#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dwu h LYS 6 N 0.00 0.00 -0.23 -0.41 3.64 -1.98 -2.84 116.57 114.75 2dwu h LYS 6 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2dwu h LYS 6 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2dwu h LYS 6 CO 0.00 0.14 0.00 0.72 -2.27 0.00 0.00 179.45 178.04 2dwu n HIS 7 N -3.78 0.33 -2.30 1.91 8.25 -1.26 -4.90 115.22 113.47 2dwu n HIS 7 Ca -0.02 -0.52 -0.36 0.00 -0.26 0.00 0.00 57.72 56.56 2dwu n HIS 7 Cb 0.25 -0.05 -0.01 0.00 1.12 0.00 0.00 29.99 31.30 2dwu n HIS 7 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2dwu s SER 8 N -1.07 6.04 0.36 0.41 0.01 -1.08 -4.89 113.70 113.48 2dwu s SER 8 Ca 0.17 2.21 0.08 0.00 1.31 0.00 0.00 55.95 59.72 2dwu s SER 8 Cb 0.09 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.68 2dwu s SER 8 CO 0.10 -1.00 0.06 0.68 0.41 0.00 0.00 173.24 173.49 2dwu s VAL 9 N -1.68 2.57 -0.33 3.43 -7.23 0.61 -4.66 120.40 113.11 2dwu s VAL 9 Ca 0.67 -1.89 -0.17 0.00 -1.81 0.00 0.00 61.98 58.78 2dwu s VAL 9 Cb -0.25 -2.87 -0.01 0.00 0.56 0.00 0.00 36.38 33.81 2dwu s VAL 9 CO 0.30 -0.15 0.44 -0.63 -0.31 0.00 0.00 175.10 174.75 2dwu s ILE 10 N -2.54 5.10 0.20 -0.62 -1.09 0.84 -0.79 121.20 122.31 2dwu s ILE 10 Ca 0.36 0.27 -0.29 0.00 -2.23 0.00 0.00 60.65 58.76 2dwu s ILE 10 Cb 0.01 -3.87 -0.08 0.00 -1.58 0.00 0.00 42.46 36.93 2dwu s ILE 10 CO 0.20 -0.11 0.91 -0.83 -1.23 0.00 0.00 174.94 173.87 2dwu s GLY 11 N 1.73 3.06 -0.06 6.18 0.00 -0.44 -1.48 107.32 116.31 2dwu s GLY 11 Ca 0.16 0.55 0.01 0.00 0.00 0.00 0.00 44.72 45.44 2dwu s GLY 11 CO 0.12 1.17 -0.05 0.14 0.00 0.00 0.00 173.10 174.48 2dwu s VAL 12 N -0.96 0.64 0.10 1.40 1.01 0.10 -0.31 120.40 122.39 2dwu s VAL 12 Ca 0.41 -0.16 0.09 0.00 0.00 0.00 0.00 61.98 62.32 2dwu s VAL 12 Cb -0.25 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 2dwu s VAL 12 CO 0.30 0.26 -0.23 -1.48 0.00 0.00 0.00 175.10 173.96 2dwu s LEU 13 N 1.07 2.29 0.21 3.92 0.05 -0.64 -0.96 118.68 124.61 2dwu s LEU 13 Ca -0.08 -0.69 -0.17 0.00 0.05 0.00 0.00 54.13 53.23 2dwu s LEU 13 Cb -0.14 -1.00 0.02 0.00 -2.05 0.00 0.00 46.19 43.03 2dwu s LEU 13 CO -0.01 0.11 0.53 -0.62 -0.55 0.00 0.00 176.35 175.81 2dwu s ASP 14 N -1.88 -0.24 0.20 1.48 2.15 -0.48 -1.26 116.67 116.64 2dwu s ASP 14 Ca 0.09 -0.54 0.24 0.00 0.43 0.00 0.00 52.55 52.77 2dwu s ASP 14 Cb -0.10 0.59 0.91 0.00 -0.30 0.00 0.00 42.92 44.02 2dwu s ASP 14 CO 0.05 -1.08 1.71 -1.54 -0.17 0.00 0.00 175.17 174.14 2dwu n SER 15 N -0.35 0.60 0.00 -0.34 3.41 -1.26 -1.68 113.62 114.00 2dwu n SER 15 Ca -0.09 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 2dwu n SER 15 Cb 0.62 -0.75 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2dwu n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dwu n GLY 16 N 0.43 0.36 0.05 5.00 0.00 -1.26 -2.34 105.19 107.44 2dwu n GLY 16 Ca 0.03 0.46 0.11 0.00 0.00 0.00 0.00 46.02 46.63 2dwu n GLY 16 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2dwu n VAL 17 N 0.00 0.26 -0.34 1.61 3.14 -1.26 -4.33 118.33 117.41 2dwu n VAL 17 Ca 0.00 -0.44 0.08 0.00 -2.96 0.00 0.00 64.34 61.03 2dwu n VAL 17 Cb 0.00 -0.04 0.28 0.00 -1.06 0.00 0.00 33.84 33.02 2dwu n VAL 17 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2dwu h GLY 18 N 4.17 1.52 1.50 7.55 0.00 -1.95 -1.08 103.07 114.79 2dwu h GLY 18 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2dwu h GLY 18 CO 0.00 0.15 0.18 0.61 0.00 0.00 0.00 176.54 177.48 2dwu n GLY 19 N -1.37 -0.70 0.30 4.60 0.00 -1.26 -1.23 105.19 105.52 2dwu n GLY 19 Ca 0.18 0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.50 2dwu n GLY 19 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dwu h LEU 20 N 0.00 0.00 -0.94 0.99 3.38 -1.49 -0.26 115.31 116.99 2dwu h LEU 20 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2dwu h LEU 20 Cb 0.37 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2dwu h LEU 20 CO 0.00 0.01 0.04 0.71 0.09 0.00 0.00 178.44 179.29 2dwu h THR 21 N 0.00 1.24 -0.09 0.22 1.35 -1.40 -0.45 112.91 113.79 2dwu h THR 21 Ca -0.00 -0.95 -0.10 0.00 -0.55 0.00 0.00 66.41 64.81 2dwu h THR 21 Cb 0.02 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 67.26 2dwu h THR 21 CO 0.00 0.34 -0.35 0.58 -0.25 0.00 0.00 175.52 175.84 2dwu h VAL 22 N 0.77 1.40 -0.82 6.82 2.07 -1.34 -2.79 116.25 122.36 2dwu h VAL 22 Ca 0.16 -1.71 0.05 0.00 0.82 0.00 0.00 66.70 66.01 2dwu h VAL 22 Cb 0.41 2.25 -0.06 0.00 -1.52 0.00 0.00 31.29 32.37 2dwu h VAL 22 CO 0.01 0.50 0.51 0.00 0.02 0.00 0.00 177.57 178.61 2dwu h ALA 23 N 0.46 1.11 -0.92 1.67 0.00 -0.97 -1.58 119.26 119.02 2dwu h ALA 23 Ca -0.02 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2dwu h ALA 23 Cb 0.99 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.50 2dwu h ALA 23 CO 0.07 0.27 0.61 1.03 0.00 0.00 0.00 179.25 181.22 2dwu h SER 24 N 0.94 1.06 0.22 0.00 0.87 -1.06 -0.36 113.55 115.23 2dwu h SER 24 Ca 0.35 -0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.75 2dwu h SER 24 Cb 0.12 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 2dwu h SER 24 CO -0.16 0.77 -0.49 -0.33 -0.53 0.00 0.00 176.83 176.09 2dwu h GLU 25 N 1.25 0.31 -0.35 2.24 4.39 -1.09 -1.07 114.58 120.27 2dwu h GLU 25 Ca 0.34 -0.18 -0.10 0.00 0.34 0.00 0.00 59.36 59.75 2dwu h GLU 25 Cb -0.14 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 2dwu h GLU 25 CO -0.07 0.74 -0.19 0.82 -1.16 0.00 0.00 179.01 179.15 2dwu h ILE 26 N 0.25 1.29 -0.87 3.13 2.04 -0.89 -0.20 117.51 122.25 2dwu h ILE 26 Ca 0.01 -1.32 0.00 0.00 1.00 0.00 0.00 64.86 64.56 2dwu h ILE 26 Cb 0.96 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.38 2dwu h ILE 26 CO 0.08 0.43 0.56 0.40 0.00 0.00 0.00 178.15 179.62 2dwu h ILE 27 N 0.53 1.23 -0.03 -0.67 2.04 -0.89 0.20 117.51 119.93 2dwu h ILE 27 Ca 0.08 -0.45 -0.08 0.00 1.00 0.00 0.00 64.86 65.41 2dwu h ILE 27 Cb 0.74 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2dwu h ILE 27 CO 0.06 0.23 -0.28 -0.09 0.00 0.00 0.00 178.15 178.07 2dwu h ARG 28 N 1.19 0.24 0.00 2.37 2.43 -0.96 -3.14 114.38 116.51 2dwu h ARG 28 Ca 0.32 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2dwu h ARG 28 Cb -0.11 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 2dwu h ARG 28 CO -0.07 0.90 -0.57 1.96 -1.51 0.00 0.00 179.97 180.69 2dwu h GLN 29 N -0.36 0.00 -2.13 0.20 4.20 -0.97 -3.37 115.11 112.69 2dwu h GLN 29 Ca -0.03 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.12 2dwu h GLN 29 Cb 0.98 0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.35 2dwu h GLN 29 CO 0.06 0.02 -0.86 1.28 -0.67 0.00 0.00 178.83 178.65 2dwu n LEU 30 N -2.88 2.44 0.00 1.46 4.77 0.70 -4.96 117.00 118.53 2dwu n LEU 30 Ca 0.02 -5.23 0.01 0.00 -0.03 0.00 0.00 56.01 50.78 2dwu n LEU 30 Cb 0.55 -0.02 0.06 0.00 -2.33 0.00 0.00 43.42 41.68 2dwu n LEU 30 CO 0.38 2.19 0.53 -0.81 -1.33 0.00 0.00 177.39 178.34 2dwu n PRO 31 N 0.58 0.01 0.00 3.23 -0.04 -1.19 -1.81 135.00 135.78 2dwu n PRO 31 Ca 0.27 0.42 0.11 0.00 -0.04 0.00 0.00 63.50 64.26 2dwu n PRO 31 Cb 0.49 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.48 2dwu n PRO 31 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2dwu n LYS 32 N -1.47 0.46 -2.76 0.54 5.02 -1.26 -4.58 118.16 114.11 2dwu n LYS 32 Ca 0.01 -0.36 -0.31 0.00 -2.02 0.00 0.00 58.31 55.63 2dwu n LYS 32 Cb 0.03 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.51 2dwu n LYS 32 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2dwu s GLU 33 N -2.79 3.81 -0.14 1.97 0.41 -0.75 -3.95 118.70 117.27 2dwu s GLU 33 Ca 0.13 0.57 -0.02 0.00 -0.41 0.00 0.00 54.97 55.24 2dwu s GLU 33 Cb 0.17 -2.34 -0.02 0.00 -1.78 0.00 0.00 34.13 30.16 2dwu s GLU 33 CO 0.71 -0.09 -0.07 -1.12 -0.49 0.00 0.00 175.26 174.21 2dwu s SER 34 N -3.14 4.55 -0.12 -0.19 0.01 -1.26 -4.81 113.70 108.73 2dwu s SER 34 Ca 0.53 -0.18 -0.14 0.00 1.31 0.00 0.00 55.95 57.48 2dwu s SER 34 Cb -0.10 -1.67 -0.05 0.00 0.21 0.00 0.00 66.02 64.41 2dwu s SER 34 CO 0.31 0.19 0.31 -0.63 0.41 0.00 0.00 173.24 173.83 2dwu s ILE 35 N 0.24 5.27 -0.29 1.44 -1.09 -1.26 -0.11 121.20 125.40 2dwu s ILE 35 Ca -0.05 0.60 0.01 0.00 -2.23 0.00 0.00 60.65 58.98 2dwu s ILE 35 Cb -0.14 -3.64 0.08 0.00 -1.58 0.00 0.00 42.46 37.18 2dwu s ILE 35 CO 0.04 0.45 0.03 0.00 -1.23 0.00 0.00 174.94 174.22 2dwu s TYR 37 N 1.35 2.94 -0.07 0.00 5.04 -0.05 -0.72 117.35 125.83 2dwu s TYR 37 Ca 0.04 -0.05 0.01 0.00 -2.44 0.00 0.00 57.07 54.63 2dwu s TYR 37 Cb -0.18 -1.74 0.02 0.00 0.35 0.00 0.00 41.96 40.40 2dwu s TYR 37 CO -0.13 0.26 -0.09 -1.50 -1.34 0.00 0.00 175.55 172.76 2dwu s ILE 38 N -0.62 0.93 -0.14 3.14 2.07 -0.13 -0.25 121.20 126.20 2dwu s ILE 38 Ca 0.09 -0.32 0.02 0.00 -1.41 0.00 0.00 60.65 59.03 2dwu s ILE 38 Cb -0.12 -0.90 0.00 0.00 0.13 0.00 0.00 42.46 41.58 2dwu s ILE 38 CO 0.02 0.32 -0.19 -0.83 -1.91 0.00 0.00 174.94 172.35 2dwu s GLY 39 N 1.01 1.41 -0.80 1.50 0.00 -0.18 -1.38 107.32 108.88 2dwu s GLY 39 Ca -0.09 -1.04 -0.05 0.00 0.00 0.00 0.00 44.72 43.54 2dwu s GLY 39 CO -0.00 -0.06 2.68 1.34 0.00 0.00 0.00 173.10 177.06 2dwu n ASP 40 N 3.95 7.09 -0.19 1.64 2.03 -0.67 -1.89 116.55 128.51 2dwu n ASP 40 Ca -0.19 -3.11 0.23 0.00 0.52 0.00 0.00 54.79 52.23 2dwu n ASP 40 Cb 0.52 -1.31 0.62 0.00 -0.72 0.00 0.00 41.12 40.24 2dwu n ASP 40 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2dwu h ASN 41 N 3.69 0.19 0.07 1.67 4.21 -1.78 0.16 115.58 123.79 2dwu h ASN 41 Ca 0.52 0.02 -0.01 0.00 1.21 0.00 0.00 56.30 58.04 2dwu h ASN 41 Cb 0.59 -0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 37.78 2dwu h ASN 41 CO 1.10 0.07 -0.02 -0.08 -1.29 0.00 0.00 177.43 177.21 2dwu h GLU 42 N 0.19 0.00 -0.13 0.81 4.81 -1.85 -2.59 114.58 115.82 2dwu h GLU 42 Ca 0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 2dwu h GLU 42 Cb 1.38 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2dwu h GLU 42 CO -0.09 0.02 0.00 0.54 -0.73 0.00 0.00 179.01 178.76 2dwu n ARG 43 N -3.83 2.61 -2.64 1.92 1.74 0.02 -5.00 116.66 111.47 2dwu n ARG 43 Ca -0.03 -2.06 -0.39 0.00 -0.77 0.00 0.00 57.85 54.60 2dwu n ARG 43 Cb 0.11 -1.29 -0.05 0.00 -1.02 0.00 0.00 32.46 30.21 2dwu n ARG 43 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dwu s PRO 45 N -1.56 3.96 0.12 0.00 0.04 -1.26 -5.02 135.00 131.28 2dwu s PRO 45 Ca 0.46 0.64 0.20 0.00 0.04 0.00 0.00 61.00 62.34 2dwu s PRO 45 Cb -0.26 -2.41 -0.09 0.00 0.04 0.00 0.00 34.50 31.78 2dwu s PRO 45 CO 0.33 0.10 0.89 0.66 0.04 0.00 0.00 177.00 179.02 2dwu n TYR 46 N -0.60 0.88 -0.29 0.56 4.02 -1.26 -4.50 117.16 115.96 2dwu n TYR 46 Ca 0.03 0.27 0.08 0.00 -0.01 0.00 0.00 57.90 58.27 2dwu n TYR 46 Cb 0.53 -0.97 0.19 0.00 -0.02 0.00 0.00 39.34 39.07 2dwu n TYR 46 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2dwu h GLY 47 N 3.89 0.92 -1.25 2.72 0.00 -1.96 -0.70 103.07 106.69 2dwu h GLY 47 Ca -0.08 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.41 2dwu h GLY 47 CO 0.02 -0.36 0.00 -1.55 0.00 0.00 0.00 176.54 174.65 2dwu n PRO 48 N -5.43 1.95 -2.18 4.80 -0.04 -1.26 -1.65 135.00 131.20 2dwu n PRO 48 Ca 0.16 -1.44 -0.30 0.00 -0.04 0.00 0.00 63.50 61.89 2dwu n PRO 48 Cb 0.55 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2dwu n PRO 48 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dwu s ARG 49 N -1.71 3.62 0.67 0.54 0.52 -0.27 -5.02 118.95 117.30 2dwu s ARG 49 Ca 0.34 0.60 -0.15 0.00 -0.52 0.00 0.00 55.73 56.00 2dwu s ARG 49 Cb 0.19 -2.18 0.01 0.00 0.52 0.00 0.00 34.95 33.48 2dwu s ARG 49 CO 0.27 -0.42 1.12 -1.54 0.02 0.00 0.00 175.30 174.75 2dwu s SER 50 N -4.01 5.00 0.19 0.23 1.04 -1.26 -4.87 113.70 110.01 2dwu s SER 50 Ca 0.53 2.01 -0.11 0.00 0.48 0.00 0.00 55.95 58.86 2dwu s SER 50 Cb -0.11 -2.55 0.12 0.00 0.10 0.00 0.00 66.02 63.58 2dwu s SER 50 CO 0.48 -1.71 1.83 0.58 0.98 0.00 0.00 173.24 175.40 2dwu h VAL 51 N -0.07 1.20 -0.67 5.02 2.07 -1.96 -1.82 116.25 120.01 2dwu h VAL 51 Ca -0.47 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 66.61 2dwu h VAL 51 Cb 1.25 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 2dwu h VAL 51 CO 0.54 0.21 0.44 -0.33 0.02 0.00 0.00 177.57 178.44 2dwu h GLU 52 N 0.91 0.89 -0.31 1.57 3.07 -1.95 -0.72 114.58 118.05 2dwu h GLU 52 Ca 0.24 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 59.01 2dwu h GLU 52 Cb -0.01 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.69 2dwu h GLU 52 CO -0.04 0.60 0.09 1.49 -1.40 0.00 0.00 179.01 179.75 2dwu h GLU 53 N 0.91 0.50 -0.57 2.33 4.81 -1.87 -2.15 114.58 118.54 2dwu h GLU 53 Ca 0.25 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2dwu h GLU 53 Cb -0.09 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 2dwu h GLU 53 CO -0.05 0.55 0.36 0.28 -0.73 0.00 0.00 179.01 179.42 2dwu h VAL 54 N 0.35 1.16 -0.79 0.32 2.07 -1.06 -1.13 116.25 117.17 2dwu h VAL 54 Ca 0.10 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.35 2dwu h VAL 54 Cb 0.27 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.33 2dwu h VAL 54 CO -0.00 0.15 0.49 1.56 0.02 0.00 0.00 177.57 179.80 2dwu h GLN 55 N 0.76 0.91 -0.41 1.57 4.20 -1.00 0.09 115.11 121.23 2dwu h GLN 55 Ca 0.21 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 2dwu h GLN 55 Cb -0.06 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 2dwu h GLN 55 CO -0.04 0.60 0.22 1.03 -0.67 0.00 0.00 178.83 179.97 2dwu h SER 56 N 0.94 0.53 -0.68 1.46 0.87 -0.73 -1.12 113.55 114.82 2dwu h SER 56 Ca 0.33 -0.10 -0.06 0.00 -1.23 0.00 0.00 61.79 60.73 2dwu h SER 56 Cb 0.08 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 2dwu h SER 56 CO -0.14 0.48 0.21 -0.26 -0.53 0.00 0.00 176.83 176.59 2dwu h PHE 57 N 0.54 1.10 -0.44 2.24 0.04 -0.69 -1.89 116.94 117.84 2dwu h PHE 57 Ca 0.15 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 2dwu h PHE 57 Cb 0.07 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.89 2dwu h PHE 57 CO -0.02 0.89 0.19 0.28 -0.60 0.00 0.00 178.31 179.05 2dwu h VAL 58 N 1.00 1.19 0.00 -0.55 2.07 -0.74 -1.58 116.25 117.64 2dwu h VAL 58 Ca 0.22 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 2dwu h VAL 58 Cb 0.31 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2dwu h VAL 58 CO -0.01 0.21 -0.23 -0.26 0.02 0.00 0.00 177.57 177.31 2dwu h PHE 59 N 0.57 0.00 -0.53 1.57 -1.00 -0.96 -0.48 116.94 116.11 2dwu h PHE 59 Ca 0.15 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.83 2dwu h PHE 59 Cb 0.16 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.70 2dwu h PHE 59 CO -0.00 0.23 -0.06 0.93 -1.61 0.00 0.00 178.31 177.80 2dwu h GLU 60 N 0.00 0.95 -0.21 1.51 5.08 -0.87 -1.54 114.58 119.50 2dwu h GLU 60 Ca -0.00 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 57.94 2dwu h GLU 60 Cb 0.41 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 2dwu h GLU 60 CO 0.03 0.97 -0.32 0.52 -1.00 0.00 0.00 179.01 179.21 2dwu h MET 61 N 0.86 0.43 -0.40 2.33 2.86 -0.30 -2.52 114.93 118.18 2dwu h MET 61 Ca 0.15 -0.18 -0.11 0.00 -2.06 0.00 0.00 59.70 57.50 2dwu h MET 61 Cb 0.58 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 2dwu h MET 61 CO 0.04 0.70 -0.19 0.28 1.06 0.00 0.00 176.91 178.80 2dwu h VAL 62 N 0.37 1.27 -0.48 -2.22 2.07 -0.83 -1.05 116.25 115.38 2dwu h VAL 62 Ca 0.05 -1.28 -0.05 0.00 0.82 0.00 0.00 66.70 66.24 2dwu h VAL 62 Cb 0.74 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 2dwu h VAL 62 CO 0.06 0.43 0.10 -0.33 0.02 0.00 0.00 177.57 177.85 2dwu h GLU 63 N 0.68 0.74 -0.06 1.57 4.39 -1.03 -0.67 114.58 120.20 2dwu h GLU 63 Ca 0.10 -0.15 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2dwu h GLU 63 Cb 0.68 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2dwu h GLU 63 CO 0.05 0.68 0.00 0.35 -1.16 0.00 0.00 179.01 178.94 2dwu h PHE 64 N 0.71 0.11 0.00 4.33 3.57 -1.00 -3.08 116.94 121.58 2dwu h PHE 64 Ca 0.16 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 2dwu h PHE 64 Cb 0.29 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 2dwu h PHE 64 CO 0.01 0.36 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.26 2dwu h LEU 65 N -0.18 0.00 -0.66 0.59 3.38 -0.85 -2.53 115.31 115.07 2dwu h LEU 65 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2dwu h LEU 65 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2dwu h LEU 65 CO 0.00 0.12 0.00 0.29 0.09 0.00 0.00 178.44 178.94 2dwu n LYS 66 N -3.67 0.10 0.06 1.13 5.02 -0.29 -1.23 118.16 119.27 2dwu n LYS 66 Ca -0.02 0.48 0.11 0.00 -2.02 0.00 0.00 58.31 56.86 2dwu n LYS 66 Cb 0.24 -1.75 0.44 0.00 -0.02 0.00 0.00 35.03 33.94 2dwu n LYS 66 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2dwu n GLN 67 N -1.95 0.10 -4.17 1.97 6.02 -0.95 -4.76 117.38 113.64 2dwu n GLN 67 Ca 0.01 0.25 -0.24 0.00 -0.01 0.00 0.00 57.00 57.01 2dwu n GLN 67 Cb 0.10 -1.66 -0.06 0.00 1.02 0.00 0.00 30.24 29.64 2dwu n GLN 67 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2dwu s PHE 68 N -3.11 2.97 -1.02 1.08 0.08 -0.37 -5.04 117.98 112.57 2dwu s PHE 68 Ca 0.08 -0.12 -0.23 0.00 0.12 0.00 0.00 56.93 56.78 2dwu s PHE 68 Cb 0.12 -1.37 0.02 0.00 -0.57 0.00 0.00 43.02 41.22 2dwu s PHE 68 CO 0.41 0.54 1.62 -1.25 -0.10 0.00 0.00 175.22 176.44 2dwu s PRO 69 N -3.48 3.31 0.00 0.24 0.04 -1.26 -4.97 135.00 128.89 2dwu s PRO 69 Ca 0.31 -0.98 -0.27 0.00 0.04 0.00 0.00 61.00 60.10 2dwu s PRO 69 Cb -0.08 -5.29 -0.04 0.00 0.04 0.00 0.00 34.50 29.13 2dwu s PRO 69 CO 0.22 -2.58 0.86 -0.51 0.04 0.00 0.00 177.00 175.03 2dwu s LEU 70 N 6.47 4.38 -0.02 -3.56 1.43 -1.26 -0.28 118.68 125.84 2dwu s LEU 70 Ca 0.54 1.51 0.22 0.00 -1.03 0.00 0.00 54.13 55.36 2dwu s LEU 70 Cb -0.01 -3.38 -0.32 0.00 0.03 0.00 0.00 46.19 42.51 2dwu s LEU 70 CO -0.05 -0.15 0.51 2.29 0.23 0.00 0.00 176.35 179.17 2dwu n LYS 71 N 3.55 0.66 -3.48 1.70 2.85 0.03 -4.84 118.16 118.63 2dwu n LYS 71 Ca 0.02 -0.18 -0.10 0.00 -1.05 0.00 0.00 58.31 57.01 2dwu n LYS 71 Cb 0.51 -1.54 -0.02 0.00 -0.65 0.00 0.00 35.03 33.33 2dwu n LYS 71 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2dwu s ALA 72 N -3.49 -1.74 -0.06 0.58 0.00 -1.25 -4.19 121.76 111.62 2dwu s ALA 72 Ca -0.08 0.80 0.03 0.00 0.00 0.00 0.00 51.96 52.72 2dwu s ALA 72 Cb 0.14 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.85 2dwu s ALA 72 CO 0.90 -0.73 -0.15 -1.17 0.00 0.00 0.00 175.76 174.61 2dwu s LEU 73 N -2.59 1.81 -0.18 0.00 2.96 -0.28 -1.33 118.68 119.08 2dwu s LEU 73 Ca 0.04 -0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 53.58 2dwu s LEU 73 Cb -0.01 -0.93 -0.01 0.00 0.50 0.00 0.00 46.19 45.74 2dwu s LEU 73 CO -0.10 0.10 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.25 2dwu s VAL 74 N 0.34 3.24 -0.65 1.68 1.01 0.58 -0.45 120.40 126.15 2dwu s VAL 74 Ca -0.10 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.13 2dwu s VAL 74 Cb -0.14 -2.42 0.11 0.00 0.00 0.00 0.00 36.38 33.93 2dwu s VAL 74 CO 0.03 0.48 0.78 -0.69 0.00 0.00 0.00 175.10 175.70 2dwu s VAL 75 N 0.91 4.83 0.03 2.92 1.01 -0.03 -1.62 120.40 128.45 2dwu s VAL 75 Ca -0.02 -1.13 0.21 0.00 0.00 0.00 0.00 61.98 61.04 2dwu s VAL 75 Cb -0.15 -4.54 0.18 0.00 0.00 0.00 0.00 36.38 31.87 2dwu s VAL 75 CO 0.00 -1.19 1.70 0.00 0.00 0.00 0.00 175.10 175.61 2dwu h ALA 76 N 9.07 0.92 -2.28 5.51 0.00 -1.47 -2.95 119.26 128.05 2dwu h ALA 76 Ca -0.21 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 53.83 2dwu h ALA 76 Cb 1.07 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 2dwu h ALA 76 CO 1.08 0.39 0.51 0.00 0.00 0.00 0.00 179.25 181.23 2dwu h ASN 78 N 7.44 0.69 -0.37 0.00 2.35 -1.85 0.00 115.58 123.83 2dwu h ASN 78 Ca -0.26 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.33 2dwu h ASN 78 Cb 1.11 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 39.28 2dwu h ASN 78 CO 0.88 0.71 0.11 0.74 -1.65 0.00 0.00 177.43 178.21 2dwu h THR 79 N 0.70 1.22 -0.62 2.81 2.02 -1.92 -0.83 112.91 116.29 2dwu h THR 79 Ca 0.15 -0.71 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 2dwu h THR 79 Cb 0.32 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2dwu h THR 79 CO 0.00 0.25 0.11 0.00 0.37 0.00 0.00 175.52 176.25 2dwu h ALA 80 N 0.95 0.82 -0.53 6.16 0.00 -1.90 -2.30 119.26 122.47 2dwu h ALA 80 Ca 0.12 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2dwu h ALA 80 Cb 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2dwu h ALA 80 CO -0.00 0.57 0.19 0.00 0.00 0.00 0.00 179.25 180.01 2dwu h ALA 81 N 1.03 0.69 -0.83 0.00 0.00 -0.82 0.14 119.26 119.46 2dwu h ALA 81 Ca 0.19 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2dwu h ALA 81 Cb 0.42 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2dwu h ALA 81 CO 0.01 0.31 0.55 0.00 0.00 0.00 0.00 179.25 180.13 2dwu h ALA 82 N 1.05 1.43 0.00 0.00 0.00 -0.96 -1.48 119.26 119.29 2dwu h ALA 82 Ca 0.17 -0.05 -0.26 0.00 0.00 0.00 0.00 54.91 54.77 2dwu h ALA 82 Cb 0.23 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2dwu h ALA 82 CO -0.01 0.52 -1.42 0.00 0.00 0.00 0.00 179.25 178.34 2dwu h ALA 83 N 1.49 0.61 0.00 0.00 0.00 -1.00 -3.43 119.26 116.93 2dwu h ALA 83 Ca 0.31 -1.23 0.00 0.00 0.00 0.00 0.00 54.91 53.99 2dwu h ALA 83 Cb -0.09 0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2dwu h ALA 83 CO -0.07 1.44 0.00 2.41 0.00 0.00 0.00 179.25 183.03 2dwu n THR 84 N -3.17 0.00 -0.07 0.00 -1.04 0.47 -4.81 114.28 105.66 2dwu n THR 84 Ca -0.10 -0.34 -0.07 0.00 -2.04 0.00 0.00 64.05 61.50 2dwu n THR 84 Cb 1.00 1.20 -0.01 0.00 -1.82 0.00 0.00 70.33 70.70 2dwu n THR 84 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2dwu h LEU 85 N 0.00 -0.30 -0.57 -4.42 5.85 -1.40 -1.35 115.31 113.13 2dwu h LEU 85 Ca 0.00 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2dwu h LEU 85 Cb 0.10 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2dwu h LEU 85 CO 0.00 -0.11 0.37 0.00 -0.34 0.00 0.00 178.44 178.36 2dwu h ALA 86 N 1.23 0.72 -0.81 1.25 0.00 -1.90 -0.22 119.26 119.53 2dwu h ALA 86 Ca 0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2dwu h ALA 86 Cb 0.23 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2dwu h ALA 86 CO -0.29 0.14 0.42 0.00 0.00 0.00 0.00 179.25 179.52 2dwu h ALA 87 N 1.21 1.21 -0.20 0.00 0.00 -1.81 -1.92 119.26 117.75 2dwu h ALA 87 Ca 0.21 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2dwu h ALA 87 Cb -0.07 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 2dwu h ALA 87 CO -0.05 0.62 -0.31 -0.07 0.00 0.00 0.00 179.25 179.44 2dwu h LEU 88 N 1.14 0.62 -1.59 0.00 -0.00 -0.65 -1.57 115.31 113.26 2dwu h LEU 88 Ca 0.28 -0.52 -0.01 0.00 -0.00 0.00 0.00 57.88 57.63 2dwu h LEU 88 Cb 0.07 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 40.54 2dwu h LEU 88 CO -0.04 1.02 0.11 1.56 -0.00 0.00 0.00 178.44 181.09 2dwu h GLN 89 N 0.24 0.38 -0.08 1.13 4.20 -0.90 0.06 115.11 120.15 2dwu h GLN 89 Ca 0.02 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.48 2dwu h GLN 89 Cb 0.89 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 28.60 2dwu h GLN 89 CO 0.07 0.32 -0.78 1.49 -0.67 0.00 0.00 178.83 179.26 2dwu h GLU 90 N 0.38 0.66 0.03 1.46 4.57 -1.27 -3.36 114.58 117.05 2dwu h GLU 90 Ca 0.10 -0.61 -0.24 0.00 -1.18 0.00 0.00 59.36 57.43 2dwu h GLU 90 Cb 0.08 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2dwu h GLU 90 CO -0.01 1.22 -1.01 0.00 -1.18 0.00 0.00 179.01 178.03 2dwu h ALA 91 N 0.46 0.30 -2.42 2.92 0.00 -0.71 -3.46 119.26 116.34 2dwu h ALA 91 Ca -0.08 -0.74 -0.52 0.00 0.00 0.00 0.00 54.91 53.58 2dwu h ALA 91 Cb 1.43 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 2dwu h ALA 91 CO 0.16 0.83 -0.18 -0.51 0.00 0.00 0.00 179.25 179.54 2dwu s LEU 92 N -7.66 4.08 0.03 0.00 1.43 -0.04 -5.01 118.68 111.50 2dwu s LEU 92 Ca -0.06 0.63 0.20 0.00 -1.03 0.00 0.00 54.13 53.87 2dwu s LEU 92 Cb 0.08 -3.44 -0.19 0.00 0.03 0.00 0.00 46.19 42.67 2dwu s LEU 92 CO 0.87 -0.18 0.65 -1.20 0.23 0.00 0.00 176.35 176.73 2dwu n SER 93 N -0.99 0.43 -4.88 2.29 7.64 -1.26 -4.85 113.62 111.99 2dwu n SER 93 Ca -0.03 0.18 -0.30 0.00 1.01 0.00 0.00 58.87 59.73 2dwu n SER 93 Cb 0.54 1.03 0.01 0.00 -1.01 0.00 0.00 64.21 64.78 2dwu n SER 93 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2dwu s ILE 94 N -3.20 4.57 0.27 0.44 -4.36 -1.26 -5.01 121.20 112.65 2dwu s ILE 94 Ca -0.05 0.61 -0.30 0.00 -0.26 0.00 0.00 60.65 60.65 2dwu s ILE 94 Cb 0.10 -3.80 -0.10 0.00 1.25 0.00 0.00 42.46 39.91 2dwu s ILE 94 CO 0.84 -0.98 1.43 -2.84 0.24 0.00 0.00 174.94 173.64 2dwu s PRO 95 N -5.08 4.26 -0.18 0.37 0.02 -1.26 -4.86 135.00 128.28 2dwu s PRO 95 Ca 0.53 2.32 0.01 0.00 0.02 0.00 0.00 61.00 63.88 2dwu s PRO 95 Cb -0.11 -3.09 0.02 0.00 0.02 0.00 0.00 34.50 31.34 2dwu s PRO 95 CO 0.51 -0.40 -0.20 0.08 -0.33 0.00 0.00 177.00 176.66 2dwu s VAL 96 N -0.25 2.10 -0.21 3.83 1.01 -1.26 -1.12 120.40 124.50 2dwu s VAL 96 Ca 0.57 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 2dwu s VAL 96 Cb -0.42 -1.88 -0.00 0.00 0.00 0.00 0.00 36.38 34.08 2dwu s VAL 96 CO 0.46 0.54 -0.07 -0.63 0.00 0.00 0.00 175.10 175.40 2dwu s ILE 97 N 1.22 3.14 0.46 2.22 1.09 0.40 -4.96 121.20 124.77 2dwu s ILE 97 Ca 0.03 -0.58 0.06 0.00 -1.10 0.00 0.00 60.65 59.06 2dwu s ILE 97 Cb -0.13 -2.41 0.02 0.00 -1.06 0.00 0.00 42.46 38.87 2dwu s ILE 97 CO -0.11 0.45 0.63 -0.83 -0.10 0.00 0.00 174.94 174.98 2dwu s GLY 98 N 1.39 1.90 0.00 6.18 0.00 -1.26 -0.85 107.32 114.67 2dwu s GLY 98 Ca 0.05 -1.55 0.26 0.00 0.00 0.00 0.00 44.72 43.48 2dwu s GLY 98 CO -0.04 -1.34 1.59 3.33 0.00 0.00 0.00 173.10 176.63 2dwu n VAL 99 N -2.00 0.00 -0.06 1.40 0.24 -1.11 -4.36 118.33 112.43 2dwu n VAL 99 Ca 0.08 -0.04 -0.10 0.00 -2.04 0.00 0.00 64.34 62.24 2dwu n VAL 99 Cb 0.59 0.12 -0.09 0.00 -1.47 0.00 0.00 33.84 32.99 2dwu n VAL 99 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2dwu h ILE 100 N 0.35 1.29 -0.81 1.34 2.04 -1.92 -3.29 117.51 116.52 2dwu h ILE 100 Ca 0.00 -1.95 0.00 0.00 1.00 0.00 0.00 64.86 63.91 2dwu h ILE 100 Cb 0.48 2.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.96 2dwu h ILE 100 CO 0.00 0.44 0.51 0.45 0.00 0.00 0.00 178.15 179.54 2dwu h HIS 101 N -0.99 1.04 -0.59 1.37 3.86 -1.96 -1.51 115.15 116.37 2dwu h HIS 101 Ca -0.00 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.17 2dwu h HIS 101 Cb 0.72 -0.35 -0.03 0.00 1.06 0.00 0.00 27.41 28.81 2dwu h HIS 101 CO 0.20 0.68 0.16 -1.35 0.86 0.00 0.00 177.93 178.47 2dwu h PRO 102 N 1.11 0.90 -0.31 2.45 0.11 -1.76 -0.32 132.00 134.17 2dwu h PRO 102 Ca 0.29 -0.18 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 2dwu h PRO 102 Cb -0.08 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 30.88 2dwu h PRO 102 CO -0.06 0.79 -0.12 0.78 -0.21 0.00 0.00 178.00 179.18 2dwu h GLY 103 N 1.00 0.68 0.92 -0.55 0.00 -1.47 -1.78 103.07 101.87 2dwu h GLY 103 Ca 0.19 -0.60 0.02 0.00 0.00 0.00 0.00 47.33 46.94 2dwu h GLY 103 CO -0.00 0.54 0.28 0.00 0.00 0.00 0.00 176.54 177.35 2dwu h ALA 104 N 0.77 0.57 -0.65 3.60 0.00 -0.97 -0.61 119.26 121.98 2dwu h ALA 104 Ca 0.07 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.99 2dwu h ALA 104 Cb 0.64 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2dwu h ALA 104 CO 0.04 -0.03 0.40 -0.09 0.00 0.00 0.00 179.25 179.57 2dwu h ARG 105 N 0.56 0.77 -0.35 0.00 2.43 -0.95 -1.85 114.38 114.98 2dwu h ARG 105 Ca 0.18 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.20 2dwu h ARG 105 Cb -0.01 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 2dwu h ARG 105 CO -0.07 0.51 -0.20 0.00 -1.51 0.00 0.00 179.97 178.70 2dwu h ALA 106 N 1.27 0.99 -0.90 2.80 0.00 -1.08 -2.35 119.26 119.99 2dwu h ALA 106 Ca 0.26 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2dwu h ALA 106 Cb 0.01 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2dwu h ALA 106 CO -0.10 0.60 0.48 0.00 0.00 0.00 0.00 179.25 180.23 2dwu h ALA 107 N 1.18 1.16 -0.42 0.00 0.00 -0.43 -1.56 119.26 119.19 2dwu h ALA 107 Ca 0.09 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2dwu h ALA 107 Cb 0.67 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2dwu h ALA 107 CO 0.05 0.67 0.02 0.82 0.00 0.00 0.00 179.25 180.81 2dwu h ILE 108 N 1.26 1.22 -0.54 0.00 2.04 -1.07 -1.19 117.51 119.23 2dwu h ILE 108 Ca 0.32 -0.87 -0.10 0.00 1.00 0.00 0.00 64.86 65.21 2dwu h ILE 108 Cb 0.04 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2dwu h ILE 108 CO -0.05 0.30 -0.06 0.50 0.00 0.00 0.00 178.15 178.85 2dwu h LYS 109 N 0.63 0.97 0.00 2.37 3.64 -0.84 -3.31 116.57 120.03 2dwu h LYS 109 Ca 0.13 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 2dwu h LYS 109 Cb 0.37 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 2dwu h LYS 109 CO 0.01 0.99 -1.27 1.33 -2.27 0.00 0.00 179.45 178.24 2dwu n VAL 110 N -4.17 0.33 -2.31 2.00 0.24 -0.66 -4.93 118.33 108.85 2dwu n VAL 110 Ca 0.02 -0.45 -0.39 0.00 -2.04 0.00 0.00 64.34 61.48 2dwu n VAL 110 Cb 0.37 -0.10 -0.02 0.00 -1.47 0.00 0.00 33.84 32.61 2dwu n VAL 110 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2dwu s THR 111 N -3.36 3.17 -0.13 3.34 -1.32 -0.47 -4.92 115.64 111.94 2dwu s THR 111 Ca -0.01 1.03 0.09 0.00 -1.21 0.00 0.00 61.69 61.58 2dwu s THR 111 Cb 0.12 -3.60 -0.14 0.00 -1.51 0.00 0.00 72.50 67.37 2dwu s THR 111 CO 0.82 0.14 0.01 0.29 -2.21 0.00 0.00 174.62 173.67 2dwu n LYS 112 N 0.33 1.70 0.03 7.08 5.02 -1.26 -4.64 118.16 126.42 2dwu n LYS 112 Ca 0.03 0.01 0.11 0.00 -2.02 0.00 0.00 58.31 56.44 2dwu n LYS 112 Cb 0.46 -1.31 0.03 0.00 -0.02 0.00 0.00 35.03 34.18 2dwu n LYS 112 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2dwu n LYS 113 N -2.55 0.29 -1.89 1.97 5.02 -1.26 -4.98 118.16 114.77 2dwu n LYS 113 Ca -0.21 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.03 2dwu n LYS 113 Cb 0.88 -1.60 -0.01 0.00 -0.02 0.00 0.00 35.03 34.28 2dwu n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dwu n GLY 114 N 1.36 0.29 2.92 0.72 0.00 -1.26 -4.95 105.19 104.27 2dwu n GLY 114 Ca 0.02 -0.71 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 2dwu n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dwu s LYS 115 N -3.85 1.53 -0.06 1.61 1.02 -1.26 -1.19 119.74 117.53 2dwu s LYS 115 Ca 0.00 -0.88 0.05 0.00 0.02 0.00 0.00 55.97 55.16 2dwu s LYS 115 Cb 0.00 -2.49 -0.01 0.00 -0.52 0.00 0.00 37.83 34.82 2dwu s LYS 115 CO 0.00 -0.58 -0.23 0.42 -0.92 0.00 0.00 175.35 174.04 2dwu s ILE 116 N 1.46 1.87 0.16 2.17 1.01 -0.21 -1.71 121.20 125.95 2dwu s ILE 116 Ca -0.05 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.70 2dwu s ILE 116 Cb -0.18 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.65 2dwu s ILE 116 CO -0.07 0.52 0.11 -0.83 0.00 0.00 0.00 174.94 174.68 2dwu s GLY 117 N -0.04 1.75 -0.01 6.18 0.00 0.65 -0.84 107.32 115.01 2dwu s GLY 117 Ca -0.06 -1.22 0.01 0.00 0.00 0.00 0.00 44.72 43.45 2dwu s GLY 117 CO 0.04 -1.22 -0.01 0.14 0.00 0.00 0.00 173.10 172.04 2dwu s VAL 118 N -1.71 0.17 0.10 1.40 1.01 -0.01 -0.67 120.40 120.69 2dwu s VAL 118 Ca 0.30 -0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.33 2dwu s VAL 118 Cb -0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 2dwu s VAL 118 CO 0.22 0.08 -0.17 0.27 0.00 0.00 0.00 175.10 175.50 2dwu s ILE 119 N 0.34 1.44 -0.03 2.22 -4.36 -1.03 -1.18 121.20 118.60 2dwu s ILE 119 Ca -0.03 -1.49 0.00 0.00 -0.26 0.00 0.00 60.65 58.87 2dwu s ILE 119 Cb -0.06 -1.38 0.00 0.00 1.25 0.00 0.00 42.46 42.28 2dwu s ILE 119 CO -0.01 -0.18 0.00 0.61 0.24 0.00 0.00 174.94 175.60 2dwu n GLY 120 N 1.06 -1.16 3.74 6.27 0.00 -1.16 -0.66 105.19 113.27 2dwu n GLY 120 Ca -0.19 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 2dwu n GLY 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dwu s THR 121 N -3.00 2.37 0.19 2.61 -4.23 -1.26 -1.03 115.64 111.29 2dwu s THR 121 Ca 0.00 0.12 -0.11 0.00 -1.18 0.00 0.00 61.69 60.52 2dwu s THR 121 Cb 0.00 -2.73 0.11 0.00 1.34 0.00 0.00 72.50 71.21 2dwu s THR 121 CO 0.00 -0.16 1.81 0.58 -0.54 0.00 0.00 174.62 176.32 2dwu h VAL 122 N -1.55 1.02 -0.75 2.29 2.07 -1.93 -1.09 116.25 116.31 2dwu h VAL 122 Ca -0.51 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2dwu h VAL 122 Cb 1.31 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2dwu h VAL 122 CO 0.59 0.12 0.44 1.23 0.02 0.00 0.00 177.57 179.97 2dwu h GLY 123 N 0.67 1.09 0.90 2.17 0.00 -1.64 0.12 103.07 106.38 2dwu h GLY 123 Ca 0.25 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 2dwu h GLY 123 CO -0.13 0.45 0.09 -0.84 0.00 0.00 0.00 176.54 176.11 2dwu h THR 124 N 1.02 1.19 -0.28 4.70 2.02 -1.73 -2.57 112.91 117.28 2dwu h THR 124 Ca 0.27 -0.61 -0.13 0.00 0.77 0.00 0.00 66.41 66.71 2dwu h THR 124 Cb -0.01 1.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2dwu h THR 124 CO -0.05 0.20 -0.32 0.40 0.37 0.00 0.00 175.52 176.13 2dwu h ILE 125 N 0.28 1.30 0.00 3.11 1.08 -1.02 -3.07 117.51 119.19 2dwu h ILE 125 Ca 0.09 -1.49 -0.02 0.00 -0.39 0.00 0.00 64.86 63.04 2dwu h ILE 125 Cb 0.23 1.62 -0.00 0.00 -3.07 0.00 0.00 36.82 35.60 2dwu h ILE 125 CO -0.00 0.48 -0.10 1.56 -0.69 0.00 0.00 178.15 179.39 2dwu h GLN 126 N 0.44 0.00 0.00 2.37 4.20 -0.74 -1.61 115.11 119.77 2dwu h GLN 126 Ca 0.04 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 2dwu h GLN 126 Cb 0.89 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.67 2dwu h GLN 126 CO 0.08 0.10 -0.13 0.66 -0.67 0.00 0.00 178.83 178.86 2dwu h SER 127 N 0.00 0.00 -1.18 1.46 4.64 -1.35 -3.46 113.55 113.66 2dwu h SER 127 Ca -0.00 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.90 2dwu h SER 127 Cb 0.24 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.17 2dwu h SER 127 CO 0.01 0.13 -0.39 -3.20 -0.87 0.00 0.00 176.83 172.52 2dwu n ASN 128 N -3.44 -5.40 0.14 4.97 5.15 -0.61 -4.88 115.26 111.20 2dwu n ASN 128 Ca -0.01 0.47 0.04 0.00 -0.60 0.00 0.00 54.58 54.48 2dwu n ASN 128 Cb 0.31 -4.75 0.45 0.00 -0.53 0.00 0.00 39.78 35.26 2dwu n ASN 128 CO 0.00 0.00 0.00 -0.03 1.40 0.00 0.00 177.26 178.63 2dwu h MET 129 N 0.00 0.21 -0.14 1.20 1.85 -1.83 -1.81 114.93 114.41 2dwu h MET 129 Ca -0.42 -0.03 -0.02 0.00 -0.61 0.00 0.00 59.70 58.62 2dwu h MET 129 Cb 1.33 -0.04 -0.01 0.00 0.43 0.00 0.00 31.60 33.32 2dwu h MET 129 CO 0.61 0.28 0.01 1.88 -0.40 0.00 0.00 176.91 179.29 2dwu h TYR 130 N 0.20 0.25 -0.49 1.39 0.05 -1.90 0.18 116.97 116.66 2dwu h TYR 130 Ca 0.05 -0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 2dwu h TYR 130 Cb 0.24 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 37.89 2dwu h TYR 130 CO 0.00 0.44 0.27 1.49 -1.05 0.00 0.00 178.16 179.31 2dwu h GLU 131 N -0.01 0.69 -0.63 4.88 4.81 -1.91 -0.16 114.58 122.25 2dwu h GLU 131 Ca 0.04 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2dwu h GLU 131 Cb 0.34 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 2dwu h GLU 131 CO 0.00 0.54 0.39 0.87 -0.73 0.00 0.00 179.01 180.09 2dwu h LYS 132 N 0.65 0.84 -0.53 1.92 1.57 -1.17 -0.01 116.57 119.83 2dwu h LYS 132 Ca 0.17 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.82 2dwu h LYS 132 Cb 0.06 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2dwu h LYS 132 CO -0.03 0.58 0.09 0.00 -0.57 0.00 0.00 179.45 179.52 2dwu h ALA 133 N 1.21 0.71 -0.44 3.86 0.00 -0.31 -1.28 119.26 123.01 2dwu h ALA 133 Ca 0.23 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2dwu h ALA 133 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2dwu h ALA 133 CO -0.05 0.45 0.11 -0.07 0.00 0.00 0.00 179.25 179.70 2dwu h LEU 134 N 0.77 0.66 -1.34 0.00 3.38 -0.74 -2.85 115.31 115.18 2dwu h LEU 134 Ca 0.16 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 2dwu h LEU 134 Cb 0.40 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2dwu h LEU 134 CO 0.01 0.71 -0.20 0.45 0.09 0.00 0.00 178.44 179.50 2dwu h HIS 135 N 0.57 0.00 -0.41 1.13 3.86 -0.86 -0.23 115.15 119.21 2dwu h HIS 135 Ca 0.14 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.29 2dwu h HIS 135 Cb 0.31 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.76 2dwu h HIS 135 CO 0.02 0.20 -0.00 1.49 0.86 0.00 0.00 177.93 180.50 2dwu h GLU 136 N 0.00 0.65 0.19 2.45 4.81 -0.99 -3.01 114.58 118.69 2dwu h GLU 136 Ca -0.00 -0.16 -0.35 0.00 -0.13 0.00 0.00 59.36 58.72 2dwu h GLU 136 Cb 0.63 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.94 2dwu h GLU 136 CO 0.03 0.68 -1.70 -0.07 -0.73 0.00 0.00 179.01 177.21 2dwu h LEU 137 N 0.62 0.63 -6.70 1.64 3.38 -1.33 -3.45 115.31 110.10 2dwu h LEU 137 Ca 0.13 -0.89 -0.30 0.00 0.09 0.00 0.00 57.88 56.90 2dwu h LEU 137 Cb 0.39 -0.20 -0.35 0.00 0.09 0.00 0.00 40.66 40.59 2dwu h LEU 137 CO 0.01 1.75 -0.61 -0.62 0.09 0.00 0.00 178.44 179.06 2dwu s ASP 138 N -7.31 1.31 0.47 -0.43 3.68 -0.16 -5.02 116.67 109.21 2dwu s ASP 138 Ca -0.14 -0.26 0.18 0.00 2.13 0.00 0.00 52.55 54.46 2dwu s ASP 138 Cb 0.05 0.48 1.13 0.00 -1.45 0.00 0.00 42.92 43.14 2dwu s ASP 138 CO 0.87 -0.33 2.01 0.74 0.13 0.00 0.00 175.17 178.59 2dwu h THR 139 N 6.29 0.98 -0.94 1.71 2.02 -1.77 -3.24 112.91 117.95 2dwu h THR 139 Ca -0.17 -0.61 -0.48 0.00 0.77 0.00 0.00 66.41 65.92 2dwu h THR 139 Cb 1.14 1.34 -0.18 0.00 -1.74 0.00 0.00 68.15 68.71 2dwu h THR 139 CO 0.29 0.17 0.49 -1.22 0.37 0.00 0.00 175.52 175.61 2dwu n TYR 140 N -4.13 1.81 -4.28 3.16 4.02 -1.26 -4.89 117.16 111.60 2dwu n TYR 140 Ca -0.02 -2.07 -0.29 0.00 -0.01 0.00 0.00 57.90 55.50 2dwu n TYR 140 Cb 0.24 -1.24 -0.11 0.00 -0.02 0.00 0.00 39.34 38.22 2dwu n TYR 140 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2dwu s LEU 141 N -2.34 2.82 -0.22 7.72 1.43 -1.22 -4.96 118.68 121.91 2dwu s LEU 141 Ca 0.50 -0.50 -0.06 0.00 -1.03 0.00 0.00 54.13 53.03 2dwu s LEU 141 Cb 0.35 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 2dwu s LEU 141 CO -0.15 0.18 0.04 -0.75 0.23 0.00 0.00 176.35 175.90 2dwu s LYS 142 N -2.19 3.68 -0.13 1.70 2.47 -0.34 -5.01 119.74 119.92 2dwu s LYS 142 Ca 0.19 -0.48 0.02 0.00 -1.56 0.00 0.00 55.97 54.15 2dwu s LYS 142 Cb -0.11 -3.22 -0.00 0.00 -1.46 0.00 0.00 37.83 33.04 2dwu s LYS 142 CO 0.12 -0.05 -0.19 0.08 0.16 0.00 0.00 175.35 175.46 2dwu s VAL 143 N 1.22 2.40 -0.26 4.02 1.01 -1.26 -1.04 120.40 126.48 2dwu s VAL 143 Ca 0.04 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 2dwu s VAL 143 Cb -0.14 -1.97 0.02 0.00 0.00 0.00 0.00 36.38 34.29 2dwu s VAL 143 CO 0.03 0.54 -0.02 -1.00 0.00 0.00 0.00 175.10 174.64 2dwu s HIS 144 N 0.57 3.10 -0.16 5.22 3.76 -0.02 -5.00 115.29 122.76 2dwu s HIS 144 Ca -0.11 -1.42 -0.02 0.00 -0.15 0.00 0.00 55.06 53.36 2dwu s HIS 144 Cb -0.16 -2.11 -0.01 0.00 1.11 0.00 0.00 32.58 31.40 2dwu s HIS 144 CO 0.04 -0.69 -0.09 -1.12 -0.85 0.00 0.00 174.74 172.02 2dwu s SER 145 N 1.37 4.19 -0.03 1.40 0.01 -1.26 -0.83 113.70 118.54 2dwu s SER 145 Ca 0.01 -0.33 0.01 0.00 1.31 0.00 0.00 55.95 56.95 2dwu s SER 145 Cb -0.17 -1.67 0.02 0.00 0.21 0.00 0.00 66.02 64.41 2dwu s SER 145 CO -0.03 0.10 -0.02 -1.00 0.41 0.00 0.00 173.24 172.70 2dwu s HIS 146 N 0.73 0.53 0.25 2.43 3.76 -0.32 -4.98 115.29 117.69 2dwu s HIS 146 Ca -0.04 -0.10 -0.30 0.00 -0.15 0.00 0.00 55.06 54.47 2dwu s HIS 146 Cb -0.15 -0.52 -0.09 0.00 1.11 0.00 0.00 32.58 32.93 2dwu s HIS 146 CO 0.02 -0.15 0.98 0.00 -0.85 0.00 0.00 174.74 174.74 2dwu s ALA 147 N 0.89 3.35 -0.51 -1.40 0.00 -1.26 -2.99 121.76 119.83 2dwu s ALA 147 Ca -0.10 0.68 0.07 0.00 0.00 0.00 0.00 51.96 52.61 2dwu s ALA 147 Cb -0.13 -3.24 0.28 0.00 0.00 0.00 0.00 23.12 20.03 2dwu s ALA 147 CO -0.01 0.12 0.69 0.00 0.00 0.00 0.00 175.76 176.57 2dwu h PRO 149 N 3.79 0.09 0.00 0.00 0.13 -1.94 -2.45 132.00 131.62 2dwu h PRO 149 Ca 0.13 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2dwu h PRO 149 Cb 0.76 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2dwu h PRO 149 CO 0.65 0.06 -0.53 0.25 -0.23 0.00 0.00 178.00 178.20 2dwu n THR 150 N -4.31 0.30 -0.16 1.56 -2.24 -1.26 -4.37 114.28 103.80 2dwu n THR 150 Ca 0.23 -0.22 -0.06 0.00 -2.27 0.00 0.00 64.05 61.73 2dwu n THR 150 Cb 1.06 -0.11 0.10 0.00 -2.10 0.00 0.00 70.33 69.27 2dwu n THR 150 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2dwu h LEU 151 N 0.00 0.90 -0.67 3.22 3.38 -1.82 -1.78 115.31 118.55 2dwu h LEU 151 Ca 0.00 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.64 2dwu h LEU 151 Cb 0.69 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2dwu h LEU 151 CO 0.00 0.96 -0.04 0.00 0.09 0.00 0.00 178.44 179.45 2dwu h ALA 152 N 1.14 0.87 -0.62 1.53 0.00 -1.78 -1.46 119.26 118.95 2dwu h ALA 152 Ca 0.16 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 2dwu h ALA 152 Cb 0.50 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2dwu h ALA 152 CO 0.02 0.65 0.03 1.15 0.00 0.00 0.00 179.25 181.11 2dwu h THR 153 N 0.91 1.26 -0.56 0.00 2.02 -1.78 -1.71 112.91 113.04 2dwu h THR 153 Ca 0.16 -1.11 0.04 0.00 0.77 0.00 0.00 66.41 66.27 2dwu h THR 153 Cb 0.58 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.69 2dwu h THR 153 CO 0.03 0.41 0.31 0.58 0.37 0.00 0.00 175.52 177.22 2dwu h VAL 154 N 0.98 0.98 -0.76 3.16 2.07 -0.92 0.89 116.25 122.65 2dwu h VAL 154 Ca 0.18 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 2dwu h VAL 154 Cb 0.51 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 2dwu h VAL 154 CO 0.02 0.11 0.25 0.58 0.02 0.00 0.00 177.57 178.56 2dwu h VAL 155 N 0.59 1.26 0.00 2.57 2.07 -0.80 0.27 116.25 122.22 2dwu h VAL 155 Ca 0.24 -0.89 -0.19 0.00 0.82 0.00 0.00 66.70 66.68 2dwu h VAL 155 Cb 0.12 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2dwu h VAL 155 CO -0.15 0.35 -0.92 -0.33 0.02 0.00 0.00 177.57 176.55 2dwu h GLU 156 N 1.12 0.00 0.00 1.57 5.08 -0.88 -3.38 114.58 118.09 2dwu h GLU 156 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 2dwu h GLU 156 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2dwu h GLU 156 CO -0.01 0.87 0.00 0.09 -1.00 0.00 0.00 179.01 178.95 2dwu n ASN 157 N -3.31 0.41 -0.23 1.42 5.03 0.27 -4.82 115.26 114.02 2dwu n ASN 157 Ca -0.00 -0.70 0.00 0.00 0.87 0.00 0.00 54.58 54.75 2dwu n ASN 157 Cb 0.90 0.44 0.00 0.00 -1.02 0.00 0.00 39.78 40.10 2dwu n ASN 157 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2dwu n ARG 158 N -0.44 0.00 0.17 3.52 5.12 0.02 -4.91 116.66 120.14 2dwu n ARG 158 Ca 0.00 -0.72 0.15 0.00 -1.93 0.00 0.00 57.85 55.36 2dwu n ARG 158 Cb 0.02 -0.49 0.74 0.00 -1.16 0.00 0.00 32.46 31.57 2dwu n ARG 158 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 2dwu h LEU 159 N 0.00 0.00 -0.34 0.55 5.85 -1.56 -1.49 115.31 118.32 2dwu h LEU 159 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2dwu h LEU 159 Cb 1.18 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 2dwu h LEU 159 CO 0.00 0.00 -0.05 -0.33 -0.34 0.00 0.00 178.44 177.72 2dwu h GLU 160 N 0.00 0.00 -5.18 1.25 3.07 -1.90 -3.38 114.58 108.44 2dwu h GLU 160 Ca 0.10 0.00 -0.71 0.00 -0.50 0.00 0.00 59.36 58.25 2dwu h GLU 160 Cb 0.47 0.00 -0.14 0.00 -0.84 0.00 0.00 28.75 28.23 2dwu h GLU 160 CO -0.00 0.05 1.59 0.34 -1.40 0.00 0.00 179.01 179.59 2dwu s ASP 161 N -6.12 6.94 0.36 1.42 3.68 -0.56 -4.86 116.67 117.53 2dwu s ASP 161 Ca 0.05 -2.69 0.07 0.00 2.13 0.00 0.00 52.55 52.11 2dwu s ASP 161 Cb 0.06 -2.46 0.76 0.00 -1.45 0.00 0.00 42.92 39.83 2dwu s ASP 161 CO 0.65 -0.93 1.92 0.71 0.13 0.00 0.00 175.17 177.64 2dwu h THR 162 N 5.12 0.95 -0.64 1.71 1.35 -1.81 -0.63 112.91 118.94 2dwu h THR 162 Ca 0.34 -0.26 -0.08 0.00 -0.55 0.00 0.00 66.41 65.86 2dwu h THR 162 Cb 0.89 0.13 -0.02 0.00 -1.73 0.00 0.00 68.15 67.42 2dwu h THR 162 CO 1.31 0.14 0.07 0.00 -0.25 0.00 0.00 175.52 176.79 2dwu h ALA 163 N 1.59 0.91 -0.39 6.62 0.00 -1.96 -0.63 119.26 125.40 2dwu h ALA 163 Ca 0.37 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 2dwu h ALA 163 Cb 0.45 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2dwu h ALA 163 CO -0.15 0.66 -0.33 -0.92 0.00 0.00 0.00 179.25 178.51 2dwu h TYR 164 N 1.00 1.09 -0.44 0.00 5.03 -1.63 -1.65 116.97 120.37 2dwu h TYR 164 Ca 0.19 -0.31 -0.03 0.00 2.58 0.00 0.00 58.73 61.15 2dwu h TYR 164 Cb 0.48 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.50 2dwu h TYR 164 CO 0.03 1.13 0.14 0.28 -1.32 0.00 0.00 178.16 178.43 2dwu h VAL 165 N 0.74 1.22 -0.49 1.81 2.07 -0.94 -0.79 116.25 119.87 2dwu h VAL 165 Ca 0.07 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 66.88 2dwu h VAL 165 Cb 0.92 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 2dwu h VAL 165 CO 0.09 0.26 0.32 0.74 0.02 0.00 0.00 177.57 178.99 2dwu h THR 166 N 0.57 1.12 -0.75 2.57 2.02 -1.01 0.20 112.91 117.63 2dwu h THR 166 Ca 0.14 -0.23 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 2dwu h THR 166 Cb 0.25 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 2dwu h THR 166 CO -0.01 0.12 0.30 -0.61 0.37 0.00 0.00 175.52 175.69 2dwu h GLN 167 N 0.66 1.12 -0.11 6.66 5.75 -1.01 -0.82 115.11 127.37 2dwu h GLN 167 Ca 0.18 -0.20 -0.18 0.00 -0.15 0.00 0.00 58.65 58.30 2dwu h GLN 167 Cb -0.07 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 28.29 2dwu h GLN 167 CO -0.04 0.91 -0.68 1.96 -2.65 0.00 0.00 178.83 178.34 2dwu h GLN 168 N 1.09 0.44 -0.39 1.69 1.08 -0.75 -1.57 115.11 116.71 2dwu h GLN 168 Ca 0.25 -0.34 -0.13 0.00 -1.45 0.00 0.00 58.65 56.99 2dwu h GLN 168 Cb 0.21 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 2dwu h GLN 168 CO -0.02 0.96 -0.26 0.28 -0.95 0.00 0.00 178.83 178.84 2dwu h VAL 169 N 0.32 1.28 -0.29 -0.54 2.07 -0.79 -1.12 116.25 117.17 2dwu h VAL 169 Ca -0.02 -1.42 0.02 0.00 0.82 0.00 0.00 66.70 66.10 2dwu h VAL 169 Cb 1.24 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 2dwu h VAL 169 CO 0.12 0.47 0.16 0.50 0.02 0.00 0.00 177.57 178.84 2dwu h LYS 170 N 0.68 0.31 -0.65 1.57 3.64 -1.01 -0.81 116.57 120.30 2dwu h LYS 170 Ca 0.08 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.35 2dwu h LYS 170 Cb 0.84 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.56 2dwu h LYS 170 CO 0.07 0.21 0.06 1.96 -2.27 0.00 0.00 179.45 179.48 2dwu h GLN 171 N 0.32 1.10 -0.46 1.90 4.20 -1.19 -1.95 115.11 119.04 2dwu h GLN 171 Ca 0.12 -0.32 -0.11 0.00 0.06 0.00 0.00 58.65 58.40 2dwu h GLN 171 Cb 0.02 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 2dwu h GLN 171 CO -0.07 1.03 -0.16 0.00 -0.67 0.00 0.00 178.83 178.96 2dwu h ALA 172 N 1.04 0.84 -0.01 3.87 0.00 -0.93 -3.20 119.26 120.87 2dwu h ALA 172 Ca 0.19 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2dwu h ALA 172 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2dwu h ALA 172 CO 0.02 0.65 -0.29 1.28 0.00 0.00 0.00 179.25 180.90 2dwu n LEU 173 N -4.13 0.94 -0.18 0.00 4.77 -0.33 -4.42 117.00 113.65 2dwu n LEU 173 Ca 0.01 -0.22 -0.03 0.00 -0.03 0.00 0.00 56.01 55.74 2dwu n LEU 173 Cb 0.42 -0.14 0.04 0.00 -2.33 0.00 0.00 43.42 41.40 2dwu n LEU 173 CO 0.45 0.18 0.72 0.25 -1.33 0.00 0.00 177.39 177.66 2dwu h LEU 174 N 1.02 -0.68 -1.66 2.23 7.12 -1.34 0.55 115.31 122.54 2dwu h LEU 174 Ca 0.00 0.18 0.07 0.00 0.13 0.00 0.00 57.88 58.26 2dwu h LEU 174 Cb 0.50 0.40 -0.03 0.00 -0.53 0.00 0.00 40.66 41.01 2dwu h LEU 174 CO 0.00 -0.23 0.34 1.55 -0.13 0.00 0.00 178.44 179.97 2dwu h PRO 175 N -0.06 0.41 0.00 5.25 0.13 -1.82 -2.00 132.00 133.90 2dwu h PRO 175 Ca 0.26 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 65.29 2dwu h PRO 175 Cb 0.46 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.49 2dwu h PRO 175 CO -0.59 0.27 -0.32 -0.07 -0.23 0.00 0.00 178.00 177.06 2dwu h LEU 176 N 0.42 0.00 -1.45 1.56 3.38 -1.22 -2.93 115.31 115.07 2dwu h LEU 176 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2dwu h LEU 176 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2dwu h LEU 176 CO -0.06 0.32 0.00 0.71 0.09 0.00 0.00 178.44 179.50 2dwu h THR 177 N 0.00 0.00 0.00 0.22 1.35 -0.53 -2.20 112.91 111.75 2dwu h THR 177 Ca -0.00 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 2dwu h THR 177 Cb 1.14 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 2dwu h THR 177 CO 0.04 0.00 -0.37 0.29 -0.25 0.00 0.00 175.52 175.23 2dwu n LYS 178 N -2.92 0.23 -3.94 4.72 5.02 -1.11 -4.89 118.16 115.28 2dwu n LYS 178 Ca 0.01 0.11 -0.25 0.00 -2.02 0.00 0.00 58.31 56.15 2dwu n LYS 178 Cb 0.27 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 33.56 2dwu n LYS 178 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2dwu s GLU 179 N -3.12 3.44 -0.60 1.97 0.41 -0.83 -5.05 118.70 114.93 2dwu s GLU 179 Ca 0.09 -0.62 -0.21 0.00 -0.41 0.00 0.00 54.97 53.82 2dwu s GLU 179 Cb 0.14 -2.95 0.07 0.00 -1.78 0.00 0.00 34.13 29.61 2dwu s GLU 179 CO 0.67 0.50 0.84 0.34 -0.49 0.00 0.00 175.26 177.12 2dwu s ASP 180 N -3.37 6.21 0.05 -0.19 2.15 -1.26 -5.00 116.67 115.26 2dwu s ASP 180 Ca 0.35 -0.95 0.00 0.00 0.43 0.00 0.00 52.55 52.38 2dwu s ASP 180 Cb -0.11 -2.37 -0.03 0.00 -0.30 0.00 0.00 42.92 40.11 2dwu s ASP 180 CO 0.29 -1.23 -0.04 0.27 -0.17 0.00 0.00 175.17 174.28 2dwu s ILE 181 N 3.49 0.30 0.00 4.11 -4.36 -1.26 -4.75 121.20 118.74 2dwu s ILE 181 Ca 0.20 -1.38 0.00 0.00 -0.26 0.00 0.00 60.65 59.21 2dwu s ILE 181 Cb -0.18 -0.94 0.00 0.00 1.25 0.00 0.00 42.46 42.59 2dwu s ILE 181 CO 0.11 -0.70 0.75 -0.90 0.24 0.00 0.00 174.94 174.45 2dwu n ASP 182 N 0.85 1.35 -3.75 4.36 5.75 -0.70 -4.77 116.55 119.64 2dwu n ASP 182 Ca -0.19 -1.56 -0.12 0.00 -0.01 0.00 0.00 54.79 52.90 2dwu n ASP 182 Cb 0.58 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.55 2dwu n ASP 182 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2dwu s THR 183 N -0.56 -0.01 -0.09 2.12 2.01 -1.23 -0.94 115.64 116.94 2dwu s THR 183 Ca 0.00 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.04 2dwu s THR 183 Cb 0.00 -0.45 0.02 0.00 0.01 0.00 0.00 72.50 72.09 2dwu s THR 183 CO 0.00 0.02 -0.08 -0.22 -0.69 0.00 0.00 174.62 173.65 2dwu s LEU 184 N 0.51 1.29 -0.18 4.42 2.96 0.08 -0.25 118.68 127.50 2dwu s LEU 184 Ca -0.03 -0.26 -0.18 0.00 -0.22 0.00 0.00 54.13 53.44 2dwu s LEU 184 Cb -0.04 -0.75 -0.03 0.00 0.50 0.00 0.00 46.19 45.86 2dwu s LEU 184 CO -0.03 -0.07 0.50 -0.63 -1.32 0.00 0.00 176.35 174.80 2dwu s ILE 185 N 1.31 5.13 -1.05 6.68 1.01 0.16 -0.53 121.20 133.92 2dwu s ILE 185 Ca -0.03 0.93 -0.21 0.00 0.00 0.00 0.00 60.65 61.33 2dwu s ILE 185 Cb -0.14 -3.82 0.07 0.00 0.01 0.00 0.00 42.46 38.58 2dwu s ILE 185 CO -0.03 0.21 1.44 -0.76 0.00 0.00 0.00 174.94 175.80 2dwu s LEU 186 N 1.40 3.81 -0.10 2.97 1.43 0.04 -2.45 118.68 125.77 2dwu s LEU 186 Ca 0.24 -1.71 -0.01 0.00 -1.03 0.00 0.00 54.13 51.62 2dwu s LEU 186 Cb -0.15 -2.54 0.03 0.00 0.03 0.00 0.00 46.19 43.55 2dwu s LEU 186 CO 0.10 -1.38 2.22 0.61 0.23 0.00 0.00 176.35 178.12 2dwu n GLY 187 N 6.42 3.05 3.48 -3.19 0.00 0.16 -3.76 105.19 111.35 2dwu n GLY 187 Ca 0.34 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 2dwu n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dwu h THR 189 N 4.12 0.81 0.00 0.00 1.35 -1.86 -2.88 112.91 114.45 2dwu h THR 189 Ca -0.28 -0.03 -0.01 0.00 -0.55 0.00 0.00 66.41 65.54 2dwu h THR 189 Cb 1.17 0.71 -0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2dwu h THR 189 CO 0.17 0.02 -0.50 0.45 -0.25 0.00 0.00 175.52 175.40 2dwu h HIS 190 N 0.10 0.00 0.00 4.73 3.86 -1.96 -3.39 115.15 118.49 2dwu h HIS 190 Ca 0.22 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.41 2dwu h HIS 190 Cb 0.75 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.22 2dwu h HIS 190 CO -0.00 0.03 -0.08 1.88 0.86 0.00 0.00 177.93 180.62 2dwu h TYR 191 N 0.00 0.00 -0.30 2.45 0.05 -1.86 -2.53 116.97 114.78 2dwu h TYR 191 Ca -0.00 0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.85 2dwu h TYR 191 Cb 1.03 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.75 2dwu h TYR 191 CO 0.00 0.08 0.21 -1.35 -1.05 0.00 0.00 178.16 176.05 2dwu h PRO 192 N 0.00 0.06 0.00 4.88 0.11 -1.79 0.11 132.00 135.36 2dwu h PRO 192 Ca -0.00 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 2dwu h PRO 192 Cb 0.18 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.27 2dwu h PRO 192 CO 0.01 0.04 -0.02 -0.07 -0.21 0.00 0.00 178.00 177.74 2dwu h LEU 193 N 0.06 0.00 -2.47 2.35 -0.00 -1.77 -2.35 115.31 111.12 2dwu h LEU 193 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.02 2dwu h LEU 193 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.14 2dwu h LEU 193 CO -0.01 0.02 0.00 0.18 -0.00 0.00 0.00 178.44 178.63 2dwu n LEU 194 N -3.18 3.53 -0.25 1.67 4.77 0.36 -4.67 117.00 119.22 2dwu n LEU 194 Ca -0.01 -1.67 0.06 0.00 -0.03 0.00 0.00 56.01 54.36 2dwu n LEU 194 Cb 0.21 -0.31 0.18 0.00 -2.33 0.00 0.00 43.42 41.17 2dwu n LEU 194 CO 0.25 0.80 0.89 -0.08 -1.33 0.00 0.00 177.39 177.92 2dwu h GLU 195 N 4.17 0.19 -0.71 3.23 4.81 -1.24 -1.21 114.58 123.81 2dwu h GLU 195 Ca 0.00 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2dwu h GLU 195 Cb 0.95 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.25 2dwu h GLU 195 CO 0.00 0.12 0.46 0.77 -0.73 0.00 0.00 179.01 179.63 2dwu h SER 196 N 0.19 0.78 -0.50 1.04 0.02 -1.85 -0.67 113.55 112.58 2dwu h SER 196 Ca 0.42 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.33 2dwu h SER 196 Cb 0.74 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 2dwu h SER 196 CO -0.58 0.56 0.20 1.88 -1.14 0.00 0.00 176.83 177.75 2dwu h TYR 197 N 0.93 0.76 -0.56 3.45 0.05 -1.61 -2.18 116.97 117.80 2dwu h TYR 197 Ca 0.27 -0.06 -0.04 0.00 0.05 0.00 0.00 58.73 58.95 2dwu h TYR 197 Cb -0.07 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.42 2dwu h TYR 197 CO -0.03 0.64 0.19 0.82 -1.05 0.00 0.00 178.16 178.73 2dwu h ILE 198 N 0.66 1.23 -0.69 -2.88 2.04 -0.98 -1.78 117.51 115.11 2dwu h ILE 198 Ca 0.17 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.24 2dwu h ILE 198 Cb 0.20 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2dwu h ILE 198 CO -0.01 0.29 0.36 0.11 0.00 0.00 0.00 178.15 178.90 2dwu h LYS 199 N 0.78 0.98 -0.72 2.37 1.57 -1.03 -0.84 116.57 119.68 2dwu h LYS 199 Ca 0.18 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2dwu h LYS 199 Cb 0.25 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 2dwu h LYS 199 CO -0.01 0.76 0.28 -0.22 -0.57 0.00 0.00 179.45 179.69 2dwu h LYS 200 N 0.96 1.07 -0.12 3.15 3.11 -1.13 0.47 116.57 124.07 2dwu h LYS 200 Ca 0.24 -0.19 -0.21 0.00 -2.81 0.00 0.00 60.65 57.69 2dwu h LYS 200 Cb 0.08 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.13 2dwu h LYS 200 CO -0.04 0.87 -0.76 1.49 -2.81 0.00 0.00 179.45 178.20 2dwu h GLU 201 N 1.04 0.64 0.00 1.90 4.57 -0.81 -3.34 114.58 118.58 2dwu h GLU 201 Ca 0.24 -0.52 -0.07 0.00 -1.18 0.00 0.00 59.36 57.83 2dwu h GLU 201 Cb 0.21 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 2dwu h GLU 201 CO -0.02 1.14 -1.52 1.28 -1.18 0.00 0.00 179.01 178.72 2dwu n LEU 202 N -3.90 0.52 0.00 1.64 4.77 -0.37 -4.99 117.00 114.68 2dwu n LEU 202 Ca -0.06 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2dwu n LEU 202 Cb 0.73 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 2dwu n LEU 202 CO 0.51 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 2dwu n GLY 203 N 1.30 0.75 0.21 -0.72 0.00 0.15 -4.64 105.19 102.24 2dwu n GLY 203 Ca -0.06 -1.94 0.15 0.00 0.00 0.00 0.00 46.02 44.16 2dwu n GLY 203 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dwu h GLU 204 N 0.00 0.00 0.00 1.61 4.39 -1.95 -3.14 114.58 115.49 2dwu h GLU 204 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2dwu h GLU 204 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2dwu h GLU 204 CO 0.00 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.60 2dwu n ASP 205 N -2.72 0.00 -4.23 1.42 9.92 -1.26 -4.71 116.55 114.97 2dwu n ASP 205 Ca 0.01 0.06 -0.34 0.00 -0.53 0.00 0.00 54.79 53.99 2dwu n ASP 205 Cb 0.29 -0.33 -0.15 0.00 -0.64 0.00 0.00 41.12 40.29 2dwu n ASP 205 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2dwu s VAL 206 N -2.66 2.85 -0.07 2.53 1.01 -1.19 -4.62 120.40 118.25 2dwu s VAL 206 Ca 0.20 -0.73 -0.28 0.00 0.00 0.00 0.00 61.98 61.18 2dwu s VAL 206 Cb 0.16 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 2dwu s VAL 206 CO 0.38 0.43 0.89 -0.89 0.00 0.00 0.00 175.10 175.91 2dwu s THR 207 N 1.39 4.89 -0.27 3.92 2.01 -0.11 -4.86 115.64 122.61 2dwu s THR 207 Ca 0.05 1.84 -0.12 0.00 0.31 0.00 0.00 61.69 63.76 2dwu s THR 207 Cb -0.14 -4.22 -0.05 0.00 0.01 0.00 0.00 72.50 68.10 2dwu s THR 207 CO -0.07 0.12 0.25 -0.63 -0.69 0.00 0.00 174.62 173.61 2dwu s ILE 208 N 1.39 5.27 -0.25 1.82 1.01 -1.26 -0.74 121.20 128.43 2dwu s ILE 208 Ca 0.45 0.32 -0.15 0.00 0.00 0.00 0.00 60.65 61.27 2dwu s ILE 208 Cb -0.19 -3.59 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 2dwu s ILE 208 CO 0.21 0.23 0.38 -0.63 0.00 0.00 0.00 174.94 175.13 2dwu s ILE 209 N 1.77 5.18 -0.09 2.92 -1.09 0.31 -4.97 121.20 125.23 2dwu s ILE 209 Ca 0.10 0.61 -0.22 0.00 -2.23 0.00 0.00 60.65 58.90 2dwu s ILE 209 Cb -0.16 -3.71 -0.03 0.00 -1.58 0.00 0.00 42.46 36.98 2dwu s ILE 209 CO 0.10 0.18 0.67 -0.55 -1.23 0.00 0.00 174.94 174.11 2dwu s SER 210 N 1.47 6.91 0.31 3.58 0.15 -1.26 -0.78 113.70 124.08 2dwu s SER 210 Ca 0.16 1.10 0.02 0.00 0.70 0.00 0.00 55.95 57.92 2dwu s SER 210 Cb -0.15 -2.39 0.52 0.00 -1.71 0.00 0.00 66.02 62.28 2dwu s SER 210 CO 0.09 -0.13 1.87 0.28 1.20 0.00 0.00 173.24 176.55 2dwu h SER 211 N 6.86 0.65 -0.01 5.45 0.02 -1.90 -2.73 113.55 121.90 2dwu h SER 211 Ca -0.39 -0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2dwu h SER 211 Cb 1.18 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.56 2dwu h SER 211 CO 0.76 0.64 0.00 0.00 -1.14 0.00 0.00 176.83 177.10 2dwu h ALA 212 N 1.44 0.01 -0.84 3.77 0.00 -1.90 -1.03 119.26 120.72 2dwu h ALA 212 Ca 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2dwu h ALA 212 Cb 0.26 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2dwu h ALA 212 CO -0.00 -0.37 0.48 1.49 0.00 0.00 0.00 179.25 180.84 2dwu h GLU 213 N -0.21 1.16 0.00 0.00 4.81 -1.86 -2.43 114.58 116.05 2dwu h GLU 213 Ca 0.00 -0.12 -0.16 0.00 -0.13 0.00 0.00 59.36 58.95 2dwu h GLU 213 Cb 0.23 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 2dwu h GLU 213 CO 0.00 0.83 -0.75 0.93 -0.73 0.00 0.00 179.01 179.30 2dwu h GLU 214 N 1.16 0.00 -0.15 1.92 4.39 -1.42 -3.06 114.58 117.42 2dwu h GLU 214 Ca 0.30 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.83 2dwu h GLU 214 Cb -0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2dwu h GLU 214 CO -0.05 0.75 -0.60 1.15 -1.16 0.00 0.00 179.01 179.10 2dwu h THR 215 N 0.00 1.34 -0.61 1.13 2.02 -0.99 -1.74 112.91 114.06 2dwu h THR 215 Ca -0.01 -1.89 -0.09 0.00 0.77 0.00 0.00 66.41 65.20 2dwu h THR 215 Cb 1.48 1.87 -0.02 0.00 -1.74 0.00 0.00 68.15 69.74 2dwu h THR 215 CO 0.10 0.58 0.03 0.00 0.37 0.00 0.00 175.52 176.60 2dwu h ALA 216 N 0.97 0.82 -0.02 6.16 0.00 -1.43 0.63 119.26 126.38 2dwu h ALA 216 Ca -0.00 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.49 2dwu h ALA 216 Cb 1.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 2dwu h ALA 216 CO 0.11 0.63 -0.56 0.97 0.00 0.00 0.00 179.25 180.39 2dwu h ILE 217 N 0.95 1.40 -0.30 0.00 2.10 -1.44 -0.48 117.51 119.74 2dwu h ILE 217 Ca 0.18 -1.92 -0.03 0.00 1.08 0.00 0.00 64.86 64.17 2dwu h ILE 217 Cb 0.52 2.01 -0.01 0.00 -1.09 0.00 0.00 36.82 38.25 2dwu h ILE 217 CO 0.02 0.55 0.07 -0.08 -1.08 0.00 0.00 178.15 177.64 2dwu h GLU 218 N 0.05 0.47 -0.41 2.19 4.57 -0.89 -1.08 114.58 119.48 2dwu h GLU 218 Ca -0.00 -0.11 0.02 0.00 -1.18 0.00 0.00 59.36 58.08 2dwu h GLU 218 Cb 1.01 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.51 2dwu h GLU 218 CO 0.08 0.55 0.23 1.25 -1.18 0.00 0.00 179.01 179.94 2dwu h LEU 219 N 0.31 0.36 -0.51 1.64 5.85 -0.65 -1.67 115.31 120.63 2dwu h LEU 219 Ca 0.09 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.88 2dwu h LEU 219 Cb 0.29 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 2dwu h LEU 219 CO 0.00 0.26 0.22 -1.28 -0.34 0.00 0.00 178.44 177.29 2dwu h SER 220 N 0.46 0.26 -0.40 1.25 0.87 -0.84 0.92 113.55 116.08 2dwu h SER 220 Ca 0.17 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.80 2dwu h SER 220 Cb 0.04 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 2dwu h SER 220 CO -0.09 0.18 0.22 0.74 -0.53 0.00 0.00 176.83 177.35 2dwu h THR 221 N 0.42 1.01 -0.28 2.23 2.02 -0.79 -1.60 112.91 115.91 2dwu h THR 221 Ca 0.24 -0.15 -0.14 0.00 0.77 0.00 0.00 66.41 67.13 2dwu h THR 221 Cb 0.22 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2dwu h THR 221 CO -0.21 0.08 -0.37 0.40 0.37 0.00 0.00 175.52 175.79 2dwu h ILE 222 N 0.44 1.30 -0.74 3.11 2.04 -0.85 -1.02 117.51 121.79 2dwu h ILE 222 Ca 0.16 -1.55 -0.05 0.00 1.00 0.00 0.00 64.86 64.42 2dwu h ILE 222 Cb 0.04 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 2dwu h ILE 222 CO -0.09 0.50 0.28 -0.07 0.00 0.00 0.00 178.15 178.77 2dwu h LEU 223 N 0.50 1.02 -0.33 1.44 3.38 -0.69 -1.49 115.31 119.15 2dwu h LEU 223 Ca 0.03 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 57.66 2dwu h LEU 223 Cb 0.96 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 2dwu h LEU 223 CO 0.09 0.92 -0.51 -0.61 0.09 0.00 0.00 178.44 178.42 2dwu h GLN 224 N 1.08 0.89 -0.88 1.13 4.15 -1.24 -0.83 115.11 119.41 2dwu h GLN 224 Ca 0.25 -0.54 0.05 0.00 0.77 0.00 0.00 58.65 59.18 2dwu h GLN 224 Cb 0.23 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.91 2dwu h GLN 224 CO -0.02 1.18 0.57 1.25 -1.93 0.00 0.00 178.83 179.88 2dwu h HIS 225 N 0.69 1.03 -0.00 3.99 2.76 -0.89 -1.04 115.15 121.69 2dwu h HIS 225 Ca 0.03 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2dwu h HIS 225 Cb 1.11 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.73 2dwu h HIS 225 CO 0.07 0.56 -0.11 1.63 -1.30 0.00 0.00 177.93 178.78 2dwu n LYS 226 N -4.47 0.68 -2.57 5.26 5.02 -0.59 -4.94 118.16 116.55 2dwu n LYS 226 Ca 0.13 -0.24 -0.13 0.00 -2.02 0.00 0.00 58.31 56.05 2dwu n LYS 226 Cb 0.16 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.69 2dwu n LYS 226 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dwu n GLY 227 N 1.28 -0.03 0.62 0.72 0.00 -0.40 -4.95 105.19 102.44 2dwu n GLY 227 Ca 0.14 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.93 2dwu n GLY 227 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2dwu n ILE 228 N -3.98 1.87 -2.19 -0.61 -5.35 -0.39 -5.03 119.36 103.69 2dwu n ILE 228 Ca -0.08 -2.79 -0.39 0.00 -0.27 0.00 0.00 62.75 59.21 2dwu n ILE 228 Cb 0.58 -0.09 -0.02 0.00 -1.74 0.00 0.00 39.64 38.38 2dwu n ILE 228 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2dwu s LEU 229 N -2.76 4.30 0.66 7.28 1.43 -1.25 -4.95 118.68 123.39 2dwu s LEU 229 Ca 0.36 2.53 -0.11 0.00 -1.03 0.00 0.00 54.13 55.88 2dwu s LEU 229 Cb 0.35 -3.84 -0.02 0.00 0.03 0.00 0.00 46.19 42.72 2dwu s LEU 229 CO -0.07 -0.64 1.05 0.00 0.23 0.00 0.00 176.35 176.93 2dwu s ALA 230 N -1.26 2.94 -0.03 4.21 0.00 -1.26 -5.00 121.76 121.35 2dwu s ALA 230 Ca 0.53 -0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.44 2dwu s ALA 230 Cb -0.36 -3.09 0.07 0.00 0.00 0.00 0.00 23.12 19.74 2dwu s ALA 230 CO 0.46 -0.93 1.00 -0.40 0.00 0.00 0.00 175.76 175.89 2dwu n ASP 231 N -2.91 1.85 -4.64 0.00 5.75 -1.26 -4.84 116.55 110.50 2dwu n ASP 231 Ca 0.07 -2.19 -0.42 0.00 -0.01 0.00 0.00 54.79 52.23 2dwu n ASP 231 Cb 0.55 -0.11 -0.03 0.00 -1.03 0.00 0.00 41.12 40.49 2dwu n ASP 231 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2dwu s ASN 232 N -1.38 6.39 0.33 -1.12 3.84 -1.25 -4.92 114.94 116.83 2dwu s ASN 232 Ca 0.08 2.13 0.16 0.00 0.21 0.00 0.00 52.86 55.44 2dwu s ASN 232 Cb 0.07 -2.53 0.52 0.00 -0.55 0.00 0.00 41.25 38.76 2dwu s ASN 232 CO 0.01 -1.17 1.66 -0.07 -2.79 0.00 0.00 177.10 174.74 2dwu h LEU 233 N 11.31 0.00 -6.09 3.21 4.07 -1.91 -3.38 115.31 122.52 2dwu h LEU 233 Ca -0.40 0.00 -0.56 0.00 0.08 0.00 0.00 57.88 57.00 2dwu h LEU 233 Cb 1.19 0.00 -0.38 0.00 1.08 0.00 0.00 40.66 42.56 2dwu h LEU 233 CO 0.96 0.46 -1.04 -0.46 -1.08 0.00 0.00 178.44 177.29 2dwu n ASN 234 N -3.54 -0.21 -4.81 -0.43 6.94 -1.26 -4.91 115.26 107.03 2dwu n ASN 234 Ca -0.00 -2.60 -0.30 0.00 -0.02 0.00 0.00 54.58 51.67 2dwu n ASN 234 Cb 0.57 -0.50 0.10 0.00 -2.36 0.00 0.00 39.78 37.59 2dwu n ASN 234 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 2dwu s PRO 235 N -0.65 1.93 0.10 -0.53 0.04 -1.26 -5.08 135.00 129.55 2dwu s PRO 235 Ca 0.34 0.56 0.08 0.00 0.04 0.00 0.00 61.00 62.02 2dwu s PRO 235 Cb 0.12 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.72 2dwu s PRO 235 CO -0.15 -1.71 -0.21 0.15 0.04 0.00 0.00 177.00 175.12 2dwu s LYS 236 N -5.20 1.19 0.16 4.56 1.02 -1.26 -5.06 119.74 115.15 2dwu s LYS 236 Ca 0.61 -1.15 0.10 0.00 0.02 0.00 0.00 55.97 55.55 2dwu s LYS 236 Cb -0.14 -1.46 -0.04 0.00 -0.52 0.00 0.00 37.83 35.67 2dwu s LYS 236 CO 0.54 0.34 -0.19 -1.01 -0.92 0.00 0.00 175.35 174.11 2dwu s HIS 237 N -1.10 2.45 -0.00 3.18 3.76 -1.26 -4.26 115.29 118.06 2dwu s HIS 237 Ca 0.07 -0.30 0.05 0.00 -0.15 0.00 0.00 55.06 54.73 2dwu s HIS 237 Cb -0.10 -1.24 -0.01 0.00 1.11 0.00 0.00 32.58 32.34 2dwu s HIS 237 CO 0.04 0.46 -0.15 1.03 -0.85 0.00 0.00 174.74 175.27 2dwu s ARG 238 N -2.53 1.15 0.02 1.40 0.52 -0.23 -4.59 118.95 114.69 2dwu s ARG 238 Ca 0.21 -0.55 0.07 0.00 -0.52 0.00 0.00 55.73 54.93 2dwu s ARG 238 Cb -0.09 -1.13 -0.02 0.00 0.52 0.00 0.00 34.95 34.23 2dwu s ARG 238 CO 0.11 0.31 -0.22 -0.06 0.02 0.00 0.00 175.30 175.46 2dwu s PHE 239 N -0.40 1.91 0.04 -0.53 0.08 -0.44 -0.87 117.98 117.76 2dwu s PHE 239 Ca 0.05 -0.37 0.04 0.00 0.12 0.00 0.00 56.93 56.77 2dwu s PHE 239 Cb -0.06 -1.18 -0.02 0.00 -0.57 0.00 0.00 43.02 41.19 2dwu s PHE 239 CO -0.00 0.04 -0.11 -0.06 -0.10 0.00 0.00 175.22 174.98 2dwu s PHE 240 N -0.67 1.00 0.01 0.36 0.08 0.66 -1.32 117.98 118.10 2dwu s PHE 240 Ca 0.08 -0.38 -0.03 0.00 0.12 0.00 0.00 56.93 56.72 2dwu s PHE 240 Cb -0.09 -0.59 -0.01 0.00 -0.57 0.00 0.00 43.02 41.77 2dwu s PHE 240 CO 0.01 0.00 0.05 -0.08 -0.10 0.00 0.00 175.22 175.10 2dwu s THR 241 N -0.98 0.08 -1.41 0.64 -1.32 -0.41 -1.01 115.64 111.23 2dwu s THR 241 Ca -0.02 -0.67 0.26 0.00 -1.21 0.00 0.00 61.69 60.05 2dwu s THR 241 Cb -0.08 -0.30 0.18 0.00 -1.51 0.00 0.00 72.50 70.80 2dwu s THR 241 CO 0.01 -0.37 1.56 0.35 -2.21 0.00 0.00 174.62 173.96 2dwu n THR 242 N 1.80 0.00 -1.64 5.08 -2.24 -0.79 -1.69 114.28 114.79 2dwu n THR 242 Ca -0.21 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 2dwu n THR 242 Cb 0.56 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 2dwu n THR 242 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dwu n GLY 243 N 1.40 2.19 3.70 3.38 0.00 -1.26 -4.26 105.19 110.35 2dwu n GLY 243 Ca 0.10 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 2dwu n GLY 243 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dwu s SER 244 N -0.88 6.59 0.10 1.61 0.15 -1.26 -4.90 113.70 115.11 2dwu s SER 244 Ca 0.00 2.56 -0.16 0.00 0.70 0.00 0.00 55.95 59.05 2dwu s SER 244 Cb 0.00 -2.58 -0.05 0.00 -1.71 0.00 0.00 66.02 61.68 2dwu s SER 244 CO 0.00 -0.86 1.51 0.58 1.20 0.00 0.00 173.24 175.67 2dwu h VAL 245 N 4.42 1.28 -0.41 4.45 2.07 -1.94 -2.57 116.25 123.54 2dwu h VAL 245 Ca -0.43 -1.10 -0.05 0.00 0.82 0.00 0.00 66.70 65.94 2dwu h VAL 245 Cb 1.20 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2dwu h VAL 245 CO 0.92 0.36 0.03 0.77 0.02 0.00 0.00 177.57 179.67 2dwu h SER 246 N 0.41 0.60 -0.28 0.57 4.64 -1.98 -1.21 113.55 116.30 2dwu h SER 246 Ca 0.09 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.26 2dwu h SER 246 Cb 0.55 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 2dwu h SER 246 CO 0.03 0.66 0.07 0.28 -0.87 0.00 0.00 176.83 177.00 2dwu h SER 247 N 0.61 0.42 0.04 4.97 0.02 -1.94 -1.81 113.55 115.87 2dwu h SER 247 Ca 0.13 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 2dwu h SER 247 Cb 0.35 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 2dwu h SER 247 CO 0.01 0.54 -0.04 0.15 -1.14 0.00 0.00 176.83 176.34 2dwu h PHE 248 N 0.29 -0.11 -0.90 3.45 3.57 -1.14 -1.81 116.94 120.29 2dwu h PHE 248 Ca 0.09 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.66 2dwu h PHE 248 Cb 0.27 0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 2dwu h PHE 248 CO 0.01 -0.07 0.58 0.93 -2.23 0.00 0.00 178.31 177.54 2dwu h GLU 249 N -0.10 0.98 -0.09 1.11 5.08 -1.17 0.11 114.58 120.51 2dwu h GLU 249 Ca 0.01 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2dwu h GLU 249 Cb 0.10 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 2dwu h GLU 249 CO -0.02 0.65 -0.01 1.25 -1.00 0.00 0.00 179.01 179.88 2dwu h HIS 250 N 1.01 0.18 -0.44 4.33 2.76 -0.99 -1.05 115.15 120.96 2dwu h HIS 250 Ca 0.39 -0.04 -0.08 0.00 -2.20 0.00 0.00 60.37 58.44 2dwu h HIS 250 Cb 0.21 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.11 2dwu h HIS 250 CO -0.00 0.45 -0.04 0.82 -1.30 0.00 0.00 177.93 177.85 2dwu h ILE 251 N -0.13 1.27 -0.62 6.26 2.04 -1.05 -2.53 117.51 122.74 2dwu h ILE 251 Ca 0.03 -1.12 0.05 0.00 1.00 0.00 0.00 64.86 64.82 2dwu h ILE 251 Cb 0.38 1.10 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 2dwu h ILE 251 CO 0.01 0.38 0.35 0.00 0.00 0.00 0.00 178.15 178.89 2dwu h ALA 252 N 0.89 0.82 -0.49 1.87 0.00 -0.74 0.93 119.26 122.54 2dwu h ALA 252 Ca 0.12 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2dwu h ALA 252 Cb 0.56 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2dwu h ALA 252 CO 0.03 0.04 0.06 1.49 0.00 0.00 0.00 179.25 180.88 2dwu h GLU 253 N 0.67 0.77 -0.39 0.00 4.81 -1.09 0.57 114.58 119.92 2dwu h GLU 253 Ca 0.27 -0.18 -0.09 0.00 -0.13 0.00 0.00 59.36 59.24 2dwu h GLU 253 Cb 0.13 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2dwu h GLU 253 CO -0.15 0.74 -0.09 0.00 -0.73 0.00 0.00 179.01 178.77 2dwu h ARG 254 N 0.73 0.75 -0.00 1.92 -0.00 -0.83 -0.54 114.38 116.41 2dwu h ARG 254 Ca 0.15 -0.28 -0.17 0.00 -0.50 0.00 0.00 59.98 59.18 2dwu h ARG 254 Cb 0.36 -0.04 0.01 0.00 0.00 0.00 0.00 29.97 30.30 2dwu h ARG 254 CO 0.01 0.89 -0.67 -1.49 0.00 0.00 0.00 179.97 178.70 2dwu h TRP 255 N 0.55 0.68 0.00 3.04 4.06 -0.63 -3.36 115.95 120.29 2dwu h TRP 255 Ca 0.10 -0.37 -0.22 0.00 2.06 0.00 0.00 58.89 60.46 2dwu h TRP 255 Cb 0.61 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.66 2dwu h TRP 255 CO 0.05 1.19 -1.19 -0.07 -3.56 0.00 0.00 178.44 174.85 2dwu h LEU 256 N -0.02 0.00 0.00 -4.49 3.38 -0.98 -3.48 115.31 109.71 2dwu h LEU 256 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2dwu h LEU 256 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 2dwu h LEU 256 CO 0.13 0.90 0.00 0.61 0.09 0.00 0.00 178.44 180.17 2dwu n GLY 257 N 1.40 0.75 3.56 0.83 0.00 -0.21 -5.04 105.19 106.47 2dwu n GLY 257 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2dwu n GLY 257 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dwu s TYR 258 N -2.34 -0.26 0.35 1.61 -0.85 -1.22 -5.03 117.35 109.60 2dwu s TYR 258 Ca 0.00 -0.06 -0.20 0.00 -0.52 0.00 0.00 57.07 56.29 2dwu s TYR 258 Cb 0.00 0.51 -0.10 0.00 0.38 0.00 0.00 41.96 42.75 2dwu s TYR 258 CO 0.00 -0.96 0.86 -0.65 -1.52 0.00 0.00 175.55 173.27 2dwu s GLN 259 N -3.84 4.24 0.30 -3.49 -0.21 -1.26 -4.04 119.66 111.35 2dwu s GLN 259 Ca 0.07 1.00 0.04 0.00 0.02 0.00 0.00 55.36 56.49 2dwu s GLN 259 Cb -0.02 -2.48 -0.06 0.00 1.00 0.00 0.00 33.01 31.45 2dwu s GLN 259 CO -0.04 0.15 0.04 0.96 -2.12 0.00 0.00 175.29 174.28 2dwu s ILE 260 N -1.92 1.13 -0.35 1.08 -4.36 -1.26 -5.07 121.20 110.46 2dwu s ILE 260 Ca 0.55 -2.02 -0.25 0.00 -0.26 0.00 0.00 60.65 58.67 2dwu s ILE 260 Cb -0.12 -2.66 0.01 0.00 1.25 0.00 0.00 42.46 40.94 2dwu s ILE 260 CO 0.18 -0.09 0.89 -0.44 0.24 0.00 0.00 174.94 175.72 2dwu s SER 261 N -3.43 6.69 -0.06 4.36 0.01 -1.26 -5.03 113.70 114.98 2dwu s SER 261 Ca 0.35 0.62 0.04 0.00 1.31 0.00 0.00 55.95 58.27 2dwu s SER 261 Cb 0.08 -2.45 -0.00 0.00 0.21 0.00 0.00 66.02 63.85 2dwu s SER 261 CO 0.14 -0.79 -0.19 -0.69 0.41 0.00 0.00 173.24 172.12 2dwu s VAL 262 N 3.33 1.63 0.12 3.43 1.01 -1.26 -1.33 120.40 127.32 2dwu s VAL 262 Ca 0.37 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.59 2dwu s VAL 262 Cb -0.13 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2dwu s VAL 262 CO 0.17 0.46 -0.12 -1.81 0.00 0.00 0.00 175.10 173.80 2dwu s ASP 263 N 0.16 1.77 0.40 3.32 1.11 -0.43 -5.00 116.67 118.00 2dwu s ASP 263 Ca -0.09 -0.85 -0.17 0.00 0.18 0.00 0.00 52.55 51.63 2dwu s ASP 263 Cb -0.14 -0.03 -0.09 0.00 1.07 0.00 0.00 42.92 43.73 2dwu s ASP 263 CO 0.04 -0.22 0.86 0.00 1.18 0.00 0.00 175.17 177.03 2dwu s VAL 265 N -2.21 0.04 -0.12 0.00 0.11 -0.68 -4.82 120.40 112.71 2dwu s VAL 265 Ca 0.58 -0.30 -0.01 0.00 -2.93 0.00 0.00 61.98 59.32 2dwu s VAL 265 Cb -0.10 -0.61 -0.03 0.00 -1.53 0.00 0.00 36.38 34.11 2dwu s VAL 265 CO 0.20 -0.16 -0.07 -1.81 -3.33 0.00 0.00 175.10 169.92 2dwu s ASP 266 N -0.85 4.56 0.03 3.54 -0.00 -1.26 -4.23 116.67 118.46 2dwu s ASP 266 Ca -0.09 -0.14 0.09 0.00 -0.00 0.00 0.00 52.55 52.41 2dwu s ASP 266 Cb -0.04 -1.52 -0.03 0.00 -0.00 0.00 0.00 42.92 41.33 2dwu s ASP 266 CO 0.03 0.24 -0.26 -0.76 -0.00 0.00 0.00 175.17 174.42 2dwu s LEU 267 N -0.06 2.15 0.52 1.23 1.43 -1.26 -3.79 118.68 118.90 2dwu s LEU 267 Ca 0.00 -0.56 -0.19 0.00 -1.03 0.00 0.00 54.13 52.34 2dwu s LEU 267 Cb -0.13 -1.30 -0.07 0.00 0.03 0.00 0.00 46.19 44.71 2dwu s LEU 267 CO 0.03 0.27 1.05 -2.16 0.23 0.00 0.00 176.35 175.77 2dwu s PRO 268 N -1.12 3.64 0.32 1.29 0.04 -1.26 -5.09 135.00 132.83 2dwu s PRO 268 Ca 0.11 1.36 -0.29 0.00 0.04 0.00 0.00 61.00 62.22 2dwu s PRO 268 Cb -0.10 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.25 2dwu s PRO 268 CO 0.01 -0.56 1.45 0.28 0.04 0.00 0.00 177.00 178.22 2dwu n VAL 269 N -1.24 1.55 -0.92 -0.36 0.31 -1.25 -5.16 118.33 111.27 2dwu n VAL 269 Ca 0.09 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2dwu n VAL 269 Cb 0.52 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.68 2dwu n VAL 269 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80