#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9r n ARG 3 N 0.00 -0.01 0.00 1.61 -4.01 -1.26 -4.62 116.66 108.37 2x9r n ARG 3 Ca 0.00 0.01 0.00 0.00 -1.04 0.00 0.00 57.85 56.82 2x9r n ARG 3 Cb 0.00 -0.09 0.00 0.00 -3.04 0.00 0.00 32.46 29.33 2x9r n ARG 3 CO 0.00 0.00 0.00 0.98 -3.04 0.00 0.00 177.63 175.57 2x9r n TYR 4 N 1.57 0.00 -0.81 2.89 9.36 -1.26 -4.91 117.16 124.00 2x9r n TYR 4 Ca 0.00 0.00 0.07 0.00 3.32 0.00 0.00 57.90 61.29 2x9r n TYR 4 Cb 0.00 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 38.67 2x9r n TYR 4 CO 0.00 0.00 0.00 -0.89 0.22 0.00 0.00 176.86 176.19 2x9r n ILE 5 N -0.19 -0.78 0.00 2.97 5.41 -1.26 -5.06 119.36 120.44 2x9r n ILE 5 Ca 0.00 0.59 0.00 0.00 1.00 0.00 0.00 62.75 64.34 2x9r n ILE 5 Cb 0.00 -0.92 0.00 0.00 -0.71 0.00 0.00 39.64 38.01 2x9r n ILE 5 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2x9r n GLY 6 N -3.00 0.67 2.14 7.39 0.00 -1.26 -4.92 105.19 106.20 2x9r n GLY 6 Ca -0.04 -1.93 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 2x9r n GLY 6 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2x9r n PRO 7 N 1.01 0.00 -0.08 1.61 -0.02 -1.26 -4.83 135.00 131.43 2x9r n PRO 7 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 63.50 61.26 2x9r n PRO 7 Cb 0.00 -0.97 -0.12 0.00 -0.02 0.00 0.00 33.50 32.39 2x9r n PRO 7 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2x9r n VAL 8 N 4.34 1.60 -1.69 -1.45 0.24 -1.26 -4.40 118.33 115.71 2x9r n VAL 8 Ca 0.37 -0.45 -0.42 0.00 -2.04 0.00 0.00 64.34 61.80 2x9r n VAL 8 Cb -0.02 -1.73 -0.02 0.00 -1.47 0.00 0.00 33.84 30.60 2x9r n VAL 8 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x9r n ARG 10 N 6.72 0.49 -0.07 0.00 0.63 -1.26 -4.78 116.66 118.39 2x9r n ARG 10 Ca 0.51 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 57.41 2x9r n ARG 10 Cb 0.41 -0.04 -0.15 0.00 0.45 0.00 0.00 32.46 33.12 2x9r n ARG 10 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2x9r n LEU 11 N 0.00 0.00 -0.10 6.15 4.77 -0.10 -3.99 117.00 123.73 2x9r n LEU 11 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 2x9r n LEU 11 Cb 0.00 0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2x9r n LEU 11 CO 0.00 0.32 0.77 0.00 -1.33 0.00 0.00 177.39 177.15 2x9r n ARG 13 N -5.32 0.19 0.00 0.00 1.85 -1.26 0.28 116.66 112.41 2x9r n ARG 13 Ca 0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 2x9r n ARG 13 Cb 0.23 -0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.64 2x9r n ARG 13 CO 0.00 0.00 0.00 -2.13 -0.01 0.00 0.00 177.63 175.49 2x9r n ARG 14 N -1.00 0.00 0.11 2.89 3.00 -1.26 -3.35 116.66 117.05 2x9r n ARG 14 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 57.95 2x9r n ARG 14 Cb 0.00 0.00 0.45 0.00 0.00 0.00 0.00 32.46 32.91 2x9r n ARG 14 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2x9r n GLU 15 N 0.00 0.14 -3.04 -0.14 4.07 -1.21 -4.84 120.64 115.61 2x9r n GLU 15 Ca 0.00 0.47 -0.23 0.00 -0.06 0.00 0.00 57.16 57.34 2x9r n GLU 15 Cb 0.00 -1.82 0.04 0.00 -0.06 0.00 0.00 31.44 29.60 2x9r n GLU 15 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2x9r n GLY 16 N -0.49 -0.52 0.00 8.31 0.00 -1.21 -4.88 105.19 106.39 2x9r n GLY 16 Ca 0.01 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2x9r n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2x9r n VAL 17 N -4.52 0.05 -2.95 1.61 0.31 -0.91 -5.04 118.33 106.87 2x9r n VAL 17 Ca -0.11 -0.05 -0.01 0.00 -0.01 0.00 0.00 64.34 64.15 2x9r n VAL 17 Cb 0.62 1.18 -0.01 0.00 -0.91 0.00 0.00 33.84 34.72 2x9r n VAL 17 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2x9r n LYS 18 N -0.02 -2.12 -3.69 5.55 4.81 0.14 -4.91 118.16 117.92 2x9r n LYS 18 Ca 0.00 1.86 -0.36 0.00 -0.87 0.00 0.00 58.31 58.94 2x9r n LYS 18 Cb 0.43 -2.56 -0.07 0.00 0.02 0.00 0.00 35.03 32.86 2x9r n LYS 18 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2x9r s LEU 19 N -0.69 4.31 -0.20 3.14 1.02 -1.26 -4.95 118.68 120.05 2x9r s LEU 19 Ca -0.06 0.47 -0.06 0.00 0.02 0.00 0.00 54.13 54.50 2x9r s LEU 19 Cb 0.00 -2.23 -0.24 0.00 0.02 0.00 0.00 46.19 43.74 2x9r s LEU 19 CO 0.31 0.24 3.47 -1.22 0.02 0.00 0.00 176.35 179.17 2x9r n TYR 20 N 2.87 0.29 0.29 0.29 4.02 -1.26 -4.42 117.16 119.24 2x9r n TYR 20 Ca -0.16 -1.66 0.15 0.00 -0.01 0.00 0.00 57.90 56.23 2x9r n TYR 20 Cb 0.53 -1.68 0.88 0.00 -0.02 0.00 0.00 39.34 39.05 2x9r n TYR 20 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2x9r h LEU 21 N 5.28 0.00 0.00 7.72 3.38 -1.93 -2.86 115.31 126.90 2x9r h LEU 21 Ca 0.27 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.82 2x9r h LEU 21 Cb 1.33 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.02 2x9r h LEU 21 CO 0.43 0.05 -2.47 0.29 0.09 0.00 0.00 178.44 176.82 2x9r n LYS 22 N -3.63 0.62 0.00 1.13 5.02 -1.26 -4.73 118.16 115.31 2x9r n LYS 22 Ca -0.02 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2x9r n LYS 22 Cb 0.15 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 2x9r n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2x9r n GLY 23 N 1.79 0.94 0.00 0.72 0.00 -1.08 -4.39 105.19 103.16 2x9r n GLY 23 Ca -0.49 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2x9r n GLY 23 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x9r n GLU 24 N 0.00 0.00 -0.28 1.61 0.00 -1.26 -1.33 120.64 119.38 2x9r n GLU 24 Ca 0.00 0.31 0.06 0.00 0.00 0.00 0.00 57.16 57.53 2x9r n GLU 24 Cb 0.00 -0.60 0.21 0.00 0.00 0.00 0.00 31.44 31.04 2x9r n GLU 24 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.13 177.04 2x9r h ARG 25 N 0.00 0.54 -0.36 5.31 2.43 -1.92 -1.05 114.38 119.34 2x9r h ARG 25 Ca 0.00 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.24 2x9r h ARG 25 Cb 0.00 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.41 2x9r h ARG 25 CO 0.00 0.36 0.50 0.00 -1.51 0.00 0.00 179.97 179.32 2x9r h TYR 27 N 0.00 -0.02 -2.40 0.00 -1.99 -0.74 -3.29 116.97 108.53 2x9r h TYR 27 Ca 0.17 -0.00 -0.56 0.00 2.00 0.00 0.00 58.73 60.34 2x9r h TYR 27 Cb 1.17 0.01 0.21 0.00 2.00 0.00 0.00 36.73 40.12 2x9r h TYR 27 CO 0.00 -0.01 -1.24 0.43 -0.00 0.00 0.00 178.16 177.34 2x9r n SER 28 N -3.36 -4.00 -4.49 3.88 7.64 -0.90 -4.47 113.62 107.92 2x9r n SER 28 Ca -0.00 0.41 -0.13 0.00 1.01 0.00 0.00 58.87 60.16 2x9r n SER 28 Cb 0.01 -0.93 -0.10 0.00 -1.01 0.00 0.00 64.21 62.18 2x9r n SER 28 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2x9r n PRO 29 N 1.12 0.23 0.00 1.43 -0.04 -1.26 -3.81 135.00 132.67 2x9r n PRO 29 Ca 0.04 -1.03 0.00 0.00 -0.04 0.00 0.00 63.50 62.47 2x9r n PRO 29 Cb 0.52 -3.20 0.00 0.00 -0.04 0.00 0.00 33.50 30.78 2x9r n PRO 29 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2x9r n LYS 30 N 7.65 0.00 0.00 0.54 2.85 -1.26 -4.94 118.16 123.00 2x9r n LYS 30 Ca 0.41 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.67 2x9r n LYS 30 Cb 0.43 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.81 2x9r n LYS 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2x9r n ALA 32 N 0.00 0.00 0.10 0.00 0.00 -1.26 -4.52 120.51 114.84 2x9r n ALA 32 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2x9r n ALA 32 Cb 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.48 2x9r n ALA 32 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 2x9r h MET 33 N 0.00 0.40 -1.69 0.00 1.85 -1.83 0.30 114.93 113.96 2x9r h MET 33 Ca 0.00 -0.69 0.00 0.00 -0.61 0.00 0.00 59.70 58.40 2x9r h MET 33 Cb 0.00 0.26 0.00 0.00 0.43 0.00 0.00 31.60 32.29 2x9r h MET 33 CO 0.00 1.31 0.00 -1.91 -0.40 0.00 0.00 176.91 175.91 2x9r n GLU 34 N -3.60 0.46 0.24 0.39 4.07 -1.26 -2.79 120.64 118.15 2x9r n GLU 34 Ca -0.19 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.91 2x9r n GLU 34 Cb 1.07 -1.27 0.00 0.00 -0.06 0.00 0.00 31.44 31.18 2x9r n GLU 34 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 2x9r n ARG 35 N 1.10 0.00 -3.33 5.31 1.85 -1.22 -4.26 116.66 116.11 2x9r n ARG 35 Ca 0.00 0.00 -0.46 0.00 -1.00 0.00 0.00 57.85 56.39 2x9r n ARG 35 Cb 0.23 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.60 2x9r n ARG 35 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2x9r s ARG 36 N -2.00 3.14 0.00 2.89 0.52 0.10 -4.93 118.95 118.68 2x9r s ARG 36 Ca 0.00 -1.93 0.25 0.00 -0.52 0.00 0.00 55.73 53.52 2x9r s ARG 36 Cb 0.00 -4.32 1.18 0.00 0.52 0.00 0.00 34.95 32.34 2x9r s ARG 36 CO 0.00 -1.31 1.82 -2.30 0.02 0.00 0.00 175.30 173.52 2x9r n PRO 37 N 4.86 0.23 -3.60 3.54 -0.02 -1.25 -4.24 135.00 134.52 2x9r n PRO 37 Ca -0.06 0.06 -0.20 0.00 -2.02 0.00 0.00 63.50 61.28 2x9r n PRO 37 Cb 0.42 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.38 2x9r n PRO 37 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2x9r s TYR 38 N -2.72 2.94 0.65 6.00 -0.85 -1.26 -4.87 117.35 117.24 2x9r s TYR 38 Ca 0.19 -0.31 -0.13 0.00 -0.52 0.00 0.00 57.07 56.31 2x9r s TYR 38 Cb 0.16 -1.96 -0.01 0.00 0.38 0.00 0.00 41.96 40.53 2x9r s TYR 38 CO 0.40 0.03 1.06 -2.14 -1.52 0.00 0.00 175.55 173.38 2x9r s PRO 39 N -4.10 3.09 1.17 -3.49 0.02 -1.26 -4.05 135.00 126.38 2x9r s PRO 39 Ca 0.44 1.09 -0.13 0.00 0.02 0.00 0.00 61.00 62.43 2x9r s PRO 39 Cb -0.07 -2.01 0.29 0.00 0.02 0.00 0.00 34.50 32.73 2x9r s PRO 39 CO 0.29 -0.98 1.03 -1.25 -0.33 0.00 0.00 177.00 175.75 2x9r s PRO 40 N -4.55 -0.96 0.00 5.54 0.04 -1.26 -3.85 135.00 129.96 2x9r s PRO 40 Ca 0.61 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.57 2x9r s PRO 40 Cb -0.15 -1.54 0.00 0.00 0.04 0.00 0.00 34.50 32.85 2x9r s PRO 40 CO 0.46 -3.78 0.00 0.41 0.04 0.00 0.00 177.00 174.13 2x9r n GLY 41 N 0.94 1.02 0.00 0.56 0.00 -1.26 -3.94 105.19 102.52 2x9r n GLY 41 Ca 0.03 -1.91 0.03 0.00 0.00 0.00 0.00 46.02 44.18 2x9r n GLY 41 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2x9r n GLN 42 N 1.38 0.12 0.00 1.61 7.27 -1.26 -4.16 117.38 122.33 2x9r n GLN 42 Ca 0.00 0.18 0.00 0.00 0.07 0.00 0.00 57.00 57.25 2x9r n GLN 42 Cb 0.00 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.15 2x9r n GLN 42 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2x9r n HIS 43 N -1.22 0.00 0.00 3.69 8.25 -1.26 -4.88 115.22 119.80 2x9r n HIS 43 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2x9r n HIS 43 Cb 0.04 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2x9r n HIS 43 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x9r n GLY 44 N 4.28 -0.29 3.46 -1.41 0.00 -1.25 -4.16 105.19 105.82 2x9r n GLY 44 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2x9r n GLY 44 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2x9r s GLN 45 N 0.00 3.88 -0.09 1.61 -2.07 -1.26 -4.37 119.66 117.37 2x9r s GLN 45 Ca 0.00 -2.24 -0.26 0.00 -1.82 0.00 0.00 55.36 51.04 2x9r s GLN 45 Cb 0.00 -5.00 0.06 0.00 -1.09 0.00 0.00 33.01 26.98 2x9r s GLN 45 CO 0.00 -1.77 0.61 0.15 -1.32 0.00 0.00 175.29 172.97 2x9r s LYS 46 N 2.04 0.93 -0.67 9.60 1.02 -1.26 -5.08 119.74 126.31 2x9r s LYS 46 Ca 0.38 0.34 -0.38 0.00 0.02 0.00 0.00 55.97 56.34 2x9r s LYS 46 Cb -0.04 0.44 -0.19 0.00 -0.52 0.00 0.00 37.83 37.52 2x9r s LYS 46 CO -0.04 -0.25 2.36 -2.13 -0.92 0.00 0.00 175.35 174.37 2x9r n ARG 47 N 1.40 0.12 -2.32 1.68 0.63 -1.26 -4.81 116.66 112.09 2x9r n ARG 47 Ca -0.18 0.02 -0.39 0.00 -0.92 0.00 0.00 57.85 56.38 2x9r n ARG 47 Cb 0.56 -1.64 -0.03 0.00 0.45 0.00 0.00 32.46 31.81 2x9r n ARG 47 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2x9r s ALA 48 N 7.41 3.30 0.10 5.13 0.00 -1.26 -5.03 121.76 131.41 2x9r s ALA 48 Ca 1.24 1.00 -0.19 0.00 0.00 0.00 0.00 51.96 54.02 2x9r s ALA 48 Cb -1.32 -3.38 -0.07 0.00 0.00 0.00 0.00 23.12 18.35 2x9r s ALA 48 CO 0.57 -0.43 0.58 1.03 0.00 0.00 0.00 175.76 177.51 2x9r s ARG 49 N -1.95 4.18 -0.21 0.00 1.81 -1.26 -4.99 118.95 116.52 2x9r s ARG 49 Ca 0.52 0.71 -0.34 0.00 -1.72 0.00 0.00 55.73 54.90 2x9r s ARG 49 Cb -0.33 -3.16 -0.11 0.00 -0.45 0.00 0.00 34.95 30.91 2x9r s ARG 49 CO 0.42 0.60 2.04 -2.13 -0.68 0.00 0.00 175.30 175.54 2x9r n ARG 50 N 1.49 1.73 -1.63 3.54 0.00 -1.26 -4.86 116.66 115.68 2x9r n ARG 50 Ca -0.09 0.57 -0.45 0.00 -0.00 0.00 0.00 57.85 57.88 2x9r n ARG 50 Cb 0.51 -2.67 -0.02 0.00 0.00 0.00 0.00 32.46 30.28 2x9r n ARG 50 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2x9r n PRO 51 N 7.48 1.63 -3.46 -0.14 -0.02 -1.26 -4.98 135.00 134.24 2x9r n PRO 51 Ca 0.30 0.57 -0.34 0.00 -2.02 0.00 0.00 63.50 62.01 2x9r n PRO 51 Cb 0.29 -2.05 -0.05 0.00 -0.02 0.00 0.00 33.50 31.67 2x9r n PRO 51 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2x9r s SER 52 N -0.31 6.69 0.11 2.55 1.04 -1.26 -4.85 113.70 117.67 2x9r s SER 52 Ca 0.61 0.91 -0.07 0.00 0.48 0.00 0.00 55.95 57.88 2x9r s SER 52 Cb -0.68 -2.22 0.13 0.00 0.10 0.00 0.00 66.02 63.35 2x9r s SER 52 CO 0.58 0.08 0.68 0.47 0.98 0.00 0.00 173.24 176.03 2x9r n ASP 53 N 0.56 -0.25 0.27 7.02 9.92 -1.26 0.10 116.55 132.91 2x9r n ASP 53 Ca -0.05 0.76 -0.14 0.00 -0.53 0.00 0.00 54.79 54.83 2x9r n ASP 53 Cb 0.52 -0.19 -0.07 0.00 -0.64 0.00 0.00 41.12 40.74 2x9r n ASP 53 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2x9r h TYR 54 N 0.00 -0.66 -1.00 1.24 3.20 -2.00 -2.84 116.97 114.91 2x9r h TYR 54 Ca 0.17 -0.02 0.36 0.00 3.14 0.00 0.00 58.73 62.38 2x9r h TYR 54 Cb 0.28 0.22 -0.18 0.00 1.54 0.00 0.00 36.73 38.58 2x9r h TYR 54 CO -0.37 -0.33 0.36 0.00 -1.64 0.00 0.00 178.16 176.17 2x9r h ALA 55 N -0.78 1.80 -0.30 1.82 0.00 0.33 -1.11 119.26 121.02 2x9r h ALA 55 Ca -0.07 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2x9r h ALA 55 Cb 0.62 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2x9r h ALA 55 CO 0.12 -0.81 0.00 0.28 0.00 0.00 0.00 179.25 178.84 2x9r n VAL 56 N -5.34 0.00 -0.32 0.00 0.31 -0.01 -2.31 118.33 110.67 2x9r n VAL 56 Ca 0.33 1.30 0.23 0.00 -0.01 0.00 0.00 64.34 66.19 2x9r n VAL 56 Cb 1.09 -2.29 0.43 0.00 -0.91 0.00 0.00 33.84 32.17 2x9r n VAL 56 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2x9r n ARG 57 N -1.85 -0.07 0.32 5.55 3.00 -0.57 -0.28 116.66 122.76 2x9r n ARG 57 Ca 0.00 1.37 -0.15 0.00 -0.01 0.00 0.00 57.85 59.06 2x9r n ARG 57 Cb 0.00 -2.32 -0.07 0.00 0.00 0.00 0.00 32.46 30.06 2x9r n ARG 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2x9r h LEU 58 N 0.00 -0.96 -0.35 0.55 6.46 -1.25 -2.22 115.31 117.54 2x9r h LEU 58 Ca 0.70 0.06 0.07 0.00 -0.12 0.00 0.00 57.88 58.59 2x9r h LEU 58 Cb 1.71 0.28 -0.09 0.00 -0.73 0.00 0.00 40.66 41.84 2x9r h LEU 58 CO -0.81 -0.57 -0.41 0.03 -0.62 0.00 0.00 178.44 176.07 2x9r h ARG 59 N -0.90 -0.33 0.00 1.25 2.47 -0.22 0.73 114.38 117.38 2x9r h ARG 59 Ca -0.08 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 2x9r h ARG 59 Cb 0.73 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.12 2x9r h ARG 59 CO 0.06 -0.22 0.11 1.49 0.56 0.00 0.00 179.97 181.98 2x9r h GLU 60 N -0.34 0.00 0.01 0.04 4.57 -1.21 0.68 114.58 118.33 2x9r h GLU 60 Ca 0.13 0.00 -0.38 0.00 -1.18 0.00 0.00 59.36 57.93 2x9r h GLU 60 Cb 0.58 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 2x9r h GLU 60 CO -0.54 0.00 -2.11 1.17 -1.18 0.00 0.00 179.01 176.36 2x9r n LYS 61 N -2.47 0.61 -0.25 1.92 4.81 0.15 -3.34 118.16 119.59 2x9r n LYS 61 Ca -0.02 0.34 0.05 0.00 -0.87 0.00 0.00 58.31 57.82 2x9r n LYS 61 Cb 0.15 -1.59 0.29 0.00 0.02 0.00 0.00 35.03 33.90 2x9r n LYS 61 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2x9r h GLN 62 N -0.76 0.87 0.03 1.64 1.08 0.11 0.62 115.11 118.71 2x9r h GLN 62 Ca -0.56 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 56.59 2x9r h GLN 62 Cb 1.60 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 28.84 2x9r h GLN 62 CO -0.27 0.58 -0.04 -0.22 -0.95 0.00 0.00 178.83 177.93 2x9r h LYS 63 N 0.90 -0.07 -0.32 1.46 3.64 0.18 0.20 116.57 122.56 2x9r h LYS 63 Ca 0.36 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.78 2x9r h LYS 63 Cb 0.24 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.00 2x9r h LYS 63 CO -0.13 -0.05 -0.46 1.25 -2.27 0.00 0.00 179.45 177.80 2x9r h LEU 64 N -0.07 -1.53 -0.63 5.20 5.85 -1.43 -2.00 115.31 120.71 2x9r h LEU 64 Ca -0.00 0.20 0.13 0.00 0.84 0.00 0.00 57.88 59.05 2x9r h LEU 64 Cb 0.06 0.62 -0.11 0.00 0.37 0.00 0.00 40.66 41.60 2x9r h LEU 64 CO -0.01 -0.34 -0.08 -0.09 -0.34 0.00 0.00 178.44 177.58 2x9r h ARG 65 N -0.34 0.05 0.00 1.25 2.43 -0.82 -0.00 114.38 116.94 2x9r h ARG 65 Ca 0.06 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2x9r h ARG 65 Cb 0.49 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2x9r h ARG 65 CO -0.48 0.03 0.05 0.00 -1.51 0.00 0.00 179.97 178.06 2x9r h ARG 66 N 0.05 0.00 0.53 0.20 3.08 0.17 -2.77 114.38 115.64 2x9r h ARG 66 Ca 0.32 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.34 2x9r h ARG 66 Cb 0.51 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.57 2x9r h ARG 66 CO -0.60 0.00 -0.25 0.82 -1.07 0.00 0.00 179.97 178.86 2x9r h ILE 67 N 0.00 0.01 0.00 2.04 2.04 -0.77 -3.10 117.51 117.73 2x9r h ILE 67 Ca 0.00 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2x9r h ILE 67 Cb 0.09 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.19 2x9r h ILE 67 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 178.15 176.93 2x9r n TYR 68 N -5.24 0.00 -3.95 1.37 4.02 -1.07 -4.87 117.16 107.42 2x9r n TYR 68 Ca -0.09 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.54 2x9r n TYR 68 Cb 0.28 -0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.54 2x9r n TYR 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2x9r n GLY 69 N 0.24 -0.18 3.62 2.72 0.00 -1.08 -4.93 105.19 105.58 2x9r n GLY 69 Ca 0.00 0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 2x9r n GLY 69 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2x9r s ILE 70 N -4.06 3.30 0.16 -0.61 2.07 -1.24 -4.76 121.20 116.06 2x9r s ILE 70 Ca 0.06 -1.98 -0.30 0.00 -1.41 0.00 0.00 60.65 57.02 2x9r s ILE 70 Cb -0.03 -2.77 -0.07 0.00 0.13 0.00 0.00 42.46 39.71 2x9r s ILE 70 CO 0.79 -0.37 1.14 -0.94 -1.91 0.00 0.00 174.94 173.64 2x9r s SER 71 N -3.66 7.19 0.34 4.50 1.04 -1.26 -4.81 113.70 117.04 2x9r s SER 71 Ca 0.31 2.11 0.13 0.00 0.48 0.00 0.00 55.95 58.99 2x9r s SER 71 Cb -0.06 -2.60 1.06 0.00 0.10 0.00 0.00 66.02 64.52 2x9r s SER 71 CO 0.19 -0.30 1.65 -0.08 0.98 0.00 0.00 173.24 175.68 2x9r h GLU 72 N 5.41 0.25 0.00 4.02 4.57 -1.98 1.08 114.58 127.93 2x9r h GLU 72 Ca -0.44 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.73 2x9r h GLU 72 Cb 1.21 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 2x9r h GLU 72 CO 0.74 0.16 0.00 -2.13 -1.18 0.00 0.00 179.01 176.61 2x9r n ARG 73 N -5.12 0.00 -0.25 1.92 3.00 -1.26 -0.33 116.66 114.62 2x9r n ARG 73 Ca 0.31 0.58 0.06 0.00 -0.00 0.00 0.00 57.85 58.79 2x9r n ARG 73 Cb 0.98 -1.41 0.19 0.00 0.00 0.00 0.00 32.46 32.21 2x9r n ARG 73 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 2x9r h GLN 74 N 0.00 0.33 -0.33 -0.14 4.20 -1.27 0.15 115.11 118.05 2x9r h GLN 74 Ca 0.00 -0.02 0.07 0.00 0.06 0.00 0.00 58.65 58.76 2x9r h GLN 74 Cb 0.00 -0.07 -0.08 0.00 0.30 0.00 0.00 27.48 27.62 2x9r h GLN 74 CO 0.00 0.22 -0.28 0.35 -0.67 0.00 0.00 178.83 178.45 2x9r h PHE 75 N 0.34 -0.75 0.54 2.96 3.57 0.13 -2.23 116.94 121.49 2x9r h PHE 75 Ca 0.42 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.94 2x9r h PHE 75 Cb 0.69 0.38 0.01 0.00 2.79 0.00 0.00 35.95 39.81 2x9r h PHE 75 CO -0.22 -0.35 -0.26 -0.09 -2.23 0.00 0.00 178.31 175.17 2x9r h ARG 76 N -0.24 -0.69 -0.98 1.11 9.65 0.80 -2.78 114.38 121.25 2x9r h ARG 76 Ca 0.16 0.05 0.30 0.00 -1.10 0.00 0.00 59.98 59.38 2x9r h ARG 76 Cb 0.50 0.16 -0.18 0.00 -1.39 0.00 0.00 29.97 29.06 2x9r h ARG 76 CO -0.47 -0.45 0.11 0.09 2.80 0.00 0.00 179.97 182.05 2x9r n ASN 77 N -5.39 -0.03 0.40 -3.80 3.02 -0.10 0.00 115.26 109.36 2x9r n ASN 77 Ca -0.12 1.65 -0.18 0.00 -0.03 0.00 0.00 54.58 55.90 2x9r n ASN 77 Cb 0.30 -0.64 -0.09 0.00 -0.61 0.00 0.00 39.78 38.74 2x9r n ASN 77 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2x9r h LEU 78 N 0.00 -0.85 -0.98 3.41 3.38 -1.16 -2.41 115.31 116.70 2x9r h LEU 78 Ca 0.64 0.02 0.19 0.00 0.09 0.00 0.00 57.88 58.82 2x9r h LEU 78 Cb 1.40 0.22 -0.18 0.00 0.09 0.00 0.00 40.66 42.19 2x9r h LEU 78 CO -0.89 -0.59 -0.26 0.33 0.09 0.00 0.00 178.44 177.12 2x9r n PHE 79 N -5.51 0.32 -0.21 1.13 7.35 0.10 0.75 117.46 121.39 2x9r n PHE 79 Ca -0.14 1.19 -0.07 0.00 -0.76 0.00 0.00 57.45 57.67 2x9r n PHE 79 Cb 0.41 -1.05 0.03 0.00 0.35 0.00 0.00 39.48 39.22 2x9r n PHE 79 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2x9r h GLU 80 N 0.00 0.83 -0.87 -4.13 3.07 -1.30 -1.98 114.58 110.20 2x9r h GLU 80 Ca 0.46 -0.11 0.07 0.00 -0.50 0.00 0.00 59.36 59.28 2x9r h GLU 80 Cb 0.70 -0.16 -0.06 0.00 -0.84 0.00 0.00 28.75 28.39 2x9r h GLU 80 CO -1.00 0.65 0.54 1.49 -1.40 0.00 0.00 179.01 179.29 2x9r h GLU 81 N 0.80 0.94 -0.85 2.33 4.81 0.85 0.16 114.58 123.61 2x9r h GLU 81 Ca 0.21 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2x9r h GLU 81 Cb 0.07 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 2x9r h GLU 81 CO -0.03 0.62 0.51 0.00 -0.73 0.00 0.00 179.01 179.38 2x9r h ALA 82 N 1.42 1.08 -0.08 2.92 0.00 -0.22 -1.10 119.26 123.29 2x9r h ALA 82 Ca 0.39 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 2x9r h ALA 82 Cb 0.21 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2x9r h ALA 82 CO -0.19 0.55 -0.05 0.77 0.00 0.00 0.00 179.25 180.33 2x9r h SER 83 N 1.17 0.17 -0.92 0.00 0.02 -0.56 -2.93 113.55 110.51 2x9r h SER 83 Ca 0.31 -0.43 0.15 0.00 -0.84 0.00 0.00 61.79 60.97 2x9r h SER 83 Cb -0.05 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 62.37 2x9r h SER 83 CO -0.06 0.57 0.59 0.11 -1.14 0.00 0.00 176.83 176.90 2x9r h LYS 84 N -0.23 0.69 -7.11 3.45 1.79 -0.52 -3.42 116.57 111.23 2x9r h LYS 84 Ca 0.02 -0.04 -0.46 0.00 -2.18 0.00 0.00 60.65 57.98 2x9r h LYS 84 Cb 0.51 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 31.01 2x9r h LYS 84 CO 0.01 0.46 0.36 0.21 -1.08 0.00 0.00 179.45 179.41 2x9r s LYS 85 N -5.71 3.97 1.05 3.15 2.20 -0.43 -5.05 119.74 118.91 2x9r s LYS 85 Ca -0.10 1.14 -0.13 0.00 -0.36 0.00 0.00 55.97 56.52 2x9r s LYS 85 Cb 0.22 -2.13 0.22 0.00 -1.51 0.00 0.00 37.83 34.63 2x9r s LYS 85 CO 0.79 -0.26 1.09 0.15 -0.36 0.00 0.00 175.35 176.76 2x9r s LYS 86 N -3.51 -0.01 1.75 4.03 -0.14 -1.26 -4.84 119.74 115.75 2x9r s LYS 86 Ca 0.63 0.43 0.00 0.00 -1.36 0.00 0.00 55.97 55.67 2x9r s LYS 86 Cb -0.12 -1.69 0.00 0.00 -1.68 0.00 0.00 37.83 34.34 2x9r s LYS 86 CO 0.22 -3.01 0.00 0.41 -0.76 0.00 0.00 175.35 172.21 2x9r n GLY 87 N -0.90 -0.97 3.61 -3.33 0.00 -1.26 -4.78 105.19 97.56 2x9r n GLY 87 Ca 0.06 -1.43 -0.40 0.00 0.00 0.00 0.00 46.02 44.25 2x9r n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x9r s VAL 88 N 0.00 5.03 0.13 1.61 1.01 -1.26 -4.96 120.40 121.96 2x9r s VAL 88 Ca 0.00 0.90 -0.16 0.00 0.00 0.00 0.00 61.98 62.72 2x9r s VAL 88 Cb 0.00 -3.88 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 2x9r s VAL 88 CO 0.00 0.03 1.70 0.74 0.00 0.00 0.00 175.10 177.57 2x9r h THR 89 N 5.43 1.18 -0.79 3.92 2.02 -1.86 -2.90 112.91 119.91 2x9r h THR 89 Ca -0.28 -0.53 0.15 0.00 0.77 0.00 0.00 66.41 66.51 2x9r h THR 89 Cb 1.13 0.81 -0.15 0.00 -1.74 0.00 0.00 68.15 68.20 2x9r h THR 89 CO 0.74 0.20 -0.26 1.23 0.37 0.00 0.00 175.52 177.79 2x9r h GLY 90 N 0.49 0.35 0.20 2.16 0.00 -1.93 -1.71 103.07 102.63 2x9r h GLY 90 Ca 0.13 0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.80 2x9r h GLY 90 CO -0.01 -0.27 -0.09 1.76 0.00 0.00 0.00 176.54 177.92 2x9r h SER 91 N -0.04 -0.22 -1.26 0.19 0.02 -1.96 -3.24 113.55 107.04 2x9r h SER 91 Ca 0.35 0.01 0.44 0.00 -0.84 0.00 0.00 61.79 61.74 2x9r h SER 91 Cb 0.59 0.06 -0.13 0.00 0.14 0.00 0.00 62.40 63.06 2x9r h SER 91 CO -0.83 -0.14 0.80 0.52 -1.14 0.00 0.00 176.83 176.04 2x9r n VAL 92 N -2.81 -0.24 0.32 2.27 0.31 -1.06 0.15 118.33 117.26 2x9r n VAL 92 Ca -0.03 1.66 0.20 0.00 -0.01 0.00 0.00 64.34 66.16 2x9r n VAL 92 Cb 0.10 -2.72 1.04 0.00 -0.91 0.00 0.00 33.84 31.36 2x9r n VAL 92 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2x9r h PHE 93 N 0.00 0.00 0.04 3.52 -0.00 -1.34 -1.24 116.94 117.92 2x9r h PHE 93 Ca 0.81 0.00 -0.36 0.00 -0.00 0.00 0.00 57.97 58.42 2x9r h PHE 93 Cb 2.59 0.00 -0.05 0.00 -0.00 0.00 0.00 35.95 38.49 2x9r h PHE 93 CO -0.01 0.01 -2.16 1.28 -0.00 0.00 0.00 178.31 177.44 2x9r n LEU 94 N -3.24 1.97 -0.09 0.59 4.77 0.39 -2.25 117.00 119.13 2x9r n LEU 94 Ca -0.02 0.11 0.05 0.00 -0.03 0.00 0.00 56.01 56.11 2x9r n LEU 94 Cb 0.13 -0.54 0.39 0.00 -2.33 0.00 0.00 43.42 41.07 2x9r n LEU 94 CO 0.23 0.73 1.19 1.23 -1.33 0.00 0.00 177.39 179.45 2x9r h GLY 95 N 2.32 0.74 0.77 -0.72 0.00 -0.98 0.54 103.07 105.74 2x9r h GLY 95 Ca -0.47 -0.26 -0.34 0.00 0.00 0.00 0.00 47.33 46.26 2x9r h GLY 95 CO 0.02 0.23 -1.88 1.41 0.00 0.00 0.00 176.54 176.32 2x9r h LEU 96 N 0.66 0.32 -1.70 3.11 4.07 -1.42 -3.02 115.31 117.32 2x9r h LEU 96 Ca 0.23 -0.68 0.02 0.00 0.08 0.00 0.00 57.88 57.52 2x9r h LEU 96 Cb 0.08 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 41.70 2x9r h LEU 96 CO -0.06 1.61 0.23 0.25 -1.08 0.00 0.00 178.44 179.39 2x9r h LEU 97 N 0.06 0.34 0.12 1.67 6.46 -0.95 -2.88 115.31 120.13 2x9r h LEU 97 Ca -0.37 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.38 2x9r h LEU 97 Cb 2.03 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 41.88 2x9r h LEU 97 CO 0.10 0.24 -0.06 -0.08 -0.62 0.00 0.00 178.44 178.02 2x9r h GLU 98 N 0.40 -0.16 0.00 1.25 4.57 -0.03 -3.30 114.58 117.32 2x9r h GLU 98 Ca 0.14 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 2x9r h GLU 98 Cb 0.06 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2x9r h GLU 98 CO -0.03 0.29 0.39 0.43 -1.18 0.00 0.00 179.01 178.91 2x9r n SER 99 N -4.86 0.01 -4.59 1.04 7.64 -1.09 -4.21 113.62 107.56 2x9r n SER 99 Ca -0.07 0.14 -0.43 0.00 1.01 0.00 0.00 58.87 59.52 2x9r n SER 99 Cb 0.26 -0.13 -0.03 0.00 -1.01 0.00 0.00 64.21 63.30 2x9r n SER 99 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2x9r n ARG 100 N -1.18 1.83 -0.18 1.43 1.74 -1.23 0.87 116.66 119.94 2x9r n ARG 100 Ca -0.00 0.47 0.04 0.00 -0.77 0.00 0.00 57.85 57.59 2x9r n ARG 100 Cb 0.39 -3.22 0.09 0.00 -1.02 0.00 0.00 32.46 28.70 2x9r n ARG 100 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2x9r n LEU 101 N 12.03 -0.15 0.23 0.55 7.94 0.15 0.22 117.00 137.97 2x9r n LEU 101 Ca 0.31 0.88 0.15 0.00 -1.11 0.00 0.00 56.01 56.24 2x9r n LEU 101 Cb 0.45 -0.28 0.82 0.00 0.53 0.00 0.00 43.42 44.93 2x9r n LEU 101 CO 0.67 -0.85 1.13 -2.24 -1.11 0.00 0.00 177.39 174.99 2x9r h ASP 102 N 0.00 0.00 0.00 1.96 2.03 -1.78 -1.72 116.42 116.90 2x9r h ASP 102 Ca 0.26 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.56 2x9r h ASP 102 Cb 0.44 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.94 2x9r h ASP 102 CO -0.52 0.00 -0.00 -1.13 -1.03 0.00 0.00 179.24 176.56 2x9r h ASN 103 N 0.00 0.00 0.00 4.15 -1.24 0.25 -3.33 115.58 115.41 2x9r h ASN 103 Ca 0.06 -0.87 -0.18 0.00 0.71 0.00 0.00 56.30 56.02 2x9r h ASN 103 Cb 0.31 -0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.35 2x9r h ASN 103 CO -0.00 0.87 0.89 0.52 -1.29 0.00 0.00 177.43 178.42 2x9r n VAL 104 N -4.67 1.70 0.00 2.57 0.31 -0.65 -0.54 118.33 117.05 2x9r n VAL 104 Ca -0.10 -0.92 0.00 0.00 -0.01 0.00 0.00 64.34 63.31 2x9r n VAL 104 Cb 0.42 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.50 2x9r n VAL 104 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2x9r n VAL 105 N 3.30 0.00 -0.04 2.52 0.31 -1.24 -4.78 118.33 118.40 2x9r n VAL 105 Ca 0.27 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.39 2x9r n VAL 105 Cb 0.33 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.13 2x9r n VAL 105 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x9r n TYR 106 N -0.69 1.00 -0.35 3.52 9.36 0.22 -1.85 117.16 128.38 2x9r n TYR 106 Ca 0.00 0.26 -0.04 0.00 3.32 0.00 0.00 57.90 61.44 2x9r n TYR 106 Cb 0.00 -1.12 0.01 0.00 -0.63 0.00 0.00 39.34 37.60 2x9r n TYR 106 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2x9r n ARG 107 N -3.68 1.18 0.00 2.98 5.12 0.29 -2.82 116.66 119.74 2x9r n ARG 107 Ca -0.35 -0.36 0.00 0.00 -1.93 0.00 0.00 57.85 55.21 2x9r n ARG 107 Cb 0.96 -1.14 0.00 0.00 -1.16 0.00 0.00 32.46 31.12 2x9r n ARG 107 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 2x9r n LEU 108 N 1.06 0.00 0.00 0.55 7.94 -1.25 -4.73 117.00 120.57 2x9r n LEU 108 Ca 0.07 -0.15 0.00 0.00 -1.11 0.00 0.00 56.01 54.82 2x9r n LEU 108 Cb 0.54 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.49 2x9r n LEU 108 CO 0.09 0.29 0.00 0.61 -1.11 0.00 0.00 177.39 177.26 2x9r n GLY 109 N 0.00 2.65 0.15 -3.96 0.00 -1.13 -4.89 105.19 98.01 2x9r n GLY 109 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2x9r n GLY 109 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2x9r n PHE 110 N 0.00 0.00 -3.55 1.61 3.01 -0.97 -4.45 117.46 113.11 2x9r n PHE 110 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 2x9r n PHE 110 Cb 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 2x9r n PHE 110 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2x9r s ALA 111 N -2.41 -1.20 -0.14 4.37 0.00 -0.77 -4.92 121.76 116.70 2x9r s ALA 111 Ca 0.00 0.16 0.21 0.00 0.00 0.00 0.00 51.96 52.33 2x9r s ALA 111 Cb 0.00 0.77 0.44 0.00 0.00 0.00 0.00 23.12 24.33 2x9r s ALA 111 CO 0.00 -0.69 1.62 -0.24 0.00 0.00 0.00 175.76 176.45 2x9r h VAL 112 N 2.22 0.51 -3.45 0.00 3.04 -1.88 -3.41 116.25 113.28 2x9r h VAL 112 Ca -0.34 -1.51 -0.05 0.00 -1.01 0.00 0.00 66.70 63.79 2x9r h VAL 112 Cb 1.28 2.09 -0.12 0.00 -2.01 0.00 0.00 31.29 32.53 2x9r h VAL 112 CO 0.43 0.26 -0.08 -0.94 -1.01 0.00 0.00 177.57 176.24 2x9r s SER 113 N -6.28 -0.19 0.32 3.17 1.04 -1.26 -4.48 113.70 106.02 2x9r s SER 113 Ca 0.04 -0.50 0.10 0.00 0.48 0.00 0.00 55.95 56.07 2x9r s SER 113 Cb 0.08 0.51 0.52 0.00 0.10 0.00 0.00 66.02 67.23 2x9r s SER 113 CO 0.68 -0.95 1.72 0.03 0.98 0.00 0.00 173.24 175.70 2x9r h ARG 114 N 2.33 0.06 -0.28 4.02 3.08 -1.86 0.44 114.38 122.17 2x9r h ARG 114 Ca -0.31 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.67 2x9r h ARG 114 Cb 1.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 2x9r h ARG 114 CO 0.43 0.53 0.05 0.00 -1.07 0.00 0.00 179.97 179.91 2x9r h ARG 115 N 0.05 0.46 -0.55 0.04 3.08 -1.91 0.45 114.38 116.00 2x9r h ARG 115 Ca 0.00 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.84 2x9r h ARG 115 Cb 0.86 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.83 2x9r h ARG 115 CO 0.06 0.56 -0.01 0.37 -1.07 0.00 0.00 179.97 179.89 2x9r h GLN 116 N 0.28 0.95 -0.53 0.04 4.15 -1.83 -2.73 115.11 115.44 2x9r h GLN 116 Ca 0.09 -0.29 0.04 0.00 0.77 0.00 0.00 58.65 59.25 2x9r h GLN 116 Cb 0.32 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.87 2x9r h GLN 116 CO 0.00 0.95 0.29 0.00 -1.93 0.00 0.00 178.83 178.15 2x9r h ALA 117 N 1.10 0.68 0.02 3.38 0.00 0.53 -2.44 119.26 122.54 2x9r h ALA 117 Ca 0.16 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2x9r h ALA 117 Cb 0.53 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2x9r h ALA 117 CO 0.03 -0.02 -0.08 -0.09 0.00 0.00 0.00 179.25 179.09 2x9r h ARG 118 N 0.58 -0.11 -1.19 0.00 2.43 0.19 0.50 114.38 116.78 2x9r h ARG 118 Ca 0.23 0.01 0.34 0.00 -0.81 0.00 0.00 59.98 59.75 2x9r h ARG 118 Cb 0.09 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.61 2x9r h ARG 118 CO -0.13 -0.07 1.03 0.37 -1.51 0.00 0.00 179.97 179.66 2x9r h GLN 119 N -0.11 0.00 0.01 0.20 4.15 -1.47 0.50 115.11 118.39 2x9r h GLN 119 Ca -0.00 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 2x9r h GLN 119 Cb 0.11 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.80 2x9r h GLN 119 CO -0.04 0.00 -0.01 -0.07 -1.93 0.00 0.00 178.83 176.78 2x9r h LEU 120 N 0.00 -0.01 -0.61 -2.39 3.38 -0.45 -2.03 115.31 113.19 2x9r h LEU 120 Ca 0.56 -0.76 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 2x9r h LEU 120 Cb 2.62 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 43.35 2x9r h LEU 120 CO -0.01 0.83 0.30 0.58 0.09 0.00 0.00 178.44 180.24 2x9r h VAL 121 N -0.95 1.21 -0.43 1.22 2.07 0.29 -2.71 116.25 116.95 2x9r h VAL 121 Ca -0.00 -0.58 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 2x9r h VAL 121 Cb 0.78 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2x9r h VAL 121 CO 0.00 0.24 -0.08 -0.09 0.02 0.00 0.00 177.57 177.66 2x9r h ARG 122 N 0.83 0.75 -0.99 1.57 9.65 -0.29 -2.90 114.38 123.02 2x9r h ARG 122 Ca 0.21 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 2x9r h ARG 122 Cb 0.10 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.61 2x9r h ARG 122 CO -0.03 0.81 0.00 0.72 2.80 0.00 0.00 179.97 184.28 2x9r n HIS 123 N -4.18 0.00 -0.72 2.20 8.25 -0.76 -4.78 115.22 115.23 2x9r n HIS 123 Ca 0.02 -0.11 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 2x9r n HIS 123 Cb 0.34 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.32 2x9r n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x9r n GLY 124 N 0.12 0.46 0.28 -1.41 0.00 -1.09 -4.89 105.19 98.66 2x9r n GLY 124 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2x9r n GLY 124 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2x9r h HIS 125 N 0.00 -0.64 -3.85 1.61 3.86 -1.68 -3.44 115.15 111.01 2x9r h HIS 125 Ca 0.00 0.00 -0.45 0.00 -1.16 0.00 0.00 60.37 58.76 2x9r h HIS 125 Cb 0.00 0.24 0.16 0.00 1.06 0.00 0.00 27.41 28.87 2x9r h HIS 125 CO 0.00 -0.36 0.19 0.42 0.86 0.00 0.00 177.93 179.04 2x9r s ILE 126 N -6.08 1.96 0.27 2.45 1.09 -1.25 -0.66 121.20 118.98 2x9r s ILE 126 Ca -0.16 0.00 -0.21 0.00 -1.10 0.00 0.00 60.65 59.18 2x9r s ILE 126 Cb 0.06 -2.51 0.03 0.00 -1.06 0.00 0.00 42.46 38.98 2x9r s ILE 126 CO 0.64 0.00 0.76 0.28 -0.10 0.00 0.00 174.94 176.53 2x9r s THR 127 N -3.00 0.00 0.00 2.92 -1.32 -1.23 -3.78 115.64 109.22 2x9r s THR 127 Ca 0.66 -0.95 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 2x9r s THR 127 Cb -0.17 -2.08 0.00 0.00 -1.51 0.00 0.00 72.50 68.74 2x9r s THR 127 CO 0.57 0.00 0.00 0.52 -2.21 0.00 0.00 174.62 173.50 2x9r n VAL 128 N -0.47 0.00 -0.18 5.08 0.31 0.17 -1.74 118.33 121.50 2x9r n VAL 128 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 2x9r n VAL 128 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 2x9r n VAL 128 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2x9r n ASN 129 N -0.22 0.00 0.00 4.52 5.03 -0.87 -3.64 115.26 120.09 2x9r n ASN 129 Ca 0.00 -0.47 0.00 0.00 0.87 0.00 0.00 54.58 54.98 2x9r n ASN 129 Cb 0.00 -0.04 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 2x9r n ASN 129 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2x9r n GLY 130 N 2.19 2.40 3.81 7.41 0.00 -1.26 -5.06 105.19 114.69 2x9r n GLY 130 Ca 0.00 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 2x9r n GLY 130 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x9r s ARG 131 N 0.00 3.21 0.65 1.61 3.00 -1.24 -5.04 118.95 121.14 2x9r s ARG 131 Ca 0.00 1.09 0.02 0.00 0.00 0.00 0.00 55.73 56.84 2x9r s ARG 131 Cb 0.00 -2.02 0.09 0.00 0.00 0.00 0.00 34.95 33.02 2x9r s ARG 131 CO 0.00 -0.89 0.89 -0.98 0.00 0.00 0.00 175.30 174.32 2x9r s ARG 132 N -4.46 2.03 -0.11 3.54 1.04 -1.26 0.42 118.95 120.15 2x9r s ARG 132 Ca 0.61 -1.13 -0.08 0.00 -1.04 0.00 0.00 55.73 54.09 2x9r s ARG 132 Cb -0.15 -2.44 0.04 0.00 -2.04 0.00 0.00 34.95 30.36 2x9r s ARG 132 CO 0.44 -1.14 0.28 0.08 -0.04 0.00 0.00 175.30 174.92 2x9r s VAL 133 N -2.94 -0.01 -0.24 4.99 1.01 -1.25 -4.73 120.40 117.22 2x9r s VAL 133 Ca 0.63 0.05 0.10 0.00 0.00 0.00 0.00 61.98 62.76 2x9r s VAL 133 Cb -0.07 -0.41 0.44 0.00 0.00 0.00 0.00 36.38 36.34 2x9r s VAL 133 CO 0.42 0.02 1.26 -0.90 0.00 0.00 0.00 175.10 175.90 2x9r n ASP 134 N 3.43 2.47 -4.04 3.32 3.85 -1.25 -4.60 116.55 119.73 2x9r n ASP 134 Ca -0.17 -3.86 -0.32 0.00 -0.71 0.00 0.00 54.79 49.72 2x9r n ASP 134 Cb 0.56 -0.52 -0.14 0.00 -1.35 0.00 0.00 41.12 39.68 2x9r n ASP 134 CO 0.00 0.00 0.00 -0.76 -1.01 0.00 0.00 177.20 175.43 2x9r s LEU 135 N -3.32 4.87 0.19 -2.12 1.02 -1.26 -4.35 118.68 113.72 2x9r s LEU 135 Ca 0.42 -2.20 -0.17 0.00 0.02 0.00 0.00 54.13 52.20 2x9r s LEU 135 Cb 0.38 -1.69 0.17 0.00 0.02 0.00 0.00 46.19 45.08 2x9r s LEU 135 CO -0.04 -0.41 1.62 -0.65 0.02 0.00 0.00 176.35 176.89 2x9r h PRO 136 N 7.63 -0.07 0.00 1.29 0.11 -1.92 0.12 132.00 139.17 2x9r h PRO 136 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2x9r h PRO 136 Cb 1.02 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2x9r h PRO 136 CO 0.58 -0.05 0.04 0.66 -0.21 0.00 0.00 178.00 179.02 2x9r h SER 137 N -0.07 0.00 -1.32 -2.05 4.64 -1.94 -2.94 113.55 109.87 2x9r h SER 137 Ca 0.25 0.00 -0.77 0.00 -0.47 0.00 0.00 61.79 60.81 2x9r h SER 137 Cb 0.47 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.59 2x9r h SER 137 CO -0.60 0.00 0.49 0.00 -0.87 0.00 0.00 176.83 175.85 2x9r n TYR 138 N -2.85 1.43 -3.08 4.77 9.36 0.03 -4.59 117.16 122.23 2x9r n TYR 138 Ca -0.03 0.84 -0.43 0.00 3.32 0.00 0.00 57.90 61.61 2x9r n TYR 138 Cb 0.10 -2.27 -0.06 0.00 -0.63 0.00 0.00 39.34 36.47 2x9r n TYR 138 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2x9r s ARG 139 N 1.53 3.43 0.21 2.98 3.52 -1.26 0.34 118.95 129.69 2x9r s ARG 139 Ca 0.94 -0.18 -0.31 0.00 -0.13 0.00 0.00 55.73 56.04 2x9r s ARG 139 Cb -1.18 -3.91 -0.10 0.00 -1.56 0.00 0.00 34.95 28.20 2x9r s ARG 139 CO 0.61 -0.95 1.56 0.08 -0.81 0.00 0.00 175.30 175.79 2x9r s VAL 140 N 2.89 2.47 0.49 7.11 1.01 0.25 -4.91 120.40 129.71 2x9r s VAL 140 Ca 0.25 0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.67 2x9r s VAL 140 Cb -0.14 -3.23 0.03 0.00 0.00 0.00 0.00 36.38 33.05 2x9r s VAL 140 CO 0.19 0.04 0.58 -0.13 0.00 0.00 0.00 175.10 175.77 2x9r s ARG 141 N 0.59 2.52 -0.29 2.72 0.52 -1.26 -4.73 118.95 119.01 2x9r s ARG 141 Ca 0.67 -1.54 -0.29 0.00 -0.52 0.00 0.00 55.73 54.05 2x9r s ARG 141 Cb -0.45 -2.55 -0.01 0.00 0.52 0.00 0.00 34.95 32.46 2x9r s ARG 141 CO 0.36 -0.50 1.46 -2.14 0.02 0.00 0.00 175.30 174.51 2x9r s PRO 142 N -4.40 3.78 0.00 3.54 0.02 -1.26 -3.76 135.00 132.92 2x9r s PRO 142 Ca 0.53 1.35 0.00 0.00 0.02 0.00 0.00 61.00 62.90 2x9r s PRO 142 Cb -0.06 -3.98 0.00 0.00 0.02 0.00 0.00 34.50 30.48 2x9r s PRO 142 CO 0.32 -1.30 0.00 0.41 -0.33 0.00 0.00 177.00 176.10 2x9r n GLY 143 N 4.63 0.60 3.20 0.52 0.00 0.73 -4.97 105.19 109.90 2x9r n GLY 143 Ca 0.17 -0.26 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 2x9r n GLY 143 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2x9r s ASP 144 N -2.11 2.13 -0.46 1.61 1.11 -1.25 -4.90 116.67 112.80 2x9r s ASP 144 Ca 0.00 -0.43 -0.23 0.00 0.18 0.00 0.00 52.55 52.07 2x9r s ASP 144 Cb 0.00 -0.19 0.03 0.00 1.07 0.00 0.00 42.92 43.83 2x9r s ASP 144 CO 0.00 0.15 0.77 -1.61 1.18 0.00 0.00 175.17 175.66 2x9r s GLU 145 N -0.89 3.36 -1.00 8.23 2.02 -1.26 -1.81 118.70 127.34 2x9r s GLU 145 Ca 0.06 -0.21 -0.16 0.00 0.02 0.00 0.00 54.97 54.68 2x9r s GLU 145 Cb -0.08 -3.96 0.16 0.00 0.10 0.00 0.00 34.13 30.35 2x9r s GLU 145 CO 0.01 -1.15 1.16 0.42 0.02 0.00 0.00 175.26 175.72 2x9r s ILE 146 N 3.26 5.00 0.00 -1.63 -1.09 0.18 -2.04 121.20 124.87 2x9r s ILE 146 Ca 0.28 -2.08 0.00 0.00 -2.23 0.00 0.00 60.65 56.62 2x9r s ILE 146 Cb -0.13 -4.76 0.00 0.00 -1.58 0.00 0.00 42.46 35.99 2x9r s ILE 146 CO 0.21 -1.46 0.00 0.00 -1.23 0.00 0.00 174.94 172.46 2x9r n ALA 147 N 5.75 0.00 -3.04 9.38 0.00 -0.71 -3.83 120.51 128.06 2x9r n ALA 147 Ca 0.26 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.58 2x9r n ALA 147 Cb 0.47 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.80 2x9r n ALA 147 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2x9r s VAL 148 N 0.00 0.02 0.20 0.00 1.01 -1.26 -3.58 120.40 116.80 2x9r s VAL 148 Ca 0.00 -0.17 -0.31 0.00 0.00 0.00 0.00 61.98 61.50 2x9r s VAL 148 Cb 0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 36.38 36.02 2x9r s VAL 148 CO 0.00 -0.09 1.56 0.00 0.00 0.00 0.00 175.10 176.56 2x9r s ALA 149 N -0.27 3.76 0.26 5.51 0.00 0.16 -4.85 121.76 126.32 2x9r s ALA 149 Ca -0.04 1.40 -0.08 0.00 0.00 0.00 0.00 51.96 53.25 2x9r s ALA 149 Cb -0.03 -3.62 0.44 0.00 0.00 0.00 0.00 23.12 19.92 2x9r s ALA 149 CO 0.00 -0.81 1.60 1.05 0.00 0.00 0.00 175.76 177.61 2x9r h GLU 150 N 6.23 0.03 0.00 0.00 9.09 -1.98 1.42 114.58 129.37 2x9r h GLU 150 Ca -0.44 -0.00 -0.01 0.00 0.05 0.00 0.00 59.36 58.96 2x9r h GLU 150 Cb 1.21 -0.01 -0.00 0.00 -1.65 0.00 0.00 28.75 28.30 2x9r h GLU 150 CO 0.88 0.02 -0.07 -0.22 0.05 0.00 0.00 179.01 179.67 2x9r h LYS 151 N 0.03 0.00 0.00 1.06 3.64 -1.95 0.66 116.57 120.01 2x9r h LYS 151 Ca 0.43 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 2x9r h LYS 151 Cb 0.74 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 2x9r h LYS 151 CO -0.81 0.07 0.00 0.43 -2.27 0.00 0.00 179.45 176.87 2x9r n SER 152 N -3.62 0.00 -0.06 4.20 7.64 0.48 -3.63 113.62 118.63 2x9r n SER 152 Ca -0.02 0.26 -0.15 0.00 1.01 0.00 0.00 58.87 59.96 2x9r n SER 152 Cb 0.18 -0.42 -0.06 0.00 -1.01 0.00 0.00 64.21 62.91 2x9r n SER 152 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2x9r h ARG 153 N 0.00 0.75 -0.00 1.43 3.08 -0.31 -3.22 114.38 116.12 2x9r h ARG 153 Ca 0.00 -0.51 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2x9r h ARG 153 Cb 0.41 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2x9r h ARG 153 CO 0.00 1.13 -0.35 0.27 -1.07 0.00 0.00 179.97 179.95 2x9r n ASN 154 N -4.10 0.58 -4.75 7.04 6.94 -1.24 -4.73 115.26 115.01 2x9r n ASN 154 Ca -0.06 -0.37 -0.42 0.00 -0.02 0.00 0.00 54.58 53.72 2x9r n ASN 154 Cb 0.61 0.12 -0.02 0.00 -2.36 0.00 0.00 39.78 38.14 2x9r n ASN 154 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2x9r s LEU 155 N -2.82 4.35 0.00 -4.53 1.43 -1.22 -4.94 118.68 110.95 2x9r s LEU 155 Ca 0.16 2.93 0.00 0.00 -1.03 0.00 0.00 54.13 56.19 2x9r s LEU 155 Cb 0.18 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.77 2x9r s LEU 155 CO 0.62 -0.91 0.26 -0.62 0.23 0.00 0.00 176.35 175.93 2x9r n GLU 156 N 2.37 0.00 -0.57 1.70 1.02 -1.26 -2.64 120.64 121.25 2x9r n GLU 156 Ca 0.09 0.16 0.43 0.00 -0.02 0.00 0.00 57.16 57.82 2x9r n GLU 156 Cb 0.37 -0.76 0.66 0.00 -0.02 0.00 0.00 31.44 31.69 2x9r n GLU 156 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2x9r n LEU 157 N -0.42 0.00 -0.07 -4.62 7.94 -1.26 0.19 117.00 118.76 2x9r n LEU 157 Ca 0.00 0.80 -0.10 0.00 -1.11 0.00 0.00 56.01 55.60 2x9r n LEU 157 Cb 0.00 -0.40 0.05 0.00 0.53 0.00 0.00 43.42 43.60 2x9r n LEU 157 CO 0.00 -0.80 0.60 0.40 -1.11 0.00 0.00 177.39 176.48 2x9r h ILE 158 N 0.00 1.28 0.60 1.96 1.08 -1.81 -3.22 117.51 117.40 2x9r h ILE 158 Ca 0.76 -1.52 -0.03 0.00 -0.39 0.00 0.00 64.86 63.68 2x9r h ILE 158 Cb 3.04 1.41 -0.00 0.00 -3.07 0.00 0.00 36.82 38.20 2x9r h ILE 158 CO -0.01 0.50 -0.35 0.03 -0.69 0.00 0.00 178.15 177.62 2x9r h ARG 159 N 0.63 -0.86 -0.66 2.37 2.47 0.23 -3.22 114.38 115.34 2x9r h ARG 159 Ca 0.06 0.06 0.12 0.00 -1.26 0.00 0.00 59.98 58.96 2x9r h ARG 159 Cb 0.90 0.19 -0.13 0.00 -1.65 0.00 0.00 29.97 29.29 2x9r h ARG 159 CO 0.08 -0.57 -0.25 1.96 0.56 0.00 0.00 179.97 181.75 2x9r h GLN 160 N -0.89 -0.07 -2.63 0.04 4.20 -1.67 -2.08 115.11 112.01 2x9r h GLN 160 Ca -0.08 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.48 2x9r h GLN 160 Cb 0.70 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.47 2x9r h GLN 160 CO 0.10 -0.05 0.49 0.09 -0.67 0.00 0.00 178.83 178.79 2x9r n ASN 161 N -5.46 3.28 0.00 1.46 3.02 -1.22 0.90 115.26 117.26 2x9r n ASN 161 Ca 0.07 -2.10 0.00 0.00 -0.03 0.00 0.00 54.58 52.52 2x9r n ASN 161 Cb 0.36 -0.85 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 2x9r n ASN 161 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2x9r n LEU 162 N 3.00 0.00 0.26 3.41 4.77 -0.80 -4.20 117.00 123.45 2x9r n LEU 162 Ca 0.28 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.36 2x9r n LEU 162 Cb 0.44 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 42.24 2x9r n LEU 162 CO 0.28 0.00 1.04 -0.08 -1.33 0.00 0.00 177.39 177.30 2x9r h GLU 163 N 0.00 0.00 -0.02 3.23 4.57 0.69 -0.65 114.58 122.40 2x9r h GLU 163 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2x9r h GLU 163 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2x9r h GLU 163 CO 0.00 0.05 -0.13 0.00 -1.18 0.00 0.00 179.01 177.75 2x9r n ALA 164 N -2.44 2.77 1.52 2.92 0.00 -1.22 -4.22 120.51 119.84 2x9r n ALA 164 Ca -0.03 -0.65 0.02 0.00 0.00 0.00 0.00 53.44 52.78 2x9r n ALA 164 Cb 0.14 -0.84 0.06 0.00 0.00 0.00 0.00 19.45 18.81 2x9r n ALA 164 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2x9r n MET 165 N 0.86 1.33 -4.08 0.00 2.81 -0.25 -3.69 117.12 114.11 2x9r n MET 165 Ca 0.13 -0.49 -0.33 0.00 -1.81 0.00 0.00 57.70 55.20 2x9r n MET 165 Cb 0.54 -1.13 -0.15 0.00 -0.71 0.00 0.00 33.22 31.77 2x9r n MET 165 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2x9r s LYS 166 N -1.79 2.56 0.00 0.03 1.02 -1.26 -4.62 119.74 115.68 2x9r s LYS 166 Ca 0.09 -1.13 0.00 0.00 0.02 0.00 0.00 55.97 54.95 2x9r s LYS 166 Cb 0.05 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.59 2x9r s LYS 166 CO 0.06 -0.42 0.00 0.41 -0.92 0.00 0.00 175.35 174.48 2x9r n GLY 167 N 4.52 2.93 3.75 -3.33 0.00 -1.26 -5.03 105.19 106.76 2x9r n GLY 167 Ca -0.17 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 2x9r n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x9r s ARG 168 N 0.00 4.55 0.46 1.61 0.52 -1.24 -5.03 118.95 119.82 2x9r s ARG 168 Ca 0.00 1.89 0.02 0.00 -0.52 0.00 0.00 55.73 57.12 2x9r s ARG 168 Cb 0.00 -3.19 0.01 0.00 0.52 0.00 0.00 34.95 32.29 2x9r s ARG 168 CO 0.00 0.05 0.66 0.15 0.02 0.00 0.00 175.30 176.19 2x9r s LYS 169 N -1.11 2.90 0.12 3.54 1.02 -1.26 -4.80 119.74 120.15 2x9r s LYS 169 Ca 0.48 -0.71 0.06 0.00 0.02 0.00 0.00 55.97 55.82 2x9r s LYS 169 Cb -0.33 -2.59 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 2x9r s LYS 169 CO 0.41 -0.35 -0.02 0.08 -0.92 0.00 0.00 175.35 174.56 2x9r s VAL 170 N -2.54 3.80 0.20 3.17 1.01 -1.26 -5.07 120.40 119.71 2x9r s VAL 170 Ca 0.51 -1.18 -0.24 0.00 0.00 0.00 0.00 61.98 61.07 2x9r s VAL 170 Cb -0.10 -2.84 -0.15 0.00 0.00 0.00 0.00 36.38 33.29 2x9r s VAL 170 CO 0.37 0.04 0.41 0.61 0.00 0.00 0.00 175.10 176.53 2x9r n GLY 171 N 0.37 -1.68 0.00 4.51 0.00 -1.26 -4.76 105.19 102.37 2x9r n GLY 171 Ca -0.11 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2x9r n GLY 171 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2x9r n PRO 172 N 0.93 0.00 0.00 1.61 -0.02 -1.26 -0.96 135.00 135.30 2x9r n PRO 172 Ca 0.15 0.34 0.02 0.00 -2.02 0.00 0.00 63.50 61.99 2x9r n PRO 172 Cb 0.24 -1.56 0.02 0.00 -0.02 0.00 0.00 33.50 32.18 2x9r n PRO 172 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2x9r n TRP 173 N -1.32 0.00 -4.88 6.00 2.14 -1.26 -5.01 117.44 113.11 2x9r n TRP 173 Ca 0.00 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.27 2x9r n TRP 173 Cb 0.06 0.00 -0.15 0.00 -0.81 0.00 0.00 31.31 30.41 2x9r n TRP 173 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2x9r s LEU 174 N -0.35 2.17 -0.29 5.67 1.43 -0.13 -2.96 118.68 124.22 2x9r s LEU 174 Ca 0.04 -0.58 -0.00 0.00 -1.03 0.00 0.00 54.13 52.56 2x9r s LEU 174 Cb 0.03 -1.25 0.09 0.00 0.03 0.00 0.00 46.19 45.09 2x9r s LEU 174 CO 0.05 0.25 0.06 -0.94 0.23 0.00 0.00 176.35 175.99 2x9r s SER 175 N -1.24 3.99 0.00 2.29 1.04 -1.20 -4.53 113.70 114.06 2x9r s SER 175 Ca 0.11 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 54.99 2x9r s SER 175 Cb -0.10 -1.01 0.00 0.00 0.10 0.00 0.00 66.02 65.01 2x9r s SER 175 CO 0.02 -0.37 0.00 -0.11 0.98 0.00 0.00 173.24 173.76 2x9r n LEU 176 N 4.75 0.00 0.00 2.42 7.94 -1.26 -1.48 117.00 129.36 2x9r n LEU 176 Ca -0.04 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 2x9r n LEU 176 Cb 0.43 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.38 2x9r n LEU 176 CO 0.14 0.00 0.00 -0.67 -1.11 0.00 0.00 177.39 175.75 2x9r n ASP 177 N 0.00 0.00 0.00 1.96 -0.08 -1.26 -4.38 116.55 112.79 2x9r n ASP 177 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2x9r n ASP 177 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2x9r n ASP 177 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2x9r n VAL 178 N 0.00 0.00 -0.24 5.18 0.31 -1.26 -3.02 118.33 119.30 2x9r n VAL 178 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 2x9r n VAL 178 Cb 0.00 0.00 0.10 0.00 -0.91 0.00 0.00 33.84 33.03 2x9r n VAL 178 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2x9r h GLU 179 N 0.00 0.03 0.00 5.55 5.08 -1.97 0.60 114.58 123.87 2x9r h GLU 179 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2x9r h GLU 179 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2x9r h GLU 179 CO 0.00 0.02 0.00 0.78 -1.00 0.00 0.00 179.01 178.81 2x9r h GLY 180 N 0.03 0.00 -0.37 -3.84 0.00 -1.97 -3.45 103.07 93.46 2x9r h GLY 180 Ca 0.36 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.53 2x9r h GLY 180 CO -0.70 0.00 -0.15 1.03 0.00 0.00 0.00 176.54 176.73 2x9r n MET 181 N -2.59 -1.07 0.00 4.80 2.81 0.21 -4.89 117.12 116.40 2x9r n MET 181 Ca 0.02 0.70 0.00 0.00 -1.81 0.00 0.00 57.70 56.61 2x9r n MET 181 Cb 0.30 -4.72 0.00 0.00 -0.71 0.00 0.00 33.22 28.09 2x9r n MET 181 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2x9r n LYS 182 N -1.73 1.68 0.00 0.03 4.01 -1.26 -4.13 118.16 116.76 2x9r n LYS 182 Ca -0.08 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.72 2x9r n LYS 182 Cb 0.39 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.91 2x9r n LYS 182 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2x9r n GLY 183 N 5.00 4.08 3.74 0.72 0.00 -1.25 -4.20 105.19 113.28 2x9r n GLY 183 Ca 0.00 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 2x9r n GLY 183 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x9r s LYS 184 N -2.90 2.45 -0.82 1.61 1.02 -0.55 0.47 119.74 121.02 2x9r s LYS 184 Ca 0.00 -1.46 0.02 0.00 0.02 0.00 0.00 55.97 54.55 2x9r s LYS 184 Cb 0.00 -2.24 0.33 0.00 -0.52 0.00 0.00 37.83 35.40 2x9r s LYS 184 CO 0.00 0.16 1.42 0.34 -0.92 0.00 0.00 175.35 176.35 2x9r n PHE 185 N -1.15 3.36 -0.21 3.18 7.35 -0.75 -3.23 117.46 126.01 2x9r n PHE 185 Ca -0.04 -3.22 0.18 0.00 -0.76 0.00 0.00 57.45 53.61 2x9r n PHE 185 Cb 0.60 -0.87 0.34 0.00 0.35 0.00 0.00 39.48 39.90 2x9r n PHE 185 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2x9r n LEU 186 N -0.13 0.15 -3.75 -2.13 4.77 -1.16 -0.19 117.00 114.55 2x9r n LEU 186 Ca 0.40 1.09 -0.04 0.00 -0.03 0.00 0.00 56.01 57.43 2x9r n LEU 186 Cb 0.32 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 40.90 2x9r n LEU 186 CO 0.44 -1.19 0.72 0.00 -1.33 0.00 0.00 177.39 176.02 2x9r s ARG 187 N -5.14 1.20 -0.28 3.23 1.70 -1.21 -4.27 118.95 114.18 2x9r s ARG 187 Ca -0.07 -0.66 -0.29 0.00 -0.47 0.00 0.00 55.73 54.24 2x9r s ARG 187 Cb 0.21 0.41 0.00 0.00 -0.57 0.00 0.00 34.95 35.01 2x9r s ARG 187 CO 0.51 -0.55 1.27 -1.17 -1.08 0.00 0.00 175.30 174.28 2x9r s LEU 188 N -2.94 3.93 0.02 -1.89 2.96 -1.26 -4.89 118.68 114.60 2x9r s LEU 188 Ca 0.12 1.26 -0.35 0.00 -0.22 0.00 0.00 54.13 54.93 2x9r s LEU 188 Cb -0.01 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 43.00 2x9r s LEU 188 CO 0.02 -1.02 1.65 -0.81 -1.32 0.00 0.00 176.35 174.87 2x9r n PRO 189 N 7.18 1.86 -1.72 0.98 -0.04 -1.26 -5.01 135.00 136.98 2x9r n PRO 189 Ca 0.14 0.67 -0.30 0.00 -0.04 0.00 0.00 63.50 63.98 2x9r n PRO 189 Cb 0.46 -2.43 0.07 0.00 -0.04 0.00 0.00 33.50 31.56 2x9r n PRO 189 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2x9r s ASP 190 N 2.13 4.86 0.02 3.54 2.15 -1.26 -4.73 116.67 123.37 2x9r s ASP 190 Ca 0.86 1.18 -0.04 0.00 0.43 0.00 0.00 52.55 54.98 2x9r s ASP 190 Cb -0.78 -1.92 -0.02 0.00 -0.30 0.00 0.00 42.92 39.90 2x9r s ASP 190 CO 0.47 -1.72 1.07 -0.09 -0.17 0.00 0.00 175.17 174.73 2x9r h ARG 191 N -0.92 -0.07 -0.96 4.34 9.65 -1.95 -2.77 114.38 121.70 2x9r h ARG 191 Ca -0.46 0.00 0.21 0.00 -1.10 0.00 0.00 59.98 58.63 2x9r h ARG 191 Cb 1.27 0.02 -0.18 0.00 -1.39 0.00 0.00 29.97 29.68 2x9r h ARG 191 CO 0.62 -0.05 -0.18 0.93 2.80 0.00 0.00 179.97 184.09 2x9r h GLU 192 N -0.07 0.00 -1.72 0.20 3.07 -2.05 0.93 114.58 114.94 2x9r h GLU 192 Ca 0.00 -0.00 0.51 0.00 -0.50 0.00 0.00 59.36 59.37 2x9r h GLU 192 Cb 0.09 -0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 27.91 2x9r h GLU 192 CO -0.06 0.00 1.22 -0.44 -1.40 0.00 0.00 179.01 178.33 2x9r h ASP 193 N 0.00 0.05 -2.90 1.42 3.32 -1.87 -3.36 116.42 113.08 2x9r h ASP 193 Ca 0.49 0.03 -0.65 0.00 0.02 0.00 0.00 57.03 56.92 2x9r h ASP 193 Cb 0.82 0.03 -0.08 0.00 0.22 0.00 0.00 39.33 40.32 2x9r h ASP 193 CO -0.97 -0.04 -0.53 -0.76 -1.72 0.00 0.00 179.24 175.23 2x9r s LEU 194 N -8.28 4.17 0.00 1.55 2.01 0.32 -4.90 118.68 113.55 2x9r s LEU 194 Ca -0.06 0.29 0.22 0.00 0.01 0.00 0.00 54.13 54.60 2x9r s LEU 194 Cb 0.27 -2.36 0.37 0.00 0.01 0.00 0.00 46.19 44.47 2x9r s LEU 194 CO 0.87 0.30 1.14 0.00 1.01 0.00 0.00 176.35 179.67 2x9r n ALA 195 N 1.27 2.34 -1.73 4.21 0.00 -1.26 -4.94 120.51 120.40 2x9r n ALA 195 Ca -0.14 -2.14 -0.39 0.00 0.00 0.00 0.00 53.44 50.77 2x9r n ALA 195 Cb 0.53 -0.70 0.04 0.00 0.00 0.00 0.00 19.45 19.32 2x9r n ALA 195 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2x9r n LEU 196 N 0.43 5.22 -1.75 0.00 4.32 -1.26 -4.84 117.00 119.11 2x9r n LEU 196 Ca 0.05 0.98 -0.02 0.00 -0.02 0.00 0.00 56.01 57.00 2x9r n LEU 196 Cb 1.08 -1.55 -0.02 0.00 -1.62 0.00 0.00 43.42 41.31 2x9r n LEU 196 CO -0.04 -0.70 0.79 -0.81 -1.22 0.00 0.00 177.39 175.42 2x9r n PRO 197 N -0.91 0.81 -4.25 3.23 -0.04 -1.26 -4.77 135.00 127.81 2x9r n PRO 197 Ca 0.10 -0.13 -0.22 0.00 -0.04 0.00 0.00 63.50 63.21 2x9r n PRO 197 Cb 0.44 -1.29 -0.17 0.00 -0.04 0.00 0.00 33.50 32.45 2x9r n PRO 197 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2x9r s VAL 198 N 0.83 0.75 -0.65 0.52 1.01 -1.26 -4.98 120.40 116.61 2x9r s VAL 198 Ca 0.09 -0.23 -0.23 0.00 0.00 0.00 0.00 61.98 61.60 2x9r s VAL 198 Cb 0.04 -0.74 0.06 0.00 0.00 0.00 0.00 36.38 35.74 2x9r s VAL 198 CO 0.00 0.28 1.00 0.21 0.00 0.00 0.00 175.10 176.59 2x9r s ASN 199 N 0.95 6.20 0.54 3.32 2.47 -1.26 -4.91 114.94 122.26 2x9r s ASN 199 Ca -0.10 -0.81 0.27 0.00 0.42 0.00 0.00 52.86 52.64 2x9r s ASN 199 Cb -0.15 -2.44 1.44 0.00 -1.45 0.00 0.00 41.25 38.66 2x9r s ASN 199 CO 0.00 -1.45 1.97 1.05 -3.72 0.00 0.00 177.10 174.95 2x9r h GLU 200 N 9.58 0.00 -0.62 0.43 9.09 -1.94 -1.73 114.58 129.39 2x9r h GLU 200 Ca -0.28 0.00 0.07 0.00 0.05 0.00 0.00 59.36 59.20 2x9r h GLU 200 Cb 1.07 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.11 2x9r h GLU 200 CO 1.18 0.00 0.31 1.96 0.05 0.00 0.00 179.01 182.51 2x9r h GLN 201 N 0.00 0.55 0.25 1.06 1.08 -1.95 -2.12 115.11 113.99 2x9r h GLN 201 Ca 0.27 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.42 2x9r h GLN 201 Cb 1.12 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.43 2x9r h GLN 201 CO -0.00 0.37 -0.12 -0.07 -0.95 0.00 0.00 178.83 178.05 2x9r h LEU 202 N 0.57 -0.29 -1.15 1.46 3.38 -1.72 -1.99 115.31 115.57 2x9r h LEU 202 Ca 0.29 -0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.42 2x9r h LEU 202 Cb 0.25 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.98 2x9r h LEU 202 CO -0.22 -0.19 0.61 0.58 0.09 0.00 0.00 178.44 179.31 2x9r h VAL 203 N -0.36 0.78 -0.56 1.22 2.07 -1.54 0.29 116.25 118.16 2x9r h VAL 203 Ca -0.03 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.13 2x9r h VAL 203 Cb 0.27 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 2x9r h VAL 203 CO 0.06 0.14 -0.02 0.40 0.02 0.00 0.00 177.57 178.17 2x9r h ILE 204 N 0.75 1.27 -0.09 4.57 2.04 -1.10 -2.54 117.51 122.41 2x9r h ILE 204 Ca 0.52 -1.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.17 2x9r h ILE 204 Cb 0.81 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 2x9r h ILE 204 CO -0.28 0.41 -0.24 -0.33 0.00 0.00 0.00 178.15 177.71 2x9r h GLU 205 N 0.88 0.16 -0.40 2.37 5.08 -0.02 -2.68 114.58 119.96 2x9r h GLU 205 Ca 0.16 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2x9r h GLU 205 Cb 0.56 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2x9r h GLU 205 CO 0.03 0.40 0.26 0.35 -1.00 0.00 0.00 179.01 179.05 2x9r h PHE 206 N 0.14 0.51 -0.00 4.33 3.57 -0.15 -2.43 116.94 122.92 2x9r h PHE 206 Ca 0.02 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2x9r h PHE 206 Cb 0.51 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.08 2x9r h PHE 206 CO 0.01 0.33 -0.02 0.66 -2.23 0.00 0.00 178.31 177.06 2x9r n TYR 207 N -4.80 0.00 0.35 0.41 0.53 -1.07 -3.22 117.16 109.37 2x9r n TYR 207 Ca 0.01 0.00 0.08 0.00 -1.02 0.00 0.00 57.90 56.97 2x9r n TYR 207 Cb 0.03 -0.05 0.23 0.00 -1.03 0.00 0.00 39.34 38.51 2x9r n TYR 207 CO 0.00 0.00 0.00 0.43 -1.02 0.00 0.00 176.86 176.27 2x9r n SER 208 N -0.77 2.78 -0.92 7.72 7.64 -0.92 -5.11 113.62 124.04 2x9r n SER 208 Ca 0.21 -2.01 0.12 0.00 1.01 0.00 0.00 58.87 58.20 2x9r n SER 208 Cb 0.20 -0.35 0.14 0.00 -1.01 0.00 0.00 64.21 63.19 2x9r n SER 208 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89