#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oac s PRO 2 N 0.00 3.22 -0.10 0.54 0.04 -1.26 -4.71 135.00 132.72 2oac s PRO 2 Ca 0.00 1.38 -0.05 0.00 0.04 0.00 0.00 61.00 62.37 2oac s PRO 2 Cb 0.00 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 2oac s PRO 2 CO 0.00 -0.92 0.11 0.71 0.04 0.00 0.00 177.00 176.95 2oac s TYR 3 N -2.20 3.49 -0.02 0.56 2.02 -1.26 -2.91 117.35 117.03 2oac s TYR 3 Ca 0.67 0.43 0.01 0.00 -0.37 0.00 0.00 57.07 57.82 2oac s TYR 3 Cb -0.19 -1.89 0.01 0.00 -0.40 0.00 0.00 41.96 39.49 2oac s TYR 3 CO 0.34 0.67 -0.04 0.99 -1.57 0.00 0.00 175.55 175.93 2oac s THR 4 N -1.03 0.43 -0.17 -0.71 2.01 -0.47 0.48 115.64 116.17 2oac s THR 4 Ca 0.16 -0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.01 2oac s THR 4 Cb -0.12 -0.42 0.01 0.00 0.01 0.00 0.00 72.50 71.98 2oac s THR 4 CO 0.05 0.16 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.35 2oac s ILE 5 N 0.36 2.51 -0.32 1.82 1.01 -0.19 -1.91 121.20 124.48 2oac s ILE 5 Ca -0.04 -0.81 -0.06 0.00 0.00 0.00 0.00 60.65 59.74 2oac s ILE 5 Cb -0.08 -2.07 0.03 0.00 0.01 0.00 0.00 42.46 40.36 2oac s ILE 5 CO -0.00 0.51 0.08 -0.69 0.00 0.00 0.00 174.94 174.84 2oac s VAL 6 N 1.04 3.73 0.26 2.92 1.01 0.09 -0.09 120.40 129.36 2oac s VAL 6 Ca -0.01 -1.02 -0.19 0.00 0.00 0.00 0.00 61.98 60.76 2oac s VAL 6 Cb -0.15 -3.05 0.02 0.00 0.00 0.00 0.00 36.38 33.20 2oac s VAL 6 CO -0.04 -0.08 0.65 -0.47 0.00 0.00 0.00 175.10 175.16 2oac s TYR 7 N 1.42 -0.11 0.89 5.22 5.04 -1.03 -0.60 117.35 128.18 2oac s TYR 7 Ca -0.01 -0.30 -0.11 0.00 -2.44 0.00 0.00 57.07 54.21 2oac s TYR 7 Cb -0.19 0.58 0.13 0.00 0.35 0.00 0.00 41.96 42.83 2oac s TYR 7 CO 0.02 -1.14 1.09 -0.06 -1.34 0.00 0.00 175.55 174.13 2oac s PHE 8 N -3.92 2.27 -1.01 4.97 0.08 -1.26 -0.34 117.98 118.78 2oac s PHE 8 Ca 0.12 1.32 -0.07 0.00 0.12 0.00 0.00 56.93 58.41 2oac s PHE 8 Cb -0.04 -3.15 -0.11 0.00 -0.57 0.00 0.00 43.02 39.14 2oac s PHE 8 CO 0.05 -2.40 2.75 -0.35 -0.10 0.00 0.00 175.22 175.16 2oac n PRO 9 N -3.90 2.72 -4.00 0.24 -0.04 -1.25 -4.71 135.00 124.06 2oac n PRO 9 Ca 0.07 -1.64 -0.10 0.00 -0.04 0.00 0.00 63.50 61.80 2oac n PRO 9 Cb 0.55 -2.48 -0.07 0.00 -0.04 0.00 0.00 33.50 31.46 2oac n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2oac s VAL 10 N 2.33 0.06 -0.04 0.52 -7.23 -1.26 -4.39 120.40 110.38 2oac s VAL 10 Ca 0.57 -1.48 -0.15 0.00 -1.81 0.00 0.00 61.98 59.11 2oac s VAL 10 Cb 0.18 -1.94 -0.09 0.00 0.56 0.00 0.00 36.38 35.08 2oac s VAL 10 CO -0.04 -0.26 0.64 0.03 -0.31 0.00 0.00 175.10 175.16 2oac h ARG 11 N 2.55 -0.45 0.00 4.82 3.08 -0.77 -3.45 114.38 120.16 2oac h ARG 11 Ca -0.32 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.76 2oac h ARG 11 Cb 1.23 0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.38 2oac h ARG 11 CO 0.48 -0.24 0.00 0.41 -1.07 0.00 0.00 179.97 179.55 2oac n GLY 12 N 0.49 1.55 0.15 0.04 0.00 -0.20 -1.12 105.19 106.10 2oac n GLY 12 Ca -0.07 0.09 0.05 0.00 0.00 0.00 0.00 46.02 46.09 2oac n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oac n ARG 13 N 9.07 1.19 -0.00 1.61 1.74 -1.26 -3.50 116.66 125.51 2oac n ARG 13 Ca 0.00 -0.29 0.05 0.00 -0.77 0.00 0.00 57.85 56.85 2oac n ARG 13 Cb 0.00 -1.18 -0.07 0.00 -1.02 0.00 0.00 32.46 30.18 2oac n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2oac n ALA 14 N -0.38 2.93 -0.21 7.54 0.00 -0.28 -4.68 120.51 125.43 2oac n ALA 14 Ca 0.08 -0.29 -0.08 0.00 0.00 0.00 0.00 53.44 53.16 2oac n ALA 14 Cb 0.10 -0.39 0.03 0.00 0.00 0.00 0.00 19.45 19.19 2oac n ALA 14 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2oac h GLU 15 N 0.00 0.92 -0.68 0.00 4.57 -1.25 -2.09 114.58 116.05 2oac h GLU 15 Ca 0.00 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 57.97 2oac h GLU 15 Cb 0.38 -0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 2oac h GLU 15 CO 0.00 0.82 0.39 0.00 -1.18 0.00 0.00 179.01 179.04 2oac h ALA 16 N 1.06 0.87 0.00 2.92 0.00 -1.83 -0.19 119.26 122.08 2oac h ALA 16 Ca 0.19 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 2oac h ALA 16 Cb 0.28 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2oac h ALA 16 CO -0.01 0.37 -0.33 0.00 0.00 0.00 0.00 179.25 179.28 2oac h MET 17 N 0.93 0.00 -0.24 0.00 -0.00 -1.82 -1.09 114.93 112.72 2oac h MET 17 Ca 0.24 0.00 -0.08 0.00 -0.00 0.00 0.00 59.70 59.86 2oac h MET 17 Cb 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.61 2oac h MET 17 CO -0.04 0.33 -0.18 0.00 -0.00 0.00 0.00 176.91 177.02 2oac h ARG 18 N 0.00 0.54 -0.18 -0.10 3.08 -0.63 -1.47 114.38 115.63 2oac h ARG 18 Ca -0.00 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 59.78 2oac h ARG 18 Cb 0.68 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2oac h ARG 18 CO 0.04 0.84 0.09 0.52 -1.07 0.00 0.00 179.97 180.40 2oac h MET 19 N 0.25 0.25 0.11 0.04 2.86 -0.71 -1.47 114.93 116.26 2oac h MET 19 Ca 0.04 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.67 2oac h MET 19 Cb 0.72 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.28 2oac h MET 19 CO 0.05 0.25 -0.49 1.25 1.06 0.00 0.00 176.91 179.03 2oac h LEU 20 N 0.18 -1.47 -0.51 1.22 6.46 -1.14 0.30 115.31 120.34 2oac h LEU 20 Ca 0.06 0.16 0.10 0.00 -0.12 0.00 0.00 57.88 58.08 2oac h LEU 20 Cb 0.08 0.55 -0.08 0.00 -0.73 0.00 0.00 40.66 40.47 2oac h LEU 20 CO -0.01 -0.54 0.01 -0.07 -0.62 0.00 0.00 178.44 177.22 2oac h LEU 21 N -0.72 -0.19 0.04 2.25 3.38 -1.16 -1.46 115.31 117.44 2oac h LEU 21 Ca 0.01 0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2oac h LEU 21 Cb 0.74 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 2oac h LEU 21 CO -0.28 -0.07 -0.09 0.00 0.09 0.00 0.00 178.44 178.09 2oac h ALA 22 N 1.45 -0.13 0.00 1.53 0.00 -0.70 0.60 119.26 122.02 2oac h ALA 22 Ca 0.26 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 2oac h ALA 22 Cb 0.39 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 2oac h ALA 22 CO -0.42 -0.60 -0.01 0.22 0.00 0.00 0.00 179.25 178.44 2oac h ASP 23 N -0.18 0.00 -0.59 0.00 3.58 0.15 0.49 116.42 119.87 2oac h ASP 23 Ca 0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.47 2oac h ASP 23 Cb 0.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.25 2oac h ASP 23 CO -0.07 0.01 0.00 0.00 -2.88 0.00 0.00 179.24 176.30 2oac n GLN 24 N -3.32 2.46 -2.02 0.28 1.13 -0.60 -4.93 117.38 110.38 2oac n GLN 24 Ca -0.03 -2.27 -0.13 0.00 -1.94 0.00 0.00 57.00 52.64 2oac n GLN 24 Cb 0.11 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 28.94 2oac n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2oac n GLY 25 N 1.51 0.23 3.92 1.08 0.00 0.16 -5.01 105.19 107.08 2oac n GLY 25 Ca 0.21 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2oac n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oac s GLN 26 N -4.24 3.49 0.33 1.61 -1.52 0.12 -5.02 119.66 114.43 2oac s GLN 26 Ca 0.00 -0.38 0.08 0.00 -1.95 0.00 0.00 55.36 53.11 2oac s GLN 26 Cb 0.00 -2.96 -0.04 0.00 -0.22 0.00 0.00 33.01 29.78 2oac s GLN 26 CO 0.00 0.54 0.12 -1.54 -0.25 0.00 0.00 175.29 174.16 2oac s SER 27 N -2.69 4.65 0.08 5.90 1.04 -1.26 -4.24 113.70 117.18 2oac s SER 27 Ca 0.37 -0.76 -0.26 0.00 0.48 0.00 0.00 55.95 55.78 2oac s SER 27 Cb -0.12 -0.75 0.07 0.00 0.10 0.00 0.00 66.02 65.32 2oac s SER 27 CO 0.27 -0.25 0.65 -1.66 0.98 0.00 0.00 173.24 173.23 2oac s TRP 28 N -2.41 -0.57 0.17 5.02 -2.14 -1.26 -4.31 118.94 113.44 2oac s TRP 28 Ca 0.37 0.59 -0.19 0.00 2.66 0.00 0.00 56.10 59.53 2oac s TRP 28 Cb -0.03 0.51 -0.08 0.00 -3.10 0.00 0.00 33.47 30.77 2oac s TRP 28 CO 0.22 -0.74 0.66 0.21 -2.66 0.00 0.00 176.95 174.63 2oac s LYS 29 N -2.82 4.21 -0.23 3.25 2.20 0.18 -4.95 119.74 121.57 2oac s LYS 29 Ca -0.03 0.78 -0.03 0.00 -0.36 0.00 0.00 55.97 56.33 2oac s LYS 29 Cb -0.01 -3.00 0.00 0.00 -1.51 0.00 0.00 37.83 33.32 2oac s LYS 29 CO -0.05 0.48 -0.05 -2.00 -0.36 0.00 0.00 175.35 173.37 2oac s GLU 30 N -1.72 3.23 -0.63 4.03 2.56 -1.26 -1.02 118.70 123.88 2oac s GLU 30 Ca 0.38 -0.72 -0.01 0.00 0.00 0.00 0.00 54.97 54.62 2oac s GLU 30 Cb -0.17 -3.00 0.16 0.00 2.00 0.00 0.00 34.13 33.12 2oac s GLU 30 CO 0.21 -0.25 0.43 -2.00 -0.56 0.00 0.00 175.26 173.09 2oac s GLU 31 N 1.44 2.50 0.16 4.30 2.12 0.87 -4.96 118.70 125.13 2oac s GLU 31 Ca 0.04 -2.67 -0.30 0.00 0.36 0.00 0.00 54.97 52.41 2oac s GLU 31 Cb -0.15 -3.65 -0.07 0.00 0.26 0.00 0.00 34.13 30.52 2oac s GLU 31 CO -0.04 -1.17 1.07 0.08 -0.54 0.00 0.00 175.26 174.66 2oac s VAL 32 N -0.31 4.02 -0.24 3.70 1.01 -1.26 -2.45 120.40 124.87 2oac s VAL 32 Ca 0.18 1.72 -0.00 0.00 0.00 0.00 0.00 61.98 63.88 2oac s VAL 32 Cb -0.20 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.12 2oac s VAL 32 CO -0.04 0.28 -0.10 -0.69 0.00 0.00 0.00 175.10 174.56 2oac s VAL 33 N -0.15 2.56 0.64 2.92 1.01 0.54 -4.93 120.40 122.98 2oac s VAL 33 Ca 0.49 -1.16 -0.13 0.00 0.00 0.00 0.00 61.98 61.18 2oac s VAL 33 Cb -0.28 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2oac s VAL 33 CO 0.33 0.20 1.05 0.42 0.00 0.00 0.00 175.10 177.10 2oac s THR 34 N 1.26 4.06 0.31 3.92 -4.23 -1.26 -3.78 115.64 115.92 2oac s THR 34 Ca -0.01 0.80 -0.00 0.00 -1.18 0.00 0.00 61.69 61.30 2oac s THR 34 Cb -0.17 -3.47 0.27 0.00 1.34 0.00 0.00 72.50 70.48 2oac s THR 34 CO -0.06 -0.74 1.96 0.40 -0.54 0.00 0.00 174.62 175.63 2oac h ILE 35 N -0.12 1.16 0.19 2.99 5.03 -1.99 -0.03 117.51 124.73 2oac h ILE 35 Ca -0.45 -0.36 0.01 0.00 -0.12 0.00 0.00 64.86 63.94 2oac h ILE 35 Cb 1.21 0.02 -0.03 0.00 -3.03 0.00 0.00 36.82 34.99 2oac h ILE 35 CO 0.58 0.19 -0.28 0.44 -0.68 0.00 0.00 178.15 178.40 2oac h ASP 36 N 1.04 -0.79 -0.69 1.72 5.19 -1.99 0.85 116.42 121.76 2oac h ASP 36 Ca 0.32 0.08 0.03 0.00 -0.62 0.00 0.00 57.03 56.84 2oac h ASP 36 Cb -0.01 0.29 -0.04 0.00 0.18 0.00 0.00 39.33 39.74 2oac h ASP 36 CO -0.09 -0.39 0.43 0.74 -3.12 0.00 0.00 179.24 176.82 2oac h THR 37 N -0.54 1.08 -0.66 0.35 2.02 -1.78 -2.49 112.91 110.90 2oac h THR 37 Ca 0.01 -0.29 0.03 0.00 0.77 0.00 0.00 66.41 66.94 2oac h THR 37 Cb 0.53 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 2oac h THR 37 CO -0.12 0.15 0.40 -0.25 0.37 0.00 0.00 175.52 176.08 2oac h TRP 38 N 0.84 0.75 0.00 3.16 2.91 -0.40 -1.18 115.95 122.04 2oac h TRP 38 Ca 0.28 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.32 2oac h TRP 38 Cb 0.03 -0.25 0.00 0.00 -0.51 0.00 0.00 29.16 28.44 2oac h TRP 38 CO -0.05 0.42 0.00 -1.33 -1.03 0.00 0.00 178.44 176.46 2oac n MET 39 N -4.71 0.05 0.28 2.65 2.81 0.24 -2.01 117.12 116.42 2oac n MET 39 Ca 0.07 0.26 0.17 0.00 -1.81 0.00 0.00 57.70 56.38 2oac n MET 39 Cb 0.09 -1.50 0.77 0.00 -0.71 0.00 0.00 33.22 31.87 2oac n MET 39 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 2oac h GLN 40 N 0.00 0.00 -1.92 0.03 4.20 -1.05 -3.47 115.11 112.91 2oac h GLN 40 Ca 0.00 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.50 2oac h GLN 40 Cb 0.19 0.00 0.01 0.00 0.30 0.00 0.00 27.48 27.98 2oac h GLN 40 CO 0.00 0.05 -0.29 0.41 -0.67 0.00 0.00 178.83 178.34 2oac n GLY 41 N -0.29 -0.01 0.09 3.46 0.00 -0.85 -4.94 105.19 102.65 2oac n GLY 41 Ca -0.01 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 2oac n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oac n LEU 42 N -1.79 2.40 0.01 0.99 4.77 -1.26 -4.63 117.00 117.49 2oac n LEU 42 Ca -0.10 -0.08 -0.21 0.00 -0.03 0.00 0.00 56.01 55.59 2oac n LEU 42 Cb 0.58 -0.47 -0.14 0.00 -2.33 0.00 0.00 43.42 41.07 2oac n LEU 42 CO 0.18 0.73 -0.24 0.25 -1.33 0.00 0.00 177.39 176.99 2oac h LEU 43 N 0.00 0.38 -0.57 2.23 5.85 -1.88 -3.39 115.31 117.93 2oac h LEU 43 Ca -0.42 -0.88 0.11 0.00 0.84 0.00 0.00 57.88 57.53 2oac h LEU 43 Cb 1.71 -0.12 -0.11 0.00 0.37 0.00 0.00 40.66 42.51 2oac h LEU 43 CO -0.05 1.51 -0.22 0.50 -0.34 0.00 0.00 178.44 179.84 2oac h LYS 44 N -0.39 -0.08 0.00 1.25 3.64 -1.85 -0.92 116.57 118.22 2oac h LYS 44 Ca -0.24 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 2oac h LYS 44 Cb 1.67 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.51 2oac h LYS 44 CO 0.08 -0.05 0.00 -1.00 -2.27 0.00 0.00 179.45 176.20 2oac h PRO 45 N -0.08 0.00 -0.01 1.90 0.13 -1.82 -0.64 132.00 131.48 2oac h PRO 45 Ca 0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.39 2oac h PRO 45 Cb 0.49 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.62 2oac h PRO 45 CO -0.63 0.00 -0.29 0.25 -0.23 0.00 0.00 178.00 177.10 2oac n THR 46 N -2.79 0.00 -3.04 1.56 -2.24 -0.37 -4.85 114.28 102.55 2oac n THR 46 Ca -0.02 -0.15 -0.40 0.00 -2.27 0.00 0.00 64.05 61.22 2oac n THR 46 Cb 0.11 0.54 -0.05 0.00 -2.10 0.00 0.00 70.33 68.83 2oac n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oac h LEU 48 N 5.72 -0.63 -3.03 0.00 5.85 -1.88 -1.88 115.31 119.46 2oac h LEU 48 Ca -0.44 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2oac h LEU 48 Cb 1.20 0.40 0.00 0.00 0.37 0.00 0.00 40.66 42.63 2oac h LEU 48 CO 0.71 -0.22 0.00 -1.22 -0.34 0.00 0.00 178.44 177.37 2oac n TYR 49 N -5.43 0.65 -2.11 1.25 4.01 -1.26 -4.95 117.16 109.32 2oac n TYR 49 Ca 0.07 -0.64 -0.12 0.00 -0.16 0.00 0.00 57.90 57.04 2oac n TYR 49 Cb 0.33 -0.14 -0.01 0.00 -0.31 0.00 0.00 39.34 39.20 2oac n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oac n GLY 50 N 0.12 0.07 3.32 2.72 0.00 -0.71 -5.00 105.19 105.70 2oac n GLY 50 Ca 0.15 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 2oac n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2oac s GLN 51 N -4.40 1.23 0.33 1.61 -0.21 -1.26 -4.94 119.66 112.02 2oac s GLN 51 Ca 0.00 -1.41 0.10 0.00 0.02 0.00 0.00 55.36 54.07 2oac s GLN 51 Cb 0.00 0.34 -0.06 0.00 1.00 0.00 0.00 33.01 34.29 2oac s GLN 51 CO 0.00 -0.44 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.10 2oac s LEU 52 N -3.07 2.69 0.56 2.90 1.43 -1.26 -4.63 118.68 117.30 2oac s LEU 52 Ca 0.28 -1.15 -0.19 0.00 -1.03 0.00 0.00 54.13 52.04 2oac s LEU 52 Cb 0.04 -1.03 -0.05 0.00 0.03 0.00 0.00 46.19 45.18 2oac s LEU 52 CO 0.07 -0.13 1.15 -2.16 0.23 0.00 0.00 176.35 175.51 2oac s PRO 53 N -3.58 3.26 -0.09 1.29 0.04 -1.26 -4.96 135.00 129.70 2oac s PRO 53 Ca 0.32 1.66 0.02 0.00 0.04 0.00 0.00 61.00 63.04 2oac s PRO 53 Cb 0.00 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 2oac s PRO 53 CO 0.16 -0.93 -0.15 0.21 0.04 0.00 0.00 177.00 176.33 2oac s LYS 54 N -3.31 2.93 -0.05 4.56 2.20 0.23 -3.89 119.74 122.42 2oac s LYS 54 Ca 0.74 -0.72 0.07 0.00 -0.36 0.00 0.00 55.97 55.69 2oac s LYS 54 Cb -0.25 -2.46 -0.01 0.00 -1.51 0.00 0.00 37.83 33.59 2oac s LYS 54 CO 0.28 0.39 -0.25 0.12 -0.36 0.00 0.00 175.35 175.54 2oac s PHE 55 N -0.14 2.36 -0.13 4.03 5.36 0.13 -0.73 117.98 128.86 2oac s PHE 55 Ca -0.02 -0.63 0.00 0.00 -0.96 0.00 0.00 56.93 55.33 2oac s PHE 55 Cb -0.14 -1.54 0.02 0.00 -0.34 0.00 0.00 43.02 41.03 2oac s PHE 55 CO 0.04 -0.16 -0.11 -1.21 -1.46 0.00 0.00 175.22 172.31 2oac s GLU 56 N -0.29 1.96 -0.48 10.12 2.02 -0.80 0.99 118.70 132.21 2oac s GLU 56 Ca 0.00 -0.43 0.03 0.00 0.02 0.00 0.00 54.97 54.60 2oac s GLU 56 Cb -0.12 -1.85 0.53 0.00 0.10 0.00 0.00 34.13 32.78 2oac s GLU 56 CO 0.02 -0.23 1.78 -3.47 0.02 0.00 0.00 175.26 173.39 2oac n ASP 57 N 4.76 5.18 0.00 -0.19 -0.08 -0.03 -1.37 116.55 124.82 2oac n ASP 57 Ca -0.15 -3.74 0.00 0.00 -1.51 0.00 0.00 54.79 49.39 2oac n ASP 57 Cb 0.50 -0.79 0.00 0.00 2.34 0.00 0.00 41.12 43.17 2oac n ASP 57 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2oac n GLY 58 N -1.00 2.15 0.12 0.27 0.00 -1.14 -4.12 105.19 101.47 2oac n GLY 58 Ca 0.54 -0.19 -0.17 0.00 0.00 0.00 0.00 46.02 46.20 2oac n GLY 58 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2oac n ASP 59 N 4.13 1.67 -4.70 1.61 2.03 -1.26 -4.89 116.55 115.14 2oac n ASP 59 Ca 0.00 0.19 -0.37 0.00 0.52 0.00 0.00 54.79 55.13 2oac n ASP 59 Cb 0.00 -0.48 -0.07 0.00 -0.72 0.00 0.00 41.12 39.85 2oac n ASP 59 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2oac s LEU 60 N -6.63 4.19 -0.17 -2.67 2.96 -1.26 -5.07 118.68 110.03 2oac s LEU 60 Ca -0.19 0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 54.14 2oac s LEU 60 Cb 0.07 -2.41 -0.03 0.00 0.50 0.00 0.00 46.19 44.33 2oac s LEU 60 CO 0.76 0.02 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.92 2oac s THR 61 N 0.88 4.12 0.20 3.68 2.01 -1.26 -0.85 115.64 124.42 2oac s THR 61 Ca 0.17 -0.27 0.07 0.00 0.31 0.00 0.00 61.69 61.97 2oac s THR 61 Cb -0.14 -2.83 -0.05 0.00 0.01 0.00 0.00 72.50 69.50 2oac s THR 61 CO 0.06 0.47 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.57 2oac s LEU 62 N 0.48 2.54 0.10 4.42 1.43 0.28 -4.98 118.68 122.94 2oac s LEU 62 Ca -0.01 -1.04 -0.01 0.00 -1.03 0.00 0.00 54.13 52.03 2oac s LEU 62 Cb -0.14 -0.61 -0.04 0.00 0.03 0.00 0.00 46.19 45.43 2oac s LEU 62 CO 0.02 -0.22 0.02 -0.31 0.23 0.00 0.00 176.35 176.10 2oac s TYR 63 N -3.04 0.70 0.00 0.29 2.02 -1.26 0.20 117.35 116.25 2oac s TYR 63 Ca 0.22 -1.15 0.00 0.00 -0.37 0.00 0.00 57.07 55.78 2oac s TYR 63 Cb 0.00 -0.43 0.00 0.00 -0.40 0.00 0.00 41.96 41.13 2oac s TYR 63 CO 0.06 -0.46 0.00 1.04 -1.57 0.00 0.00 175.55 174.62 2oac n GLN 64 N -0.01 0.00 -0.30 -0.62 1.13 -1.25 -4.57 117.38 111.76 2oac n GLN 64 Ca -0.09 0.38 0.10 0.00 -1.94 0.00 0.00 57.00 55.45 2oac n GLN 64 Cb 0.62 -0.50 0.26 0.00 0.11 0.00 0.00 30.24 30.74 2oac n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2oac h SER 65 N 0.00 0.47 0.12 1.08 4.64 -1.89 -0.80 113.55 117.17 2oac h SER 65 Ca 0.00 0.12 -0.18 0.00 -0.47 0.00 0.00 61.79 61.26 2oac h SER 65 Cb 0.00 0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2oac h SER 65 CO 0.00 0.14 -0.66 0.78 -0.87 0.00 0.00 176.83 176.22 2oac h ASN 66 N 0.55 0.59 -0.41 4.97 2.35 -1.92 -1.45 115.58 120.25 2oac h ASN 66 Ca 0.51 -0.35 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 2oac h ASN 66 Cb 0.82 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2oac h ASN 66 CO -0.42 1.09 0.14 0.00 -1.65 0.00 0.00 177.43 176.58 2oac h ALA 67 N 0.91 1.35 -0.34 -0.83 0.00 -1.55 -0.44 119.26 118.36 2oac h ALA 67 Ca -0.02 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 2oac h ALA 67 Cb 1.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2oac h ALA 67 CO 0.12 0.47 -0.29 0.82 0.00 0.00 0.00 179.25 180.37 2oac h ILE 68 N 0.69 1.29 -0.68 0.00 2.04 -0.89 -1.63 117.51 118.32 2oac h ILE 68 Ca 0.16 -1.45 -0.02 0.00 1.00 0.00 0.00 64.86 64.55 2oac h ILE 68 Cb 0.22 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 2oac h ILE 68 CO -0.01 0.48 0.34 -0.07 0.00 0.00 0.00 178.15 178.89 2oac h LEU 69 N 0.58 0.89 -0.85 1.44 3.38 -0.80 -1.74 115.31 118.20 2oac h LEU 69 Ca 0.06 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 2oac h LEU 69 Cb 0.86 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2oac h LEU 69 CO 0.07 0.76 0.06 0.03 0.09 0.00 0.00 178.44 179.46 2oac h ARG 70 N 0.95 0.92 -0.60 1.13 3.08 -1.03 0.45 114.38 119.28 2oac h ARG 70 Ca 0.24 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 2oac h ARG 70 Cb 0.10 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 2oac h ARG 70 CO -0.03 0.87 0.22 1.25 -1.07 0.00 0.00 179.97 181.21 2oac h HIS 71 N 0.86 0.93 -0.34 3.04 2.76 -0.95 -0.09 115.15 121.35 2oac h HIS 71 Ca 0.17 -0.08 -0.13 0.00 -2.20 0.00 0.00 60.37 58.14 2oac h HIS 71 Cb 0.42 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 2oac h HIS 71 CO 0.03 0.75 -0.27 -0.07 -1.30 0.00 0.00 177.93 177.06 2oac h LEU 72 N 0.83 0.84 -0.92 0.26 3.38 -1.02 -0.32 115.31 118.36 2oac h LEU 72 Ca 0.20 -0.45 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 2oac h LEU 72 Cb 0.23 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2oac h LEU 72 CO -0.01 1.11 0.12 1.23 0.09 0.00 0.00 178.44 180.98 2oac h GLY 73 N 0.57 0.99 0.88 0.83 0.00 -0.72 -1.80 103.07 103.82 2oac h GLY 73 Ca 0.06 -0.60 -0.15 0.00 0.00 0.00 0.00 47.33 46.65 2oac h GLY 73 CO 0.07 0.56 -0.51 -0.09 0.00 0.00 0.00 176.54 176.57 2oac h ARG 74 N 0.88 0.52 -0.49 4.80 2.43 -0.93 0.33 114.38 121.92 2oac h ARG 74 Ca 0.19 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2oac h ARG 74 Cb 0.34 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 2oac h ARG 74 CO 0.00 1.06 0.00 -1.13 -1.51 0.00 0.00 179.97 178.39 2oac n SER 75 N -4.23 1.95 0.00 -3.80 3.41 -0.14 -3.78 113.62 107.03 2oac n SER 75 Ca -0.08 -2.13 0.00 0.00 -0.26 0.00 0.00 58.87 56.40 2oac n SER 75 Cb 0.61 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 2oac n SER 75 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oac n LEU 76 N 0.27 0.26 -0.94 1.04 4.77 -0.69 -5.01 117.00 116.70 2oac n LEU 76 Ca 0.09 -0.26 -0.06 0.00 -0.03 0.00 0.00 56.01 55.75 2oac n LEU 76 Cb 0.37 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.47 2oac n LEU 76 CO 0.08 0.06 -0.02 0.61 -1.33 0.00 0.00 177.39 176.80 2oac n GLY 77 N -0.05 0.28 2.45 -0.72 0.00 -1.09 -4.97 105.19 101.10 2oac n GLY 77 Ca 0.00 -0.55 -0.23 0.00 0.00 0.00 0.00 46.02 45.23 2oac n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oac n LEU 78 N -1.20 4.17 -1.43 0.99 4.77 0.12 -4.75 117.00 119.67 2oac n LEU 78 Ca -0.04 -4.87 0.04 0.00 -0.03 0.00 0.00 56.01 51.11 2oac n LEU 78 Cb 0.54 -0.29 0.05 0.00 -2.33 0.00 0.00 43.42 41.39 2oac n LEU 78 CO 0.12 2.09 0.10 0.00 -1.33 0.00 0.00 177.39 178.37 2oac n TYR 79 N -0.45 0.05 0.00 -1.77 4.19 -1.19 -1.92 117.16 116.07 2oac n TYR 79 Ca 0.34 -0.69 0.00 0.00 3.31 0.00 0.00 57.90 60.86 2oac n TYR 79 Cb 0.73 -0.17 0.00 0.00 0.49 0.00 0.00 39.34 40.39 2oac n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2oac n GLY 80 N 0.24 -0.68 0.01 2.98 0.00 -1.26 -4.20 105.19 102.27 2oac n GLY 80 Ca 0.08 -1.72 0.09 0.00 0.00 0.00 0.00 46.02 44.47 2oac n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2oac n LYS 81 N -0.73 0.79 -2.41 1.61 2.85 -1.26 -4.96 118.16 114.04 2oac n LYS 81 Ca 0.00 -0.11 -0.04 0.00 -1.05 0.00 0.00 58.31 57.11 2oac n LYS 81 Cb 0.00 -1.39 -0.01 0.00 -0.65 0.00 0.00 35.03 32.98 2oac n LYS 81 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2oac n ASN 82 N -1.88 -0.25 0.13 -5.58 0.23 -1.26 -5.06 115.26 101.59 2oac n ASN 82 Ca -0.01 -1.53 -0.01 0.00 -0.53 0.00 0.00 54.58 52.50 2oac n ASN 82 Cb 0.40 0.52 0.11 0.00 -2.08 0.00 0.00 39.78 38.73 2oac n ASN 82 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2oac h GLN 83 N 0.00 0.00 -0.28 -3.83 4.20 -1.96 -2.91 115.11 110.33 2oac h GLN 83 Ca -0.06 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.54 2oac h GLN 83 Cb 0.30 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2oac h GLN 83 CO 0.09 0.66 -0.24 -0.09 -0.67 0.00 0.00 178.83 178.59 2oac h ARG 84 N 0.00 0.66 -0.28 1.46 2.43 -1.99 -1.82 114.38 114.85 2oac h ARG 84 Ca -0.01 -0.33 -0.10 0.00 -0.81 0.00 0.00 59.98 58.73 2oac h ARG 84 Cb 1.26 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 2oac h ARG 84 CO 0.09 0.94 -0.24 0.93 -1.51 0.00 0.00 179.97 180.17 2oac h GLU 85 N 0.40 0.54 -0.50 0.20 5.08 -1.93 -2.21 114.58 116.15 2oac h GLU 85 Ca 0.05 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 2oac h GLU 85 Cb 0.79 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2oac h GLU 85 CO 0.06 0.74 0.10 0.00 -1.00 0.00 0.00 179.01 178.90 2oac h ALA 86 N 1.27 0.66 -0.61 3.43 0.00 -1.40 -0.42 119.26 122.19 2oac h ALA 86 Ca 0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2oac h ALA 86 Cb 0.67 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2oac h ALA 86 CO 0.05 0.39 0.26 0.00 0.00 0.00 0.00 179.25 179.95 2oac h ALA 87 N 0.98 0.79 -0.41 0.00 0.00 -1.16 -2.33 119.26 117.14 2oac h ALA 87 Ca 0.15 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2oac h ALA 87 Cb 0.38 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2oac h ALA 87 CO 0.01 0.38 -0.22 1.96 0.00 0.00 0.00 179.25 181.38 2oac h GLN 88 N 0.84 0.81 -0.10 0.00 4.20 -1.20 -1.80 115.11 117.87 2oac h GLN 88 Ca 0.21 -0.33 -0.05 0.00 0.06 0.00 0.00 58.65 58.53 2oac h GLN 88 Cb 0.17 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2oac h GLN 88 CO -0.02 0.95 -0.18 0.52 -0.67 0.00 0.00 178.83 179.43 2oac h MET 89 N 0.71 0.16 -0.12 1.46 2.86 -0.87 -0.94 114.93 118.19 2oac h MET 89 Ca 0.10 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2oac h MET 89 Cb 0.74 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.38 2oac h MET 89 CO 0.06 0.35 -0.12 -0.44 1.06 0.00 0.00 176.91 177.82 2oac h ASP 90 N 0.15 0.32 -0.69 1.22 3.32 -1.10 0.29 116.42 119.94 2oac h ASP 90 Ca 0.03 -0.48 0.07 0.00 0.02 0.00 0.00 57.03 56.68 2oac h ASP 90 Cb 0.42 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.84 2oac h ASP 90 CO 0.03 0.73 0.45 -0.03 -1.72 0.00 0.00 179.24 178.70 2oac h MET 91 N -0.09 0.63 0.30 3.56 4.05 -0.95 0.12 114.93 122.56 2oac h MET 91 Ca 0.02 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.39 2oac h MET 91 Cb 0.64 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 2oac h MET 91 CO 0.03 0.42 -0.14 0.28 0.23 0.00 0.00 176.91 177.73 2oac h VAL 92 N 0.65 0.65 -0.95 -5.77 2.07 -0.99 -2.94 116.25 108.98 2oac h VAL 92 Ca 0.30 -0.73 0.10 0.00 0.82 0.00 0.00 66.70 67.19 2oac h VAL 92 Cb 0.34 0.99 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 2oac h VAL 92 CO -0.10 0.13 0.61 -1.13 0.02 0.00 0.00 177.57 177.10 2oac h ASN 93 N -0.84 0.89 -0.94 0.57 -1.24 -0.16 -0.23 115.58 113.63 2oac h ASN 93 Ca -0.04 0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.00 2oac h ASN 93 Cb 0.52 -0.16 -0.05 0.00 0.73 0.00 0.00 38.32 39.37 2oac h ASN 93 CO 0.07 0.51 0.58 0.44 -1.29 0.00 0.00 177.43 177.74 2oac h ASP 94 N 0.98 1.12 -0.25 1.15 5.19 -0.83 0.12 116.42 123.90 2oac h ASP 94 Ca 0.45 -0.06 -0.12 0.00 -0.62 0.00 0.00 57.03 56.67 2oac h ASP 94 Cb 0.39 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.61 2oac h ASP 94 CO -0.20 0.84 -0.28 1.23 -3.12 0.00 0.00 179.24 177.71 2oac h GLY 95 N 1.29 0.81 0.98 2.75 0.00 -0.89 -1.58 103.07 106.43 2oac h GLY 95 Ca 0.34 -0.73 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 2oac h GLY 95 CO -0.07 0.67 0.23 -2.08 0.00 0.00 0.00 176.54 175.29 2oac h VAL 96 N 0.64 1.22 -0.41 4.60 2.07 -0.57 -2.60 116.25 121.19 2oac h VAL 96 Ca 0.08 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 66.85 2oac h VAL 96 Cb 0.80 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2oac h VAL 96 CO 0.07 0.25 -0.13 -0.08 0.02 0.00 0.00 177.57 177.70 2oac h GLU 97 N 0.74 0.74 -0.23 1.57 4.57 -0.81 -0.48 114.58 120.68 2oac h GLU 97 Ca 0.18 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 2oac h GLU 97 Cb 0.18 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 2oac h GLU 97 CO -0.02 0.84 0.10 -0.44 -1.18 0.00 0.00 179.01 178.32 2oac h ASP 98 N 0.67 0.31 -0.58 1.04 3.32 -1.08 -0.44 116.42 119.65 2oac h ASP 98 Ca 0.11 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.94 2oac h ASP 98 Cb 0.60 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 2oac h ASP 98 CO 0.04 0.37 0.06 0.25 -1.72 0.00 0.00 179.24 178.24 2oac h LEU 99 N 0.24 0.98 -1.12 1.55 5.85 -1.36 -2.67 115.31 118.77 2oac h LEU 99 Ca 0.08 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 2oac h LEU 99 Cb 0.14 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 2oac h LEU 99 CO -0.01 1.00 0.38 -0.09 -0.34 0.00 0.00 178.44 179.37 2oac h ARG 100 N 0.95 0.99 -0.87 1.25 2.43 -0.71 -0.93 114.38 117.49 2oac h ARG 100 Ca 0.18 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2oac h ARG 100 Cb 0.46 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 2oac h ARG 100 CO 0.02 0.73 0.51 0.78 -1.51 0.00 0.00 179.97 180.50 2oac h GLY 101 N 1.04 1.27 1.19 2.80 0.00 -0.75 -0.75 103.07 107.87 2oac h GLY 101 Ca 0.25 -0.54 -0.17 0.00 0.00 0.00 0.00 47.33 46.88 2oac h GLY 101 CO -0.04 0.52 -0.46 0.50 0.00 0.00 0.00 176.54 177.06 2oac h LYS 102 N 1.20 0.87 -0.14 4.80 1.57 -1.19 -2.26 116.57 121.42 2oac h LYS 102 Ca 0.31 -0.49 0.03 0.00 -1.87 0.00 0.00 60.65 58.62 2oac h LYS 102 Cb -0.03 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 2oac h LYS 102 CO -0.06 1.14 -0.04 -0.92 -0.57 0.00 0.00 179.45 179.00 2oac h TYR 103 N 0.69 -0.08 -0.45 -1.35 3.20 -0.63 -1.55 116.97 116.80 2oac h TYR 103 Ca 0.04 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.95 2oac h TYR 103 Cb 1.05 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.34 2oac h TYR 103 CO 0.06 -0.06 0.24 0.28 -1.64 0.00 0.00 178.16 177.05 2oac h VAL 104 N -0.00 1.01 -0.54 1.81 2.07 -1.05 0.38 116.25 119.92 2oac h VAL 104 Ca 0.07 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.45 2oac h VAL 104 Cb 0.11 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 2oac h VAL 104 CO -0.15 0.09 0.32 0.74 0.02 0.00 0.00 177.57 178.59 2oac h THR 105 N 0.49 1.05 0.92 2.57 2.02 -1.15 -0.93 112.91 117.88 2oac h THR 105 Ca 0.19 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 2oac h THR 105 Cb 0.06 0.35 0.01 0.00 -1.74 0.00 0.00 68.15 66.83 2oac h THR 105 CO -0.11 0.12 -0.46 0.25 0.37 0.00 0.00 175.52 175.69 2oac h LEU 106 N 0.64 -1.11 -0.70 2.58 5.85 -0.73 0.41 115.31 122.26 2oac h LEU 106 Ca 0.22 0.04 0.13 0.00 0.84 0.00 0.00 57.88 59.12 2oac h LEU 106 Cb 0.03 0.29 -0.09 0.00 0.37 0.00 0.00 40.66 41.27 2oac h LEU 106 CO -0.10 -0.77 0.23 0.40 -0.34 0.00 0.00 178.44 177.86 2oac h ILE 107 N -1.26 0.64 0.00 4.05 1.08 -0.81 -0.82 117.51 120.40 2oac h ILE 107 Ca -0.12 -0.13 0.00 0.00 -0.39 0.00 0.00 64.86 64.22 2oac h ILE 107 Cb 0.97 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 34.97 2oac h ILE 107 CO 0.19 0.07 -1.29 -1.22 -0.69 0.00 0.00 178.15 175.21 2oac n TYR 108 N -5.06 0.30 -0.02 1.37 4.01 -0.37 -4.55 117.16 112.84 2oac n TYR 108 Ca 0.12 0.09 -0.03 0.00 -0.16 0.00 0.00 57.90 57.92 2oac n TYR 108 Cb 0.38 -0.52 -0.03 0.00 -0.31 0.00 0.00 39.34 38.86 2oac n TYR 108 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2oac n THR 109 N -2.14 0.30 -2.69 -0.72 -1.04 0.14 -4.93 114.28 103.20 2oac n THR 109 Ca 0.00 -0.15 -0.08 0.00 -2.04 0.00 0.00 64.05 61.79 2oac n THR 109 Cb 0.49 -0.79 0.09 0.00 -1.82 0.00 0.00 70.33 68.29 2oac n THR 109 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2oac n ASN 110 N -2.40 -0.78 0.14 8.00 5.15 -0.80 -4.98 115.26 119.58 2oac n ASN 110 Ca -0.08 -2.56 -0.13 0.00 -0.60 0.00 0.00 54.58 51.21 2oac n ASN 110 Cb 0.62 0.50 -0.06 0.00 -0.53 0.00 0.00 39.78 40.31 2oac n ASN 110 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2oac h TYR 111 N 2.35 -0.70 0.43 1.20 3.20 -1.41 0.25 116.97 122.29 2oac h TYR 111 Ca -0.22 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.65 2oac h TYR 111 Cb 1.26 0.28 -0.01 0.00 1.54 0.00 0.00 36.73 39.80 2oac h TYR 111 CO 0.26 -0.37 -0.38 0.93 -1.64 0.00 0.00 178.16 176.96 2oac h GLU 112 N -0.50 -0.76 0.00 1.82 3.07 -1.94 -1.52 114.58 114.74 2oac h GLU 112 Ca 0.02 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 2oac h GLU 112 Cb 0.50 0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 2oac h GLU 112 CO -0.11 -0.51 0.00 -0.91 -1.40 0.00 0.00 179.01 176.08 2oac h ASN 113 N -0.79 0.00 0.00 1.42 2.35 -1.97 -3.37 115.58 113.22 2oac h ASN 113 Ca -0.06 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.58 2oac h ASN 113 Cb 0.67 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.02 2oac h ASN 113 CO -0.02 0.00 -1.95 0.61 -1.65 0.00 0.00 177.43 174.42 2oac n GLY 114 N 0.68 -0.84 0.23 2.83 0.00 0.88 -4.64 105.19 104.33 2oac n GLY 114 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2oac n GLY 114 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2oac h LYS 115 N 0.00 0.15 -0.56 1.61 3.64 -1.38 -0.46 116.57 119.58 2oac h LYS 115 Ca -0.17 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2oac h LYS 115 Cb 1.28 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 33.00 2oac h LYS 115 CO 0.01 0.10 0.19 -2.95 -2.27 0.00 0.00 179.45 174.52 2oac h ASN 116 N 0.15 0.16 0.33 4.20 -1.07 -1.82 -0.71 115.58 116.83 2oac h ASN 116 Ca 0.31 0.08 -0.12 0.00 0.07 0.00 0.00 56.30 56.63 2oac h ASN 116 Cb 0.49 0.07 -0.01 0.00 -2.07 0.00 0.00 38.32 36.80 2oac h ASN 116 CO -0.48 0.11 -0.51 0.44 0.07 0.00 0.00 177.43 177.06 2oac h ASP 117 N 0.35 0.22 0.11 6.14 3.45 -1.64 -3.02 116.42 122.04 2oac h ASP 117 Ca 0.28 -0.11 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 2oac h ASP 117 Cb 0.34 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 39.05 2oac h ASP 117 CO -0.30 0.69 -0.05 0.22 -1.57 0.00 0.00 179.24 178.23 2oac h TYR 118 N 0.16 -0.14 -0.83 4.55 5.03 0.05 -2.09 116.97 123.69 2oac h TYR 118 Ca 0.01 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.34 2oac h TYR 118 Cb 0.95 0.05 -0.05 0.00 1.55 0.00 0.00 36.73 39.23 2oac h TYR 118 CO 0.01 0.19 0.55 0.28 -1.32 0.00 0.00 178.16 177.87 2oac h VAL 119 N -0.48 1.14 -0.11 1.81 2.07 -1.24 0.24 116.25 119.67 2oac h VAL 119 Ca -0.02 -0.35 -0.10 0.00 0.82 0.00 0.00 66.70 67.05 2oac h VAL 119 Cb 0.39 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 2oac h VAL 119 CO 0.02 0.19 -0.39 0.50 0.02 0.00 0.00 177.57 177.91 2oac h LYS 120 N 1.03 0.24 0.00 1.57 3.11 -1.47 -2.63 116.57 118.42 2oac h LYS 120 Ca 0.33 -0.11 0.00 0.00 -2.81 0.00 0.00 60.65 58.06 2oac h LYS 120 Cb 0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.25 2oac h LYS 120 CO -0.09 0.60 -0.55 0.00 -2.81 0.00 0.00 179.45 176.60 2oac n ALA 121 N -2.47 2.85 -0.23 5.00 0.00 -0.62 -4.30 120.51 120.74 2oac n ALA 121 Ca -0.01 -0.22 0.01 0.00 0.00 0.00 0.00 53.44 53.22 2oac n ALA 121 Cb 0.47 -1.21 0.13 0.00 0.00 0.00 0.00 19.45 18.84 2oac n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2oac h LEU 122 N 0.00 0.34 -0.66 0.00 5.85 -0.18 -2.99 115.31 117.67 2oac h LEU 122 Ca 0.00 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.89 2oac h LEU 122 Cb 0.74 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.72 2oac h LEU 122 CO 0.00 0.19 0.27 1.55 -0.34 0.00 0.00 178.44 180.12 2oac h PRO 123 N 0.50 0.45 0.00 5.25 0.13 -1.75 0.17 132.00 136.75 2oac h PRO 123 Ca 0.34 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 2oac h PRO 123 Cb 0.40 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.42 2oac h PRO 123 CO -0.30 0.30 0.00 0.78 -0.23 0.00 0.00 178.00 178.55 2oac h GLY 124 N 0.46 0.00 0.57 1.56 0.00 -1.82 -1.20 103.07 102.65 2oac h GLY 124 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 2oac h GLY 124 CO -0.32 0.00 -0.90 1.42 0.00 0.00 0.00 176.54 176.74 2oac n HIS 125 N -2.39 0.14 -0.08 5.60 8.25 0.48 -4.20 115.22 123.03 2oac n HIS 125 Ca 0.01 0.04 -0.09 0.00 -0.26 0.00 0.00 57.72 57.42 2oac n HIS 125 Cb 0.18 -0.30 -0.15 0.00 1.12 0.00 0.00 29.99 30.84 2oac n HIS 125 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2oac n LEU 126 N -1.76 0.21 -0.28 2.41 4.77 -0.57 -4.50 117.00 117.29 2oac n LEU 126 Ca 0.03 0.10 0.07 0.00 -0.03 0.00 0.00 56.01 56.18 2oac n LEU 126 Cb 0.39 0.41 0.22 0.00 -2.33 0.00 0.00 43.42 42.11 2oac n LEU 126 CO 0.40 0.46 1.05 0.50 -1.33 0.00 0.00 177.39 178.46 2oac h LYS 127 N 0.00 0.48 -0.91 3.23 3.64 -1.43 -0.83 116.57 120.75 2oac h LYS 127 Ca -0.47 -0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.06 2oac h LYS 127 Cb 2.15 -0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 33.79 2oac h LYS 127 CO 0.04 0.31 0.59 -1.35 -2.27 0.00 0.00 179.45 176.77 2oac h PRO 128 N 0.49 0.52 0.00 1.90 0.11 -1.79 0.31 132.00 133.54 2oac h PRO 128 Ca 0.45 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.34 2oac h PRO 128 Cb 0.71 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.69 2oac h PRO 128 CO -0.41 0.34 -0.85 0.74 -0.21 0.00 0.00 178.00 177.61 2oac h PHE 129 N 0.54 0.21 -0.42 0.65 0.04 -1.44 -1.82 116.94 114.69 2oac h PHE 129 Ca 0.47 -0.11 -0.10 0.00 2.80 0.00 0.00 57.97 61.03 2oac h PHE 129 Cb 0.99 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 39.11 2oac h PHE 129 CO -0.00 0.92 -0.14 1.49 -0.60 0.00 0.00 178.31 179.98 2oac h GLU 130 N 0.08 0.84 -0.33 1.51 4.57 -0.63 -2.42 114.58 118.19 2oac h GLU 130 Ca -0.03 -0.34 -0.06 0.00 -1.18 0.00 0.00 59.36 57.75 2oac h GLU 130 Cb 1.48 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 30.01 2oac h GLU 130 CO 0.12 0.97 -0.03 1.15 -1.18 0.00 0.00 179.01 180.05 2oac h THR 131 N 0.66 1.21 -0.58 0.32 2.02 -0.38 -1.96 112.91 114.20 2oac h THR 131 Ca 0.10 -0.85 -0.11 0.00 0.77 0.00 0.00 66.41 66.32 2oac h THR 131 Cb 0.69 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 2oac h THR 131 CO 0.05 0.29 -0.05 -0.07 0.37 0.00 0.00 175.52 176.11 2oac h LEU 132 N 0.50 1.05 -0.32 2.58 3.38 -1.07 -2.63 115.31 118.80 2oac h LEU 132 Ca 0.10 -0.33 -0.07 0.00 0.09 0.00 0.00 57.88 57.68 2oac h LEU 132 Cb 0.37 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2oac h LEU 132 CO 0.02 1.13 -0.06 -0.07 0.09 0.00 0.00 178.44 179.54 2oac h LEU 133 N 0.95 0.60 -1.42 1.67 3.38 -1.14 -2.99 115.31 116.36 2oac h LEU 133 Ca 0.16 -0.35 0.06 0.00 0.09 0.00 0.00 57.88 57.84 2oac h LEU 133 Cb 0.62 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 2oac h LEU 133 CO 0.04 0.81 0.45 0.77 0.09 0.00 0.00 178.44 180.61 2oac h SER 134 N 0.38 0.63 -0.04 -0.43 4.64 -1.28 0.22 113.55 117.66 2oac h SER 134 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2oac h SER 134 Cb 0.54 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2oac h SER 134 CO 0.03 0.41 0.00 0.00 -0.87 0.00 0.00 176.83 176.40 2oac n GLN 135 N -4.48 1.14 -3.65 4.77 6.02 -1.00 -3.63 117.38 116.55 2oac n GLN 135 Ca 0.10 -0.22 -0.29 0.00 -0.01 0.00 0.00 57.00 56.58 2oac n GLN 135 Cb 0.22 -1.27 -0.12 0.00 1.02 0.00 0.00 30.24 30.09 2oac n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2oac s ASN 136 N -1.48 3.33 -1.35 1.08 2.47 0.60 -4.87 114.94 114.72 2oac s ASN 136 Ca 0.25 -2.82 -0.05 0.00 0.42 0.00 0.00 52.86 50.65 2oac s ASN 136 Cb 0.12 -0.94 0.02 0.00 -1.45 0.00 0.00 41.25 39.00 2oac s ASN 136 CO 0.19 -0.23 0.94 0.00 -3.72 0.00 0.00 177.10 174.28 2oac n GLN 137 N 3.26 -6.12 -1.09 0.43 6.02 -1.26 -1.58 117.38 117.05 2oac n GLN 137 Ca 0.14 0.71 -0.05 0.00 -0.01 0.00 0.00 57.00 57.79 2oac n GLN 137 Cb 0.37 -5.56 -0.02 0.00 1.02 0.00 0.00 30.24 26.05 2oac n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oac n GLY 138 N -1.60 0.52 1.76 1.08 0.00 -1.24 -1.46 105.19 104.25 2oac n GLY 138 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2oac n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oac n GLY 139 N 0.55 0.51 0.09 -0.02 0.00 -0.14 -4.70 105.19 101.48 2oac n GLY 139 Ca -0.05 -0.88 -0.04 0.00 0.00 0.00 0.00 46.02 45.05 2oac n GLY 139 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oac h LYS 140 N 0.00 0.00 0.00 1.61 1.57 -1.37 -3.45 116.57 114.93 2oac h LYS 140 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2oac h LYS 140 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2oac h LYS 140 CO 0.00 0.44 0.00 0.00 -0.57 0.00 0.00 179.45 179.32 2oac n ALA 141 N -2.44 0.00 -4.10 3.86 0.00 -1.26 -5.09 120.51 111.47 2oac n ALA 141 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.11 2oac n ALA 141 Cb 0.92 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.35 2oac n ALA 141 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2oac n PHE 142 N 0.00 -0.13 -0.20 0.00 3.72 -1.01 -5.02 117.46 114.82 2oac n PHE 142 Ca 0.00 -1.78 -0.01 0.00 -0.05 0.00 0.00 57.45 55.62 2oac n PHE 142 Cb 0.00 -0.30 0.22 0.00 -0.94 0.00 0.00 39.48 38.46 2oac n PHE 142 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 2oac h ILE 143 N 0.86 1.21 -3.12 4.37 -0.00 -1.96 -3.39 117.51 115.48 2oac h ILE 143 Ca -0.28 -0.49 -0.45 0.00 -0.00 0.00 0.00 64.86 63.64 2oac h ILE 143 Cb 0.94 0.23 -0.40 0.00 -0.00 0.00 0.00 36.82 37.59 2oac h ILE 143 CO 0.45 0.22 -0.75 -0.69 -0.00 0.00 0.00 178.15 177.38 2oac s VAL 144 N -5.69 -0.00 0.00 2.19 1.01 -1.26 -4.67 120.40 111.98 2oac s VAL 144 Ca -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.76 2oac s VAL 144 Cb 0.17 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.99 2oac s VAL 144 CO 0.79 -0.19 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2oac n GLY 145 N 5.25 -1.65 0.13 4.51 0.00 -1.26 -4.52 105.19 107.65 2oac n GLY 145 Ca -0.07 -1.55 0.04 0.00 0.00 0.00 0.00 46.02 44.44 2oac n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oac n ASP 146 N 0.01 2.30 -4.14 1.61 3.85 -1.26 -2.41 116.55 116.51 2oac n ASP 146 Ca 0.00 -2.41 -0.24 0.00 -0.71 0.00 0.00 54.79 51.43 2oac n ASP 146 Cb 0.00 -0.19 -0.15 0.00 -1.35 0.00 0.00 41.12 39.43 2oac n ASP 146 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2oac s GLN 147 N -1.71 1.44 0.23 0.11 1.03 -1.26 -4.80 119.66 114.69 2oac s GLN 147 Ca 0.15 -0.58 -0.31 0.00 0.04 0.00 0.00 55.36 54.65 2oac s GLN 147 Cb 0.12 -1.35 -0.14 0.00 0.03 0.00 0.00 33.01 31.68 2oac s GLN 147 CO 0.03 0.32 1.37 1.51 -2.54 0.00 0.00 175.29 175.98 2oac n ILE 148 N 2.82 0.94 -4.35 3.63 0.00 -1.26 -4.88 119.36 116.27 2oac n ILE 148 Ca -0.16 -0.23 -0.18 0.00 0.00 0.00 0.00 62.75 62.18 2oac n ILE 148 Cb 0.54 -1.38 -0.10 0.00 0.00 0.00 0.00 39.64 38.69 2oac n ILE 148 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2oac s SER 149 N 0.25 1.86 0.58 9.51 1.04 -1.26 -4.64 113.70 121.05 2oac s SER 149 Ca 0.69 -1.26 0.28 0.00 0.48 0.00 0.00 55.95 56.14 2oac s SER 149 Cb -0.68 0.01 1.68 0.00 0.10 0.00 0.00 66.02 67.13 2oac s SER 149 CO 0.50 -0.55 2.15 2.19 0.98 0.00 0.00 173.24 178.52 2oac h PHE 150 N 2.40 0.00 -0.05 5.02 -0.00 -1.71 -0.11 116.94 122.48 2oac h PHE 150 Ca -0.39 0.00 -0.11 0.00 -0.00 0.00 0.00 57.97 57.48 2oac h PHE 150 Cb 1.23 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 37.17 2oac h PHE 150 CO 0.57 0.00 -0.46 0.00 -0.00 0.00 0.00 178.31 178.42 2oac h ALA 151 N 1.86 1.13 -0.09 12.09 0.00 -1.87 -2.78 119.26 129.60 2oac h ALA 151 Ca 0.06 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 2oac h ALA 151 Cb 0.30 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2oac h ALA 151 CO -0.00 0.61 -0.02 -0.44 0.00 0.00 0.00 179.25 179.39 2oac h ASP 152 N 0.10 0.18 -1.01 0.00 3.32 -1.41 -1.62 116.42 115.99 2oac h ASP 152 Ca 0.01 -0.37 0.09 0.00 0.02 0.00 0.00 57.03 56.77 2oac h ASP 152 Cb 0.86 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 40.28 2oac h ASP 152 CO 0.07 0.52 0.64 1.88 -1.72 0.00 0.00 179.24 180.63 2oac h TYR 153 N -0.15 1.18 -0.17 4.55 0.05 -1.46 0.48 116.97 121.45 2oac h TYR 153 Ca 0.02 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.76 2oac h TYR 153 Cb 0.44 -0.38 -0.00 0.00 1.01 0.00 0.00 36.73 37.79 2oac h TYR 153 CO 0.05 0.56 -0.20 -0.97 -1.05 0.00 0.00 178.16 176.55 2oac h ASN 154 N 1.11 0.47 -0.27 3.88 -0.00 -1.43 -1.85 115.58 117.48 2oac h ASN 154 Ca 0.46 -0.50 -0.01 0.00 -0.00 0.00 0.00 56.30 56.25 2oac h ASN 154 Cb 0.30 -0.13 -0.01 0.00 -0.00 0.00 0.00 38.32 38.48 2oac h ASN 154 CO -0.21 0.87 0.12 0.25 -0.00 0.00 0.00 177.43 178.46 2oac h LEU 155 N 0.07 0.36 -0.09 0.34 5.85 -0.74 -0.53 115.31 120.57 2oac h LEU 155 Ca 0.02 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.63 2oac h LEU 155 Cb 0.75 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 2oac h LEU 155 CO 0.05 0.40 -0.09 0.25 -0.34 0.00 0.00 178.44 178.70 2oac h LEU 156 N 0.30 -0.29 -0.92 2.25 5.85 -0.08 0.64 115.31 123.06 2oac h LEU 156 Ca 0.09 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2oac h LEU 156 Cb 0.14 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 2oac h LEU 156 CO -0.01 -0.13 0.59 -0.78 -0.34 0.00 0.00 178.44 177.78 2oac h ASP 157 N -0.12 0.99 -0.61 1.25 3.58 -1.14 -0.44 116.42 119.93 2oac h ASP 157 Ca 0.07 -0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.44 2oac h ASP 157 Cb 0.21 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 2oac h ASP 157 CO -0.16 0.68 0.10 0.25 -2.88 0.00 0.00 179.24 177.23 2oac h LEU 158 N 1.15 0.99 -0.35 2.28 5.85 -0.37 -2.65 115.31 122.22 2oac h LEU 158 Ca 0.36 -0.23 -0.17 0.00 0.84 0.00 0.00 57.88 58.68 2oac h LEU 158 Cb 0.00 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.77 2oac h LEU 158 CO -0.12 0.98 -0.47 -0.07 -0.34 0.00 0.00 178.44 178.43 2oac h LEU 159 N 0.98 0.99 -0.27 2.25 3.38 -0.29 -2.74 115.31 119.61 2oac h LEU 159 Ca 0.20 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.67 2oac h LEU 159 Cb 0.42 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2oac h LEU 159 CO 0.01 1.29 0.16 -0.07 0.09 0.00 0.00 178.44 179.93 2oac h LEU 160 N 0.72 0.32 -1.45 1.67 3.38 -0.93 -0.88 115.31 118.15 2oac h LEU 160 Ca 0.04 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2oac h LEU 160 Cb 1.07 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 2oac h LEU 160 CO 0.11 0.28 -0.24 0.16 0.09 0.00 0.00 178.44 178.84 2oac h ILE 161 N 0.34 0.78 0.00 1.22 3.07 -1.52 -2.37 117.51 119.02 2oac h ILE 161 Ca 0.10 -0.97 -0.17 0.00 1.55 0.00 0.00 64.86 65.36 2oac h ILE 161 Cb 0.01 1.60 -0.02 0.00 -0.27 0.00 0.00 36.82 38.13 2oac h ILE 161 CO -0.02 0.23 -0.80 0.45 -1.05 0.00 0.00 178.15 176.97 2oac h HIS 162 N 0.00 0.00 0.00 0.16 3.86 -1.08 -1.96 115.15 116.14 2oac h HIS 162 Ca -0.00 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 2oac h HIS 162 Cb 0.58 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.04 2oac h HIS 162 CO 0.00 0.80 -0.28 1.96 0.86 0.00 0.00 177.93 181.27 2oac h GLN 163 N 0.00 0.00 0.08 2.45 4.20 -0.66 0.26 115.11 121.43 2oac h GLN 163 Ca -0.01 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.42 2oac h GLN 163 Cb 1.42 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.22 2oac h GLN 163 CO 0.10 0.28 -1.16 0.28 -0.67 0.00 0.00 178.83 177.67 2oac h VAL 164 N 0.00 1.30 -0.11 -0.54 2.07 -1.28 -1.75 116.25 115.95 2oac h VAL 164 Ca -0.00 -2.43 -0.15 0.00 0.82 0.00 0.00 66.70 64.94 2oac h VAL 164 Cb 0.59 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 2oac h VAL 164 CO 0.04 0.74 -0.57 0.25 0.02 0.00 0.00 177.57 178.05 2oac h LEU 165 N 0.30 0.38 -6.18 2.57 7.12 -0.85 -3.39 115.31 115.25 2oac h LEU 165 Ca -0.16 -0.21 -0.36 0.00 0.13 0.00 0.00 57.88 57.28 2oac h LEU 165 Cb 1.83 -0.11 -0.30 0.00 -0.53 0.00 0.00 40.66 41.55 2oac h LEU 165 CO 0.22 0.87 -0.70 0.00 -0.13 0.00 0.00 178.44 178.70 2oac s ALA 166 N -3.87 -0.45 0.18 1.25 0.00 0.86 -5.06 121.76 114.68 2oac s ALA 166 Ca -0.05 -1.09 0.05 0.00 0.00 0.00 0.00 51.96 50.87 2oac s ALA 166 Cb 0.12 -2.10 0.53 0.00 0.00 0.00 0.00 23.12 21.66 2oac s ALA 166 CO 0.81 -2.14 0.87 -2.30 0.00 0.00 0.00 175.76 173.00 2oac n PRO 167 N 3.87 -0.04 -1.87 0.00 -0.02 -0.66 -1.38 135.00 134.91 2oac n PRO 167 Ca 0.15 0.81 -0.32 0.00 -2.02 0.00 0.00 63.50 62.12 2oac n PRO 167 Cb 0.47 -1.34 0.04 0.00 -0.02 0.00 0.00 33.50 32.66 2oac n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oac n GLY 168 N -1.23 5.97 0.08 -1.23 0.00 -1.26 -4.67 105.19 102.84 2oac n GLY 168 Ca 0.16 -2.53 0.13 0.00 0.00 0.00 0.00 46.02 43.77 2oac n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oac n LEU 170 N -2.07 2.60 -0.21 0.00 4.77 -1.26 -4.61 117.00 116.22 2oac n LEU 170 Ca 0.06 -1.50 0.04 0.00 -0.03 0.00 0.00 56.01 54.57 2oac n LEU 170 Cb 0.41 -0.14 0.30 0.00 -2.33 0.00 0.00 43.42 41.66 2oac n LEU 170 CO 0.30 0.58 1.23 0.44 -1.33 0.00 0.00 177.39 178.61 2oac h ASP 171 N 2.50 0.77 -0.49 -1.43 5.19 -1.91 -0.82 116.42 120.24 2oac h ASP 171 Ca 0.00 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 2oac h ASP 171 Cb 0.66 -0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.00 2oac h ASP 171 CO 0.00 0.52 0.00 0.59 -3.12 0.00 0.00 179.24 177.23 2oac n ASN 172 N -4.46 2.95 -3.60 6.45 5.03 -1.26 -4.51 115.26 115.86 2oac n ASN 172 Ca 0.10 -2.11 -0.27 0.00 0.87 0.00 0.00 54.58 53.17 2oac n ASN 172 Cb 0.14 -0.38 -0.10 0.00 -1.02 0.00 0.00 39.78 38.41 2oac n ASN 172 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2oac n PHE 173 N 0.88 1.78 -0.15 3.10 3.72 -0.31 -4.99 117.46 121.49 2oac n PHE 173 Ca 0.17 -3.93 -0.12 0.00 -0.05 0.00 0.00 57.45 53.53 2oac n PHE 173 Cb 0.50 -0.34 -0.09 0.00 -0.94 0.00 0.00 39.48 38.62 2oac n PHE 173 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 2oac h PRO 174 N 5.07 -0.30 -0.57 -1.08 0.11 -1.79 0.34 132.00 133.78 2oac h PRO 174 Ca 0.18 0.02 0.11 0.00 0.11 0.00 0.00 66.00 66.42 2oac h PRO 174 Cb 0.79 0.07 -0.09 0.00 0.11 0.00 0.00 31.00 31.88 2oac h PRO 174 CO 0.62 -0.20 0.08 -0.07 -0.21 0.00 0.00 178.00 178.22 2oac h LEU 175 N -0.31 -0.09 -0.82 2.35 3.38 -1.93 -1.13 115.31 116.77 2oac h LEU 175 Ca 0.07 0.12 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 2oac h LEU 175 Cb 0.50 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 2oac h LEU 175 CO -0.56 -0.03 -0.04 -0.07 0.09 0.00 0.00 178.44 177.84 2oac h LEU 176 N 0.20 0.82 0.78 1.67 3.38 -1.78 0.62 115.31 121.00 2oac h LEU 176 Ca 0.30 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2oac h LEU 176 Cb 0.45 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.98 2oac h LEU 176 CO -0.42 0.91 -0.38 0.28 0.09 0.00 0.00 178.44 178.93 2oac h SER 177 N 0.78 -0.89 -0.77 -0.43 0.02 0.12 0.59 113.55 112.96 2oac h SER 177 Ca 0.14 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2oac h SER 177 Cb 0.52 0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.26 2oac h SER 177 CO 0.03 -0.63 0.47 0.00 -1.14 0.00 0.00 176.83 175.55 2oac h ALA 178 N -0.81 0.98 -0.55 3.77 0.00 -1.24 -1.03 119.26 120.39 2oac h ALA 178 Ca -0.11 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 54.81 2oac h ALA 178 Cb 0.80 -0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.21 2oac h ALA 178 CO 0.17 0.45 0.13 -0.92 0.00 0.00 0.00 179.25 179.09 2oac h TYR 179 N 1.06 0.22 -0.01 0.00 3.20 -0.66 0.29 116.97 121.06 2oac h TYR 179 Ca 0.28 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.18 2oac h TYR 179 Cb -0.04 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.22 2oac h TYR 179 CO -0.01 0.01 0.00 0.28 -1.64 0.00 0.00 178.16 176.80 2oac h VAL 180 N 0.28 1.19 -0.96 1.81 2.07 -0.21 -2.21 116.25 118.22 2oac h VAL 180 Ca 0.28 -0.58 0.04 0.00 0.82 0.00 0.00 66.70 67.26 2oac h VAL 180 Cb 0.38 1.57 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 2oac h VAL 180 CO -0.34 0.15 0.63 0.00 0.02 0.00 0.00 177.57 178.03 2oac h ALA 181 N 0.76 1.39 0.67 1.67 0.00 -0.65 -2.28 119.26 120.82 2oac h ALA 181 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2oac h ALA 181 Cb 0.24 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 17.71 2oac h ALA 181 CO 0.00 0.51 -0.32 -0.09 0.00 0.00 0.00 179.25 179.35 2oac h ARG 182 N 1.20 -0.86 -0.78 0.00 2.43 -0.33 -2.41 114.38 113.63 2oac h ARG 182 Ca 0.39 0.06 0.15 0.00 -0.81 0.00 0.00 59.98 59.76 2oac h ARG 182 Cb 0.03 0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 29.72 2oac h ARG 182 CO -0.12 -0.57 0.52 -0.07 -1.51 0.00 0.00 179.97 178.21 2oac h LEU 183 N -1.10 0.44 -1.18 3.80 4.07 -1.40 0.21 115.31 120.15 2oac h LEU 183 Ca -0.09 0.03 -0.09 0.00 0.08 0.00 0.00 57.88 57.81 2oac h LEU 183 Cb 0.68 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 2oac h LEU 183 CO 0.15 0.23 -0.39 0.28 -1.08 0.00 0.00 178.44 177.63 2oac h SER 184 N 0.47 0.03 0.57 -0.43 0.02 -1.40 -2.68 113.55 110.14 2oac h SER 184 Ca 0.38 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.27 2oac h SER 184 Cb 0.81 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 2oac h SER 184 CO -0.13 0.42 -0.27 0.00 -1.14 0.00 0.00 176.83 175.71 2oac h ALA 185 N 1.58 1.19 -1.54 3.77 0.00 -0.06 -2.46 119.26 121.75 2oac h ALA 185 Ca -0.00 -0.24 -0.72 0.00 0.00 0.00 0.00 54.91 53.94 2oac h ALA 185 Cb 0.71 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.49 2oac h ALA 185 CO 0.05 0.33 0.63 0.54 0.00 0.00 0.00 179.25 180.81 2oac n ARG 186 N -3.69 1.02 -0.03 0.00 1.74 -1.01 -4.59 116.66 110.10 2oac n ARG 186 Ca -0.01 0.37 -0.01 0.00 -0.77 0.00 0.00 57.85 57.43 2oac n ARG 186 Cb 0.38 -2.02 -0.01 0.00 -1.02 0.00 0.00 32.46 29.80 2oac n ARG 186 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2oac n PRO 187 N 3.77 -0.03 0.26 5.56 -0.02 -1.26 -0.10 135.00 143.18 2oac n PRO 187 Ca 0.23 0.68 0.17 0.00 -2.02 0.00 0.00 63.50 62.55 2oac n PRO 187 Cb 0.14 -1.01 0.75 0.00 -0.02 0.00 0.00 33.50 33.36 2oac n PRO 187 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2oac h LYS 188 N 0.00 0.00 0.05 -0.52 1.57 -1.91 -1.40 116.57 114.36 2oac h LYS 188 Ca 0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2oac h LYS 188 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 2oac h LYS 188 CO -0.06 0.00 -0.02 0.82 -0.57 0.00 0.00 179.45 179.61 2oac h ILE 189 N 0.00 0.84 -0.99 1.86 1.08 -1.20 -1.85 117.51 117.24 2oac h ILE 189 Ca 0.00 -1.50 0.15 0.00 -0.39 0.00 0.00 64.86 63.12 2oac h ILE 189 Cb 0.38 1.54 -0.09 0.00 -3.07 0.00 0.00 36.82 35.58 2oac h ILE 189 CO 0.00 0.27 0.62 0.50 -0.69 0.00 0.00 178.15 178.85 2oac h LYS 190 N -0.97 0.85 -0.47 2.37 3.64 -0.00 0.33 116.57 122.31 2oac h LYS 190 Ca -0.01 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.20 2oac h LYS 190 Cb 0.49 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2oac h LYS 190 CO 0.01 0.56 -0.19 0.00 -2.27 0.00 0.00 179.45 177.56 2oac h ALA 191 N 1.59 0.76 -0.50 5.00 0.00 -1.33 -2.80 119.26 121.97 2oac h ALA 191 Ca 0.52 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2oac h ALA 191 Cb 0.68 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2oac h ALA 191 CO -0.30 0.66 -0.02 0.35 0.00 0.00 0.00 179.25 179.95 2oac h PHE 192 N 0.82 0.98 0.00 0.00 3.57 0.07 -1.95 116.94 120.44 2oac h PHE 192 Ca 0.11 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.44 2oac h PHE 192 Cb 0.75 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.24 2oac h PHE 192 CO 0.05 0.92 0.00 1.28 -2.23 0.00 0.00 178.31 178.33 2oac n LEU 193 N -4.30 0.61 -0.03 0.59 4.77 0.89 -2.52 117.00 117.01 2oac n LEU 193 Ca 0.01 0.71 0.05 0.00 -0.03 0.00 0.00 56.01 56.75 2oac n LEU 193 Cb 0.33 -0.69 -0.05 0.00 -2.33 0.00 0.00 43.42 40.67 2oac n LEU 193 CO 0.43 -0.74 0.00 -1.54 -1.33 0.00 0.00 177.39 174.21 2oac n SER 194 N -2.23 0.61 -4.76 -1.43 3.41 -0.98 -4.65 113.62 103.59 2oac n SER 194 Ca 0.00 -0.81 -0.38 0.00 -0.26 0.00 0.00 58.87 57.43 2oac n SER 194 Cb 0.14 0.94 0.02 0.00 -0.26 0.00 0.00 64.21 65.04 2oac n SER 194 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2oac s SER 195 N -1.97 5.72 0.37 4.04 1.04 -0.77 -4.77 113.70 117.36 2oac s SER 195 Ca 0.05 2.62 0.05 0.00 0.48 0.00 0.00 55.95 59.15 2oac s SER 195 Cb 0.08 -2.63 0.74 0.00 0.10 0.00 0.00 66.02 64.32 2oac s SER 195 CO 0.43 -1.25 2.00 1.55 0.98 0.00 0.00 173.24 176.95 2oac h PRO 196 N 1.85 0.71 -0.21 4.02 0.13 -1.92 0.81 132.00 137.40 2oac h PRO 196 Ca -0.50 -0.04 0.05 0.00 -0.87 0.00 0.00 66.00 64.64 2oac h PRO 196 Cb 1.27 -0.16 -0.06 0.00 0.13 0.00 0.00 31.00 32.19 2oac h PRO 196 CO 0.59 0.47 -0.17 0.93 -0.23 0.00 0.00 178.00 179.59 2oac h GLU 197 N 0.73 -0.17 0.43 0.86 4.39 -1.93 0.08 114.58 118.97 2oac h GLU 197 Ca 0.24 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.93 2oac h GLU 197 Cb 0.05 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2oac h GLU 197 CO -0.06 -0.11 -0.20 1.25 -1.16 0.00 0.00 179.01 178.72 2oac h HIS 198 N -0.17 -0.53 -0.72 4.33 -0.00 -1.69 -3.09 115.15 113.28 2oac h HIS 198 Ca 0.12 -0.01 0.16 0.00 -0.00 0.00 0.00 60.37 60.64 2oac h HIS 198 Cb 0.36 0.18 -0.12 0.00 -0.00 0.00 0.00 27.41 27.83 2oac h HIS 198 CO -0.32 -0.27 0.08 0.28 -0.00 0.00 0.00 177.93 177.70 2oac h VAL 199 N -1.10 0.44 0.00 5.26 2.07 -0.82 -1.56 116.25 120.54 2oac h VAL 199 Ca -0.06 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 2oac h VAL 199 Cb 0.50 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2oac h VAL 199 CO 0.10 0.03 -0.20 0.78 0.02 0.00 0.00 177.57 178.30 2oac h ASN 200 N 0.17 0.00 -3.04 0.57 -0.26 -1.11 -3.44 115.58 108.48 2oac h ASN 200 Ca 0.40 0.00 -0.56 0.00 -0.56 0.00 0.00 56.30 55.57 2oac h ASN 200 Cb 0.68 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.91 2oac h ASN 200 CO -0.57 0.20 0.78 -0.60 -1.06 0.00 0.00 177.43 176.17 2oac s ARG 201 N -3.41 4.30 0.53 0.81 3.52 -0.59 -5.01 118.95 119.11 2oac s ARG 201 Ca 0.03 1.59 -0.21 0.00 -0.13 0.00 0.00 55.73 57.01 2oac s ARG 201 Cb 0.08 -3.65 -0.05 0.00 -1.56 0.00 0.00 34.95 29.77 2oac s ARG 201 CO 0.65 -0.56 1.23 -1.25 -0.81 0.00 0.00 175.30 174.56 2oac s PRO 202 N 2.83 3.32 0.16 5.12 0.04 -1.26 -4.70 135.00 140.51 2oac s PRO 202 Ca 0.53 1.91 -0.13 0.00 0.04 0.00 0.00 61.00 63.34 2oac s PRO 202 Cb -0.21 -2.19 0.05 0.00 0.04 0.00 0.00 34.50 32.19 2oac s PRO 202 CO 0.16 -0.95 1.72 0.82 0.04 0.00 0.00 177.00 178.80 2oac h ILE 203 N 1.41 1.22 -2.20 0.56 2.04 -1.94 0.32 117.51 118.92 2oac h ILE 203 Ca -0.50 -0.67 -0.55 0.00 1.00 0.00 0.00 64.86 64.14 2oac h ILE 203 Cb 1.28 0.65 -0.13 0.00 -0.74 0.00 0.00 36.82 37.87 2oac h ILE 203 CO 0.58 0.26 -0.57 0.20 0.00 0.00 0.00 178.15 178.61 2oac s ASN 204 N -6.02 3.01 0.00 1.72 0.02 -1.26 -1.03 114.94 111.38 2oac s ASN 204 Ca -0.13 -1.49 0.17 0.00 -1.02 0.00 0.00 52.86 50.39 2oac s ASN 204 Cb 0.12 0.10 0.51 0.00 0.02 0.00 0.00 41.25 42.00 2oac s ASN 204 CO 0.78 -0.70 1.41 0.61 0.02 0.00 0.00 177.10 179.22 2oac n GLY 205 N -0.88 0.99 0.01 0.66 0.00 -1.26 -4.06 105.19 100.65 2oac n GLY 205 Ca -0.06 -0.51 0.01 0.00 0.00 0.00 0.00 46.02 45.46 2oac n GLY 205 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2oac n ASN 206 N 0.79 1.97 -0.36 1.61 2.04 -1.26 -4.99 115.26 115.06 2oac n ASN 206 Ca 0.16 -2.13 -0.05 0.00 -0.44 0.00 0.00 54.58 52.13 2oac n ASN 206 Cb 0.40 -0.06 -0.02 0.00 -2.53 0.00 0.00 39.78 37.57 2oac n ASN 206 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2oac n GLY 207 N -0.62 0.71 3.52 4.83 0.00 -1.26 -5.01 105.19 107.37 2oac n GLY 207 Ca 0.02 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 2oac n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oac s LYS 208 N -1.90 2.39 0.00 1.61 1.02 -1.26 -5.07 119.74 116.54 2oac s LYS 208 Ca 0.00 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.20 2oac s LYS 208 Cb 0.00 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 2oac s LYS 208 CO 0.00 0.59 0.00 0.00 -0.92 0.00 0.00 175.35 175.02