.15 -0.41 -0.39 0.00 -0.03 0.00 0.00 54.58 53.90 1xmp n ASN 29 Cb 0.33 -4.25 -0.08 0.00 -0.61 0.00 0.00 39.78 35.17 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 -3.14 5.19 0.39 2.41 1.01 -0.26 -5.03 121.20 121.77 1xmp s ILE 30 Ca 0.42 0.62 -0.26 0.00 0.00 0.00 0.00 60.65 61.43 1xmp s ILE 30 Cb -0.20 -3.71 -0.09 0.00 0.01 0.00 0.00 42.46 38.48 1xmp s ILE 30 CO 0.51 0.20 1.18 -2.16 0.00 0.00 0.00 174.94 174.67 1xmp s PRO 31 N 1.70 4.12 0.21 2.79 0.04 -1.26 -4.53 135.00 138.07 1xmp s PRO 31 Ca 0.16 1.87 -0.16 0.00 0.04 0.00 0.00 61.00 62.92 1xmp s PRO 31 Cb -0.15 -2.75 0.02 0.00 0.04 0.00 0.00 34.50 31.66 1xmp s PRO 31 CO 0.09 -0.27 0.50 1.52 0.04 0.00 0.00 177.00 178.88 1xmp s TYR 32 N -1.37 0.03 0.16 0.56 1.13 -1.26 -1.27 117.35 115.32 1xmp s TYR 32 Ca 0.55 -0.39 0.09 0.00 -1.41 0.00 0.00 57.07 55.91 1xmp s TYR 32 Cb -0.32 0.33 -0.04 0.00 -1.10 0.00 0.00 41.96 40.83 1xmp s TYR 32 CO 0.40 -0.94 -0.19 -1.83 -2.51 0.00 0.00 175.55 170.48 1xmp s GLU 33 N -3.92 1.26 -0.04 -3.49 -1.05 -0.53 -4.83 118.70 106.10 1xmp s GLU 33 Ca 0.13 -1.37 0.01 0.00 -0.15 0.00 0.00 54.97 53.59 1xmp s GLU 33 Cb -0.01 -1.35 0.02 0.00 -0.44 0.00 0.00 34.13 32.35 1xmp s GLU 33 CO 0.01 0.28 -0.06 -1.59 0.95 0.00 0.00 175.26 174.84 1xmp s LYS 34 N -2.66 1.00 -0.05 -4.83 -2.85 -1.26 -0.48 119.74 108.61 1xmp s LYS 34 Ca 0.14 -0.18 -0.12 0.00 -1.00 0.00 0.00 55.97 54.81 1xmp s LYS 34 Cb -0.06 -0.93 0.02 0.00 -2.06 0.00 0.00 37.83 34.79 1xmp s LYS 34 CO 0.06 -0.03 0.28 0.15 0.10 0.00 0.00 175.35 175.91 1xmp s LYS 35 N 0.76 0.50 -0.27 1.78 1.02 -0.30 -4.99 119.74 118.25 1xmp s LYS 35 Ca -0.11 0.04 -0.29 0.00 0.02 0.00 0.00 55.97 55.63 1xmp s LYS 35 Cb -0.14 0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.41 1xmp s LYS 35 CO 0.01 -0.11 1.04 0.08 -0.92 0.00 0.00 175.35 175.45 1xmp s VAL 36 N -0.69 4.62 -0.10 3.17 1.01 -1.26 -2.27 120.40 124.88 1xmp s VAL 36 Ca -0.08 1.86 -0.02 0.00 0.00 0.00 0.00 61.98 63.74 1xmp s VAL 36 Cb -0.04 -4.34 0.04 0.00 0.00 0.00 0.00 36.38 32.04 1xmp s VAL 36 CO 0.02 -0.30 0.03 -0.69 0.00 0.00 0.00 175.10 174.16 1xmp s VAL 37 N 3.37 0.28 -0.18 2.92 1.01 0.58 -4.90 120.40 123.48 1xmp s VAL 37 Ca 0.44 -0.00 -0.05 0.00 0.00 0.00 0.00 61.98 62.37 1xmp s VAL 37 Cb -0.14 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 1xmp s VAL 37 CO 0.10 0.09 -0.01 -0.55 0.00 0.00 0.00 175.10 174.74 1xmp s SER 38 N 2.00 4.92 0.35 3.32 0.15 -1.26 -3.21 113.70 119.96 1xmp s SER 38 Ca 0.03 -0.13 0.04 0.00 0.70 0.00 0.00 55.95 56.60 1xmp s SER 38 Cb -0.14 -1.82 0.65 0.00 -1.71 0.00 0.00 66.02 63.00 1xmp s SER 38 CO -0.06 0.13 1.93 0.00 1.20 0.00 0.00 173.24 176.43 1xmp h ALA 39 N 7.03 1.45 0.00 5.45 0.00 -1.91 -1.02 119.26 130.27 1xmp h ALA 39 Ca -0.34 -0.15 -0.35 0.00 0.00 0.00 0.00 54.91 54.08 1xmp h ALA 39 Cb 1.18 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1xmp h ALA 39 CO 0.63 0.40 -2.32 0.72 0.00 0.00 0.00 179.25 178.69 1xmp n HIS 40 N -4.34 0.00 -0.02 0.00 8.25 -1.26 -3.71 115.22 114.14 1xmp n HIS 40 Ca 0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.56 1xmp n HIS 40 Cb 0.18 -0.95 -0.16 0.00 1.12 0.00 0.00 29.99 30.19 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 -2.72 0.66 -2.99 -0.41 1.74 -1.24 -4.59 116.66 107.11 1xmp n ARG 41 Ca -0.31 -0.14 -0.18 0.00 -0.77 0.00 0.00 57.85 56.45 1xmp n ARG 41 Cb 1.12 -1.54 -0.02 0.00 -1.02 0.00 0.00 32.46 31.01 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 -2.38 0.69 -0.35 0.55 -2.24 -0.39 -4.98 114.28 105.18 1xmp n THR 42 Ca -0.09 -4.38 -0.03 0.00 -2.27 0.00 0.00 64.05 57.28 1xmp n THR 42 Cb 0.67 -0.25 0.10 0.00 -2.10 0.00 0.00 70.33 68.75 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 2.97 1.24 -0.38 -0.78 0.13 -1.63 0.19 132.00 133.73 1xmp h PRO 43 Ca 0.07 -0.08 -0.05 0.00 -0.87 0.00 0.00 66.00 65.06 1xmp h PRO 43 Cb 0.95 -0.27 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1xmp h PRO 43 CO 0.56 0.83 0.03 -0.44 -0.23 0.00 0.00 178.00 178.76 1xmp h ASP 44 N 1.27 0.64 -0.89 1.44 3.32 -1.90 -1.93 116.42 118.37 1xmp h ASP 44 Ca 0.34 -0.28 0.04 0.00 0.02 0.00 0.00 57.03 57.15 1xmp h ASP 44 Cb -0.13 -0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.20 1xmp h ASP 44 CO -0.07 0.76 0.57 0.22 -1.72 0.00 0.00 179.24 179.00 1xmp h TYR 45 N 0.49 1.07 -0.56 4.55 3.20 -1.83 -1.45 116.97 122.45 1xmp h TYR 45 Ca 0.11 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1xmp h TYR 45 Cb 0.42 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 1xmp h TYR 45 CO 0.03 0.59 0.29 1.98 -1.64 0.00 0.00 178.16 179.41 1xmp h MET 46 N 1.08 0.78 -0.51 1.82 4.05 -0.64 -0.83 114.93 120.68 1xmp h MET 46 Ca 0.37 -0.10 -0.04 0.00 -0.28 0.00 0.00 59.70 59.65 1xmp h MET 46 Cb 0.06 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 1xmp h MET 46 CO -0.14 0.61 0.17 0.74 0.23 0.00 0.00 176.91 178.52 1xmp h PHE 47 N 0.75 0.82 -0.22 1.39 -1.00 -1.02 -1.33 116.94 116.33 1xmp h PHE 47 Ca 0.19 -0.08 0.03 0.00 2.81 0.00 0.00 57.97 60.92 1xmp h PHE 47 Cb 0.07 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 39.36 1xmp h PHE 47 CO -0.01 0.71 0.03 0.93 -1.61 0.00 0.00 178.31 178.36 1xmp h GLU 48 N 0.70 0.11 -0.05 1.51 5.08 -1.09 0.12 114.58 120.95 1xmp h GLU 48 Ca 0.17 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1xmp h GLU 48 Cb 0.27 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 1xmp h GLU 48 CO -0.01 0.07 0.03 -0.92 -1.00 0.00 0.00 179.01 177.19 1xmp h TYR 49 N 0.12 0.07 -0.31 4.33 5.03 -0.96 -1.70 116.97 123.54 1xmp h TYR 49 Ca 0.10 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.41 1xmp h TYR 49 Cb 0.11 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.35 1xmp h TYR 49 CO -0.16 0.08 0.19 0.00 -1.32 0.00 0.00 178.16 176.95 1xmp h ALA 50 N 0.99 0.40 -0.81 1.82 0.00 -1.11 -2.38 119.26 118.17 1xmp h ALA 50 Ca 0.02 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1xmp h ALA 50 Cb 0.03 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 1xmp h ALA 50 CO -0.00 -0.11 0.50 0.93 0.00 0.00 0.00 179.25 180.57 1xmp h GLU 51 N 0.40 0.88 -0.00 0.00 5.08 -0.53 -3.05 114.58 117.36 1xmp h GLU 51 Ca 0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1xmp h GLU 51 Cb 0.01 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1xmp h GLU 51 CO -0.02 0.58 -0.43 0.25 -1.00 0.00 0.00 179.01 178.40 1xmp n THR 52 N -4.65 0.00 -0.06 1.13 -2.24 -0.66 -4.48 114.28 103.32 1xmp n THR 52 Ca 0.11 -0.07 -0.07 0.00 -2.27 0.00 0.00 64.05 61.74 1xmp n THR 52 Cb 0.17 0.44 -0.01 0.00 -2.10 0.00 0.00 70.33 68.82 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 3.36 0.05 -0.49 6.98 0.00 -1.31 -1.31 119.26 126.54 1xmp h ALA 53 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xmp h ALA 53 Cb 0.52 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1xmp h ALA 53 CO 0.00 -0.56 0.22 -0.09 0.00 0.00 0.00 179.25 178.83 1xmp h ARG 54 N -0.12 0.72 0.00 0.00 2.43 -1.78 -2.40 114.38 113.22 1xmp h ARG 54 Ca 0.14 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1xmp h ARG 54 Cb 0.33 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1xmp h ARG 54 CO -0.33 0.61 0.00 1.49 -1.51 0.00 0.00 179.97 180.23 1xmp h GLU 55 N 0.65 0.00 0.00 0.20 4.57 -1.76 -1.47 114.58 116.77 1xmp h GLU 55 Ca 0.17 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1xmp h GLU 55 Cb 0.14 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1xmp h GLU 55 CO -0.02 0.00 0.00 0.54 -1.18 0.00 0.00 179.01 178.35 1xmp n ARG 56 N -3.02 0.74 -0.39 1.92 1.74 -0.53 -4.91 116.66 112.21 1xmp n ARG 56 Ca 0.02 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1xmp n ARG 56 Cb 0.39 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 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 0.90 0.71 3.77 -0.13 0.00 -0.55 -4.84 105.19 105.04 1xmp n GLY 57 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 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 4.40 -0.12 0.99 1.43 -0.94 -4.59 118.68 119.85 1xmp s LEU 58 Ca 0.00 2.52 0.16 0.00 -1.03 0.00 0.00 54.13 55.78 1xmp s LEU 58 Cb 0.00 -3.73 -0.23 0.00 0.03 0.00 0.00 46.19 42.26 1xmp s LEU 58 CO 0.00 -0.48 0.16 0.29 0.23 0.00 0.00 176.35 176.55 1xmp n LYS 59 N 0.72 1.04 -3.75 1.70 4.76 0.24 -4.41 118.16 118.46 1xmp n LYS 59 Ca 0.01 -0.06 -0.13 0.00 -2.87 0.00 0.00 58.31 55.26 1xmp n LYS 59 Cb 0.43 -1.43 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 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 -2.66 0.01 -0.12 -0.18 1.01 -1.14 -4.13 120.40 113.19 1xmp s VAL 60 Ca -0.08 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1xmp s VAL 60 Cb 0.07 -0.52 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 1xmp s VAL 60 CO 0.71 -0.04 -0.18 -0.63 0.00 0.00 0.00 175.10 174.95 1xmp s ILE 61 N -0.08 2.56 -0.26 2.22 1.01 -0.96 -1.88 121.20 123.81 1xmp s ILE 61 Ca -0.02 -0.84 -0.08 0.00 0.00 0.00 0.00 60.65 59.71 1xmp s ILE 61 Cb -0.03 -2.04 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 1xmp s ILE 61 CO 0.01 0.54 0.10 -0.63 0.00 0.00 0.00 174.94 174.96 1xmp s ILE 62 N 0.37 4.49 -0.11 2.92 1.01 0.12 -0.24 121.20 129.77 1xmp s ILE 62 Ca -0.14 -0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.38 1xmp s ILE 62 Cb -0.17 -3.13 0.01 0.00 0.01 0.00 0.00 42.46 39.18 1xmp s ILE 62 CO 0.07 0.29 -0.18 0.00 0.00 0.00 0.00 174.94 175.12 1xmp s ALA 63 N 1.64 1.86 -0.08 9.38 0.00 0.53 -0.60 121.76 134.48 1xmp s ALA 63 Ca 0.06 -0.82 -0.00 0.00 0.00 0.00 0.00 51.96 51.20 1xmp s ALA 63 Cb -0.15 -0.82 -0.03 0.00 0.00 0.00 0.00 23.12 22.12 1xmp s ALA 63 CO 0.05 0.05 -0.05 0.20 0.00 0.00 0.00 175.76 176.02 1xmp s GLY 64 N 0.74 1.74 0.01 0.00 0.00 -0.56 -1.07 107.32 108.19 1xmp s GLY 64 Ca -0.11 -0.86 -0.29 0.00 0.00 0.00 0.00 44.72 43.46 1xmp s GLY 64 CO 0.02 -0.61 0.65 0.00 0.00 0.00 0.00 173.10 173.17 1xmp s ALA 65 N -0.76 -1.71 0.22 3.20 0.00 -0.83 -3.54 121.76 118.33 1xmp s ALA 65 Ca 0.12 1.07 0.06 0.00 0.00 0.00 0.00 51.96 53.21 1xmp s ALA 65 Cb -0.11 0.26 -0.05 0.00 0.00 0.00 0.00 23.12 23.22 1xmp s ALA 65 CO 0.02 -0.49 -0.09 0.20 0.00 0.00 0.00 175.76 175.40 1xmp s GLY 66 N -1.65 1.49 0.00 0.00 0.00 -1.26 -0.80 107.32 105.10 1xmp s GLY 66 Ca -0.07 -1.71 0.00 0.00 0.00 0.00 0.00 44.72 42.93 1xmp s GLY 66 CO 0.03 -1.74 0.00 0.61 0.00 0.00 0.00 173.10 172.01 1xmp n GLY 67 N -0.41 1.50 3.56 0.20 0.00 -1.26 -3.83 105.19 104.95 1xmp n GLY 67 Ca -0.07 -0.49 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.96 2.20 -0.76 4.61 0.00 -1.26 -2.69 121.76 121.90 1xmp s ALA 68 Ca 0.00 -1.96 -0.17 0.00 0.00 0.00 0.00 51.96 49.83 1xmp s ALA 68 Cb 0.00 -4.56 0.15 0.00 0.00 0.00 0.00 23.12 18.71 1xmp s ALA 68 CO 0.00 -4.28 0.84 0.00 0.00 0.00 0.00 175.76 172.32 1xmp s ALA 69 N 7.78 3.62 -0.55 0.00 0.00 -1.25 -4.82 121.76 126.54 1xmp s ALA 69 Ca 0.59 -2.75 0.19 0.00 0.00 0.00 0.00 51.96 49.99 1xmp s ALA 69 Cb -0.03 -3.67 -0.24 0.00 0.00 0.00 0.00 23.12 19.18 1xmp s ALA 69 CO -0.02 -2.50 0.65 0.72 0.00 0.00 0.00 175.76 174.60 1xmp n HIS 70 N 5.60 0.00 0.04 0.00 8.25 -1.26 -4.10 115.22 123.75 1xmp n HIS 70 Ca 0.08 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.42 1xmp n HIS 70 Cb 0.46 -0.17 -0.06 0.00 1.12 0.00 0.00 29.99 31.34 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 -0.19 -0.54 2.41 5.85 -1.92 -1.02 115.31 119.90 1xmp h LEU 71 Ca 0.00 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1xmp h LEU 71 Cb 0.61 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1xmp h LEU 71 CO 0.00 -0.09 0.34 -0.65 -0.34 0.00 0.00 178.44 177.69 1xmp h PRO 72 N -0.11 0.66 -0.56 5.25 0.11 -1.83 -2.10 132.00 133.43 1xmp h PRO 72 Ca 0.03 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.99 1xmp h PRO 72 Cb 0.15 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1xmp h PRO 72 CO -0.07 0.44 -0.08 0.78 -0.21 0.00 0.00 178.00 178.86 1xmp h GLY 73 N 0.68 1.13 1.64 -0.55 0.00 -1.80 -0.52 103.07 103.65 1xmp h GLY 73 Ca 0.21 -0.88 -0.14 0.00 0.00 0.00 0.00 47.33 46.51 1xmp h GLY 73 CO -0.07 0.81 -0.54 -0.33 0.00 0.00 0.00 176.54 176.41 1xmp h MET 74 N 0.93 0.38 -0.21 4.80 2.86 -1.12 -0.85 114.93 121.72 1xmp h MET 74 Ca 0.15 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1xmp h MET 74 Cb 0.64 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1xmp h MET 74 CO 0.04 0.82 0.06 0.28 1.06 0.00 0.00 176.91 179.17 1xmp h VAL 75 N 0.29 1.20 -0.34 -2.22 2.07 -1.27 -2.85 116.25 113.14 1xmp h VAL 75 Ca 0.01 -0.64 0.07 0.00 0.82 0.00 0.00 66.70 66.96 1xmp h VAL 75 Cb 1.04 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1xmp h VAL 75 CO 0.09 0.20 0.23 0.00 0.02 0.00 0.00 177.57 178.12 1xmp h ALA 76 N 0.88 2.16 0.00 1.67 0.00 -0.91 -0.05 119.26 123.00 1xmp h ALA 76 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1xmp h ALA 76 Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1xmp h ALA 76 CO -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.01 1xmp h ALA 77 N 1.83 1.00 -0.01 0.00 0.00 -0.92 -3.28 119.26 117.89 1xmp h ALA 77 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1xmp h ALA 77 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xmp h ALA 77 CO -0.02 0.00 -0.10 1.63 0.00 0.00 0.00 179.25 180.77 1xmp n LYS 78 N -2.91 1.28 -3.80 0.00 4.76 -0.07 -4.99 118.16 112.42 1xmp n LYS 78 Ca 0.01 -0.78 -0.12 0.00 -2.87 0.00 0.00 58.31 54.55 1xmp n LYS 78 Cb 0.28 -1.10 -0.09 0.00 -1.84 0.00 0.00 35.03 32.28 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 -1.01 0.08 -2.21 -0.18 -1.32 -0.95 -4.15 115.64 105.90 1xmp s THR 79 Ca 0.09 -0.67 0.23 0.00 -1.21 0.00 0.00 61.69 60.12 1xmp s THR 79 Cb 0.07 -0.73 0.52 0.00 -1.51 0.00 0.00 72.50 70.86 1xmp s THR 79 CO 0.17 -0.37 1.46 0.59 -2.21 0.00 0.00 174.62 174.26 1xmp n ASN 80 N 1.00 3.68 -4.75 8.08 5.03 -1.26 -4.67 115.26 122.38 1xmp n ASN 80 Ca -0.20 -1.99 -0.37 0.00 0.87 0.00 0.00 54.58 52.88 1xmp n ASN 80 Cb 0.57 -0.36 0.04 0.00 -1.02 0.00 0.00 39.78 39.01 1xmp n ASN 80 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1xmp s LEU 81 N -1.25 3.76 0.28 3.41 1.43 -1.26 -4.96 118.68 120.08 1xmp s LEU 81 Ca 0.43 2.57 -0.30 0.00 -1.03 0.00 0.00 54.13 55.80 1xmp s LEU 81 Cb 0.24 -4.44 -0.11 0.00 0.03 0.00 0.00 46.19 41.91 1xmp s LEU 81 CO 0.32 -1.59 1.50 -2.16 0.23 0.00 0.00 176.35 174.66 1xmp s PRO 82 N -3.10 4.20 -0.14 1.29 0.04 -1.26 -4.91 135.00 131.12 1xmp s PRO 82 Ca 0.75 2.43 0.02 0.00 0.04 0.00 0.00 61.00 64.24 1xmp s PRO 82 Cb -0.35 -3.07 0.01 0.00 0.04 0.00 0.00 34.50 31.13 1xmp s PRO 82 CO 0.40 -0.51 -0.21 0.08 0.04 0.00 0.00 177.00 176.80 1xmp s VAL 83 N -0.09 2.13 -0.20 -0.36 1.01 -1.26 -2.26 120.40 119.37 1xmp s VAL 83 Ca 0.60 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 61.54 1xmp s VAL 83 Cb -0.44 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1xmp s VAL 83 CO 0.46 0.55 0.09 -0.63 0.00 0.00 0.00 175.10 175.57 1xmp s ILE 84 N 0.79 4.88 -0.21 2.22 1.01 0.67 -0.82 121.20 129.74 1xmp s ILE 84 Ca -0.07 0.00 -0.05 0.00 0.00 0.00 0.00 60.65 60.53 1xmp s ILE 84 Cb -0.16 -3.22 -0.02 0.00 0.01 0.00 0.00 42.46 39.07 1xmp s ILE 84 CO -0.01 0.42 0.01 -0.83 0.00 0.00 0.00 174.94 174.53 1xmp s GLY 85 N 0.63 1.71 -0.34 6.18 0.00 0.27 -0.35 107.32 115.42 1xmp s GLY 85 Ca 0.04 -1.05 -0.11 0.00 0.00 0.00 0.00 44.72 43.61 1xmp s GLY 85 CO 0.01 0.34 0.19 0.14 0.00 0.00 0.00 173.10 173.77 1xmp s VAL 86 N 1.22 4.65 -0.19 1.40 1.01 -0.23 -2.28 120.40 125.98 1xmp s VAL 86 Ca 0.03 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 61.11 1xmp s VAL 86 Cb -0.15 -3.48 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 1xmp s VAL 86 CO 0.01 -0.09 1.43 -2.84 0.00 0.00 0.00 175.10 173.61 1xmp s PRO 87 N 1.59 4.05 0.27 2.72 0.02 -1.26 -1.97 135.00 140.42 1xmp s PRO 87 Ca 0.04 1.66 -0.27 0.00 0.02 0.00 0.00 61.00 62.44 1xmp s PRO 87 Cb -0.18 -3.90 -0.09 0.00 0.02 0.00 0.00 34.50 30.35 1xmp s PRO 87 CO 0.07 -0.97 0.92 0.08 -0.33 0.00 0.00 177.00 176.77 1xmp s VAL 88 N 4.20 4.18 -0.40 3.83 1.01 0.02 -1.02 120.40 132.22 1xmp s VAL 88 Ca 0.62 1.90 -0.28 0.00 0.00 0.00 0.00 61.98 64.22 1xmp s VAL 88 Cb -0.23 -4.14 -0.00 0.00 0.00 0.00 0.00 36.38 32.00 1xmp s VAL 88 CO 0.23 0.32 1.58 -1.58 0.00 0.00 0.00 175.10 175.64 1xmp s GLN 89 N -1.63 3.43 0.65 2.72 0.74 -1.26 -4.32 119.66 119.98 1xmp s GLN 89 Ca 0.45 1.08 -0.11 0.00 0.05 0.00 0.00 55.36 56.83 1xmp s GLN 89 Cb -0.22 -4.11 -0.02 0.00 1.10 0.00 0.00 33.01 29.76 1xmp s GLN 89 CO 0.27 -1.75 1.04 -1.54 -0.55 0.00 0.00 175.29 172.76 1xmp s SER 90 N 4.96 5.95 0.01 6.67 1.04 -1.26 -4.72 113.70 126.34 1xmp s SER 90 Ca 0.68 1.48 -0.25 0.00 0.48 0.00 0.00 55.95 58.33 1xmp s SER 90 Cb -0.17 -2.47 -0.15 0.00 0.10 0.00 0.00 66.02 63.33 1xmp s SER 90 CO 0.32 -1.06 1.15 0.50 0.98 0.00 0.00 173.24 175.13 1xmp h LYS 91 N -0.45 -0.67 0.01 4.02 3.64 -1.97 -2.29 116.57 118.86 1xmp h LYS 91 Ca -0.44 0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1xmp h LYS 91 Cb 1.20 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.17 1xmp h LYS 91 CO 0.60 -0.37 -0.01 0.00 -2.27 0.00 0.00 179.45 177.41 1xmp h ALA 92 N -0.78 -0.02 -0.53 5.00 0.00 -2.03 -3.36 119.26 117.54 1xmp h ALA 92 Ca -0.07 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1xmp h ALA 92 Cb 0.62 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1xmp h ALA 92 CO 0.12 -0.16 0.00 1.28 0.00 0.00 0.00 179.25 180.49 1xmp n LEU 93 N -4.77 3.50 -3.67 0.00 4.32 -1.26 -4.98 117.00 110.14 1xmp n LEU 93 Ca -0.09 -1.85 -0.28 0.00 -0.02 0.00 0.00 56.01 53.77 1xmp n LEU 93 Cb 0.34 -0.35 0.01 0.00 -1.62 0.00 0.00 43.42 41.80 1xmp n LEU 93 CO 0.33 0.84 0.04 0.59 -1.22 0.00 0.00 177.39 177.97 1xmp n ASN 94 N 1.28 -4.46 0.00 -1.43 3.02 -0.86 -1.72 115.26 111.09 1xmp n ASN 94 Ca 0.19 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 54.12 1xmp n ASN 94 Cb 0.55 -3.61 0.00 0.00 -0.61 0.00 0.00 39.78 36.12 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 -1.47 0.82 0.23 7.41 0.00 -1.25 -4.55 105.19 106.38 1xmp n GLY 95 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 0.76 -0.34 0.99 5.85 -1.68 0.91 115.31 121.81 1xmp h LEU 96 Ca 0.00 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 1xmp h LEU 96 Cb 0.00 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1xmp h LEU 96 CO 0.00 0.88 0.15 -2.24 -0.34 0.00 0.00 178.44 176.89 1xmp h ASP 97 N 0.62 0.46 -0.31 1.25 2.03 -1.85 -1.93 116.42 116.69 1xmp h ASP 97 Ca 0.13 -0.15 0.07 0.00 -0.73 0.00 0.00 57.03 56.35 1xmp h ASP 97 Cb 0.49 -0.12 -0.07 0.00 -0.83 0.00 0.00 39.33 38.80 1xmp h ASP 97 CO 0.02 0.48 -0.18 0.28 -1.03 0.00 0.00 179.24 178.81 1xmp h SER 98 N 0.40 -0.61 0.05 4.15 0.02 -1.28 -1.57 113.55 114.72 1xmp h SER 98 Ca 0.11 0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1xmp h SER 98 Cb 0.16 0.32 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1xmp h SER 98 CO -0.01 -0.22 -0.02 0.25 -1.14 0.00 0.00 176.83 175.69 1xmp h LEU 99 N -0.14 -0.06 -0.79 5.07 5.85 -0.73 -2.71 115.31 121.80 1xmp h LEU 99 Ca 0.16 -0.14 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 1xmp h LEU 99 Cb 0.39 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1xmp h LEU 99 CO -0.40 0.10 0.19 -0.07 -0.34 0.00 0.00 178.44 177.92 1xmp h LEU 100 N -0.21 1.04 -2.15 2.25 3.38 -1.27 0.13 115.31 118.48 1xmp h LEU 100 Ca -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1xmp h LEU 100 Cb 0.19 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1xmp h LEU 100 CO 0.01 0.98 -0.05 0.28 0.09 0.00 0.00 178.44 179.75 1xmp h SER 101 N 1.05 0.00 0.00 -0.43 0.02 -1.24 -3.05 113.55 109.90 1xmp h SER 101 Ca 0.22 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.82 1xmp h SER 101 Cb 0.34 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.82 1xmp h SER 101 CO -0.00 0.05 -1.99 -0.38 -1.14 0.00 0.00 176.83 173.37 1xmp n ILE 102 N -3.99 1.53 -0.01 3.27 5.41 -0.98 -4.68 119.36 119.92 1xmp n ILE 102 Ca -0.03 -0.23 -0.10 0.00 1.00 0.00 0.00 62.75 63.40 1xmp n ILE 102 Cb 0.14 -1.97 0.05 0.00 -0.71 0.00 0.00 39.64 37.16 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 -1.00 1.31 0.00 1.39 3.04 -1.05 -3.33 116.25 116.61 1xmp h VAL 103 Ca -0.54 -1.74 0.00 0.00 -1.01 0.00 0.00 66.70 63.40 1xmp h VAL 103 Cb 1.46 1.71 0.00 0.00 -2.01 0.00 0.00 31.29 32.45 1xmp h VAL 103 CO -0.33 0.55 0.00 0.00 -1.01 0.00 0.00 177.57 176.78 1xmp n GLN 104 N -3.98 0.86 -1.77 4.17 1.13 -1.15 -4.89 117.38 111.75 1xmp n GLN 104 Ca -0.03 0.00 -0.39 0.00 -1.94 0.00 0.00 57.00 54.64 1xmp n GLN 104 Cb 0.59 -1.15 0.03 0.00 0.11 0.00 0.00 30.24 29.83 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 -0.11 3.35 0.70 -1.09 -1.94 -1.25 -4.97 119.30 113.98 1xmp s MET 105 Ca 0.00 2.33 -0.11 0.00 -1.71 0.00 0.00 55.69 56.20 1xmp s MET 105 Cb 0.00 -2.42 0.01 0.00 2.01 0.00 0.00 34.83 34.43 1xmp s MET 105 CO 0.00 -1.06 1.07 -1.25 -0.01 0.00 0.00 175.02 173.77 1xmp s PRO 106 N -2.72 2.88 0.12 2.03 0.04 -1.26 -4.93 135.00 131.16 1xmp s PRO 106 Ca 0.67 0.76 -0.34 0.00 0.04 0.00 0.00 61.00 62.13 1xmp s PRO 106 Cb -0.42 -2.00 -0.14 0.00 0.04 0.00 0.00 34.50 31.98 1xmp s PRO 106 CO 0.52 -1.08 1.59 0.41 0.04 0.00 0.00 177.00 178.47 1xmp n GLY 107 N -2.36 1.09 0.00 0.56 0.00 -1.26 -2.21 105.19 101.02 1xmp n GLY 107 Ca 0.07 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.77 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 3.43 1.02 2.39 -0.02 0.00 -1.26 -5.01 105.19 105.74 1xmp n GLY 108 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.02 0.45 -1.99 1.61 0.31 -0.94 -5.07 118.33 112.68 1xmp n VAL 109 Ca 0.00 -4.39 -0.39 0.00 -0.01 0.00 0.00 64.34 59.55 1xmp n VAL 109 Cb 0.00 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 30.96 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 -1.40 3.79 -0.09 5.55 0.04 -1.26 -4.53 135.00 137.09 1xmp s PRO 110 Ca 0.35 2.18 0.02 0.00 0.04 0.00 0.00 61.00 63.60 1xmp s PRO 110 Cb 0.11 -2.64 0.01 0.00 0.04 0.00 0.00 34.50 32.02 1xmp s PRO 110 CO -0.10 -0.65 -0.15 0.08 0.04 0.00 0.00 177.00 176.22 1xmp s VAL 111 N -1.28 1.40 -0.55 -0.36 1.01 -1.26 -4.72 120.40 114.63 1xmp s VAL 111 Ca 0.60 -0.61 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 1xmp s VAL 111 Cb -0.39 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1xmp s VAL 111 CO 0.49 0.42 1.38 0.00 0.00 0.00 0.00 175.10 177.39 1xmp s ALA 112 N 0.74 2.85 -0.14 5.51 0.00 -0.00 -4.87 121.76 125.85 1xmp s ALA 112 Ca -0.12 -0.66 -0.07 0.00 0.00 0.00 0.00 51.96 51.11 1xmp s ALA 112 Cb -0.16 -4.08 -0.04 0.00 0.00 0.00 0.00 23.12 18.84 1xmp s ALA 112 CO 0.03 -2.86 0.12 0.99 0.00 0.00 0.00 175.76 174.04 1xmp s THR 113 N 5.86 5.36 0.43 0.00 2.01 -1.26 -0.56 115.64 127.48 1xmp s THR 113 Ca 0.52 0.16 0.01 0.00 0.31 0.00 0.00 61.69 62.69 1xmp s THR 113 Cb -0.10 -3.36 0.01 0.00 0.01 0.00 0.00 72.50 69.06 1xmp s THR 113 CO 0.26 0.57 0.12 1.33 -0.69 0.00 0.00 174.62 176.21 1xmp n VAL 114 N 2.38 0.00 -1.77 3.82 0.24 -0.96 -4.96 118.33 117.08 1xmp n VAL 114 Ca -0.19 -1.92 -0.35 0.00 -2.04 0.00 0.00 64.34 59.84 1xmp n VAL 114 Cb 0.54 0.22 0.06 0.00 -1.47 0.00 0.00 33.84 33.19 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 -2.70 2.38 0.19 2.33 0.00 -1.26 -4.43 121.76 118.28 1xmp s ALA 115 Ca 0.09 0.95 -0.33 0.00 0.00 0.00 0.00 51.96 52.67 1xmp s ALA 115 Cb -0.01 -3.46 -0.13 0.00 0.00 0.00 0.00 23.12 19.52 1xmp s ALA 115 CO 0.06 -1.45 1.58 -0.89 0.00 0.00 0.00 175.76 175.05 1xmp n ILE 116 N -2.06 0.24 -3.36 0.00 5.41 -1.26 -3.28 119.36 115.05 1xmp n ILE 116 Ca 0.14 -0.06 0.00 0.00 1.00 0.00 0.00 62.75 63.83 1xmp n ILE 116 Cb 0.50 -1.64 0.00 0.00 -0.71 0.00 0.00 39.64 37.79 1xmp n ILE 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1xmp n GLY 117 N 3.20 -0.90 0.25 7.39 0.00 -0.18 -4.24 105.19 110.71 1xmp n GLY 117 Ca 0.15 -1.32 0.01 0.00 0.00 0.00 0.00 46.02 44.86 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 0.39 -0.34 1.61 1.57 -1.87 -1.25 116.57 116.68 1xmp h LYS 118 Ca 0.00 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1xmp h LYS 118 Cb 0.00 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1xmp h LYS 118 CO 0.00 0.50 0.17 0.00 -0.57 0.00 0.00 179.45 179.55 1xmp h ALA 119 N 1.54 0.44 -0.46 3.86 0.00 -1.88 -0.86 119.26 121.91 1xmp h ALA 119 Ca 0.07 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1xmp h ALA 119 Cb 0.40 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1xmp h ALA 119 CO 0.02 -0.00 0.26 0.78 0.00 0.00 0.00 179.25 180.30 1xmp h GLY 120 N 0.42 0.64 0.65 0.00 0.00 -1.34 -1.22 103.07 102.21 1xmp h GLY 120 Ca 0.12 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.29 1xmp h GLY 120 CO -0.02 0.15 -0.13 0.23 0.00 0.00 0.00 176.54 176.78 1xmp h SER 121 N 0.51 -0.37 -0.43 0.19 0.87 -0.83 0.32 113.55 113.80 1xmp h SER 121 Ca 0.19 0.06 0.09 0.00 -1.23 0.00 0.00 61.79 60.90 1xmp h SER 121 Cb 0.05 0.16 -0.09 0.00 -0.44 0.00 0.00 62.40 62.08 1xmp h SER 121 CO -0.10 -0.18 -0.25 0.74 -0.53 0.00 0.00 176.83 176.51 1xmp h THR 122 N -0.20 0.32 0.00 2.23 2.02 -1.10 -1.78 112.91 114.41 1xmp h THR 122 Ca 0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.22 1xmp h THR 122 Cb 0.27 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 67.00 1xmp h THR 122 CO -0.15 0.00 -0.09 0.78 0.37 0.00 0.00 175.52 176.43 1xmp h ASN 123 N -0.16 0.00 -0.37 4.18 -0.26 -0.34 -2.14 115.58 116.49 1xmp h ASN 123 Ca 0.20 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.93 1xmp h ASN 123 Cb 0.48 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.73 1xmp h ASN 123 CO -0.53 0.09 0.18 0.00 -1.06 0.00 0.00 177.43 176.12 1xmp h ALA 124 N 1.91 0.47 -0.16 -0.83 0.00 0.48 0.15 119.26 121.28 1xmp h ALA 124 Ca -0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xmp h ALA 124 Cb 0.19 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1xmp h ALA 124 CO 0.01 0.02 0.09 0.78 0.00 0.00 0.00 179.25 180.15 1xmp h GLY 125 N 0.46 0.23 1.14 0.00 0.00 -1.10 0.15 103.07 103.95 1xmp h GLY 125 Ca 0.13 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 1xmp h GLY 125 CO -0.02 0.10 0.22 1.41 0.00 0.00 0.00 176.54 178.25 1xmp h LEU 126 N 0.17 1.00 -0.53 3.11 3.38 -1.30 -1.67 115.31 119.48 1xmp h LEU 126 Ca 0.06 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1xmp h LEU 126 Cb 0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1xmp h LEU 126 CO -0.01 0.93 -0.12 0.25 0.09 0.00 0.00 178.44 179.59 1xmp h LEU 127 N 1.04 1.03 -0.84 1.67 5.85 -0.47 0.19 115.31 123.77 1xmp h LEU 127 Ca 0.23 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1xmp h LEU 127 Cb 0.28 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 1xmp h LEU 127 CO -0.01 1.14 0.48 0.00 -0.34 0.00 0.00 178.44 179.71 1xmp h ALA 128 N 0.92 1.08 -0.68 1.25 0.00 -0.85 -0.42 119.26 120.56 1xmp h ALA 128 Ca 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1xmp h ALA 128 Cb 0.69 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1xmp h ALA 128 CO 0.05 0.57 0.37 0.00 0.00 0.00 0.00 179.25 180.24 1xmp h ALA 129 N 1.26 0.86 -0.70 0.00 0.00 -0.77 -1.76 119.26 118.15 1xmp h ALA 129 Ca 0.30 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1xmp h ALA 129 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1xmp h ALA 129 CO -0.05 0.38 0.31 1.96 0.00 0.00 0.00 179.25 181.85 1xmp h GLN 130 N 0.92 1.02 -0.30 0.00 4.20 -0.18 0.90 115.11 121.67 1xmp h GLN 130 Ca 0.24 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1xmp h GLN 130 Cb 0.04 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1xmp h GLN 130 CO -0.04 0.81 -0.01 0.82 -0.67 0.00 0.00 178.83 179.74 1xmp h ILE 131 N 1.01 1.26 -0.59 2.54 2.04 -0.74 -1.61 117.51 121.42 1xmp h ILE 131 Ca 0.24 -0.96 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 1xmp h ILE 131 Cb 0.15 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 1xmp h ILE 131 CO -0.03 0.31 0.20 -0.07 0.00 0.00 0.00 178.15 178.57 1xmp h LEU 132 N 0.33 0.80 -0.36 1.44 3.38 -1.10 -2.52 115.31 117.28 1xmp h LEU 132 Ca 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xmp h LEU 132 Cb 0.45 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1xmp h LEU 132 CO 0.02 0.74 0.00 0.61 0.09 0.00 0.00 178.44 179.90 1xmp n GLY 133 N -0.97 -1.22 0.18 0.83 0.00 0.29 -1.22 105.19 103.08 1xmp n GLY 133 Ca 0.05 0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.84 -3.34 113.55 115.62 1xmp h SER 134 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 1xmp h SER 134 Cb 0.36 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1xmp h SER 134 CO 0.00 0.00 -1.28 0.33 -0.87 0.00 0.00 176.83 175.01 1xmp n PHE 135 N -2.51 0.00 -3.24 4.77 7.35 -0.81 -4.99 117.46 118.04 1xmp n PHE 135 Ca 0.01 0.00 -0.44 0.00 -0.76 0.00 0.00 57.45 56.26 1xmp n PHE 135 Cb 0.22 -0.19 -0.07 0.00 0.35 0.00 0.00 39.48 39.79 1xmp n PHE 135 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1xmp s HIS 136 N -2.10 3.12 0.51 -5.13 3.76 -0.36 -4.95 115.29 110.14 1xmp s HIS 136 Ca -0.07 -0.69 0.16 0.00 -0.15 0.00 0.00 55.06 54.32 1xmp s HIS 136 Cb 0.02 -3.41 1.24 0.00 1.11 0.00 0.00 32.58 31.54 1xmp s HIS 136 CO 0.11 -0.95 2.13 -0.44 -0.85 0.00 0.00 174.74 174.74 1xmp h ASP 137 N 8.91 0.00 -0.76 1.40 3.32 -1.89 -2.35 116.42 125.05 1xmp h ASP 137 Ca -0.28 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 1xmp h ASP 137 Cb 1.10 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 1xmp h ASP 137 CO 0.93 0.03 0.31 -2.24 -1.72 0.00 0.00 179.24 176.55 1xmp h ASP 138 N 0.00 1.04 -0.43 6.45 2.03 -1.92 -0.44 116.42 123.15 1xmp h ASP 138 Ca -0.00 -0.17 -0.08 0.00 -0.73 0.00 0.00 57.03 56.05 1xmp h ASP 138 Cb 0.05 -0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 38.27 1xmp h ASP 138 CO 0.00 0.93 -0.04 0.40 -1.03 0.00 0.00 179.24 179.50 1xmp h ILE 139 N 1.09 1.27 -0.28 4.15 2.04 -1.79 -0.83 117.51 123.16 1xmp h ILE 139 Ca 0.25 -1.10 0.00 0.00 1.00 0.00 0.00 64.86 65.01 1xmp h ILE 139 Cb 0.21 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1xmp h ILE 139 CO -0.02 0.37 0.18 -0.74 0.00 0.00 0.00 178.15 177.94 1xmp h HIS 140 N 0.61 0.36 -0.96 1.37 2.76 -1.28 -0.65 115.15 117.37 1xmp h HIS 140 Ca 0.12 0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.31 1xmp h HIS 140 Cb 0.55 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 29.33 1xmp h HIS 140 CO 0.04 0.25 0.63 -0.44 -1.30 0.00 0.00 177.93 177.11 1xmp h ASP 141 N 0.36 1.07 -0.42 3.26 3.32 -0.98 -1.35 116.42 121.68 1xmp h ASP 141 Ca 0.10 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 1xmp h ASP 141 Cb -0.01 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 1xmp h ASP 141 CO -0.02 0.75 0.11 0.00 -1.72 0.00 0.00 179.24 178.36 1xmp h ALA 142 N 1.37 1.28 -0.29 3.45 0.00 -0.58 -2.21 119.26 122.29 1xmp h ALA 142 Ca 0.37 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1xmp h ALA 142 Cb -0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1xmp h ALA 142 CO -0.10 0.50 0.04 -0.07 0.00 0.00 0.00 179.25 179.62 1xmp h LEU 143 N 0.72 0.46 -0.41 0.00 3.38 -0.38 -1.83 115.31 117.25 1xmp h LEU 143 Ca 0.16 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 57.92 1xmp h LEU 143 Cb 0.28 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1xmp h LEU 143 CO -0.00 0.61 0.11 -0.33 0.09 0.00 0.00 178.44 178.92 1xmp h GLU 144 N 0.29 0.25 -0.59 1.13 4.39 -1.10 -1.36 114.58 117.59 1xmp h GLU 144 Ca 0.09 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.68 1xmp h GLU 144 Cb 0.35 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 1xmp h GLU 144 CO 0.01 0.17 0.02 -0.07 -1.16 0.00 0.00 179.01 177.97 1xmp h LEU 145 N 0.26 0.99 -0.45 1.33 3.38 -1.29 -0.26 115.31 119.26 1xmp h LEU 145 Ca 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1xmp h LEU 145 Cb 0.22 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1xmp h LEU 145 CO -0.23 1.03 0.22 -0.09 0.09 0.00 0.00 178.44 179.46 1xmp h ARG 146 N 0.94 0.65 -0.40 1.13 2.43 -1.09 -0.95 114.38 117.09 1xmp h ARG 146 Ca 0.17 -0.09 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 1xmp h ARG 146 Cb 0.51 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 1xmp h ARG 146 CO 0.02 0.55 0.04 -0.09 -1.51 0.00 0.00 179.97 178.98 1xmp h ARG 147 N 0.59 0.68 -0.60 0.20 2.43 -1.02 -2.60 114.38 114.06 1xmp h ARG 147 Ca 0.16 -0.20 0.08 0.00 -0.81 0.00 0.00 59.98 59.21 1xmp h ARG 147 Cb 0.11 -0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.52 1xmp h ARG 147 CO -0.02 0.74 0.27 0.93 -1.51 0.00 0.00 179.97 180.38 1xmp h GLU 148 N 0.52 0.48 -0.47 0.20 5.08 -0.81 -0.48 114.58 119.10 1xmp h GLU 148 Ca 0.12 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1xmp h GLU 148 Cb 0.41 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1xmp h GLU 148 CO 0.01 0.32 0.24 0.00 -1.00 0.00 0.00 179.01 178.58 1xmp h ALA 149 N 1.37 0.61 -0.62 3.43 0.00 -1.05 -1.98 119.26 121.03 1xmp h ALA 149 Ca 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1xmp h ALA 149 Cb 0.29 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1xmp h ALA 149 CO -0.25 0.15 0.34 0.82 0.00 0.00 0.00 179.25 180.31 1xmp h ILE 150 N 0.62 1.20 -0.50 0.00 2.04 -1.07 -1.84 117.51 117.95 1xmp h ILE 150 Ca 0.16 -0.50 0.04 0.00 1.00 0.00 0.00 64.86 65.57 1xmp h ILE 150 Cb 0.09 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 1xmp h ILE 150 CO -0.02 0.22 0.26 -0.08 0.00 0.00 0.00 178.15 178.53 1xmp h GLU 151 N 0.84 0.50 -0.32 2.37 4.22 -0.78 -0.44 114.58 120.98 1xmp h GLU 151 Ca 0.22 -0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.58 1xmp h GLU 151 Cb 0.04 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 1xmp h GLU 151 CO -0.04 0.33 0.01 -0.22 -2.18 0.00 0.00 179.01 176.92 1xmp h LYS 152 N 0.52 0.56 -0.56 1.92 3.64 -1.21 -0.19 116.57 121.24 1xmp h LYS 152 Ca 0.22 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1xmp h LYS 152 Cb 0.11 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1xmp h LYS 152 CO -0.14 0.68 0.26 0.22 -2.27 0.00 0.00 179.45 178.19 1xmp h ASP 153 N 0.36 0.72 0.02 4.20 3.58 -0.97 -0.18 116.42 124.15 1xmp h ASP 153 Ca 0.09 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.42 1xmp h ASP 153 Cb 0.42 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.29 1xmp h ASP 153 CO 0.01 0.62 -0.19 0.58 -2.88 0.00 0.00 179.24 177.38 1xmp h VAL 154 N 0.79 1.66 -0.46 2.25 2.07 -0.95 -3.32 116.25 118.29 1xmp h VAL 154 Ca 0.20 -2.20 -0.01 0.00 0.82 0.00 0.00 66.70 65.51 1xmp h VAL 154 Cb 0.10 3.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.98 1xmp h VAL 154 CO -0.02 0.59 0.25 -0.09 0.02 0.00 0.00 177.57 178.31 1xmp h ARG 155 N -0.74 0.63 -0.03 1.57 2.43 -0.97 -3.51 114.38 113.76 1xmp h ARG 155 Ca -0.03 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1xmp h ARG 155 Cb 1.07 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 1xmp h ARG 155 CO 0.04 0.47 0.00 0.39 -1.51 0.00 0.00 179.97 179.36