#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b73 s LYS 2 N 0.00 2.39 -0.15 2.12 2.20 -1.26 -1.72 119.74 123.32 1b73 s LYS 2 Ca 0.00 -0.64 -0.06 0.00 -0.36 0.00 0.00 55.97 54.91 1b73 s LYS 2 Cb 0.00 -1.91 -0.04 0.00 -1.51 0.00 0.00 37.83 34.37 1b73 s LYS 2 CO 0.00 0.05 0.06 0.42 -0.36 0.00 0.00 175.35 175.52 1b73 s ILE 3 N 0.66 4.82 -0.24 5.43 1.01 0.46 -1.07 121.20 132.27 1b73 s ILE 3 Ca -0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 60.65 60.43 1b73 s ILE 3 Cb -0.16 -3.13 -0.01 0.00 0.01 0.00 0.00 42.46 39.17 1b73 s ILE 3 CO 0.04 0.52 0.00 -0.83 0.00 0.00 0.00 174.94 174.67 1b73 s GLY 4 N -0.14 1.67 0.02 6.18 0.00 -0.85 -1.81 107.32 112.40 1b73 s GLY 4 Ca 0.07 -1.22 0.02 0.00 0.00 0.00 0.00 44.72 43.59 1b73 s GLY 4 CO 0.01 0.49 0.00 -0.42 0.00 0.00 0.00 173.10 173.19 1b73 s ILE 5 N 1.51 4.15 -0.02 0.90 1.09 -0.73 0.55 121.20 128.65 1b73 s ILE 5 Ca 0.05 -0.67 -0.02 0.00 -1.10 0.00 0.00 60.65 58.91 1b73 s ILE 5 Cb -0.15 -2.88 0.00 0.00 -1.06 0.00 0.00 42.46 38.37 1b73 s ILE 5 CO -0.01 0.33 0.05 0.72 -0.10 0.00 0.00 174.94 175.93 1b73 s PHE 6 N -1.13 -0.01 0.29 3.97 -0.12 0.31 -1.94 117.98 119.34 1b73 s PHE 6 Ca 0.21 0.05 -0.09 0.00 -0.05 0.00 0.00 56.93 57.04 1b73 s PHE 6 Cb -0.12 -0.01 0.00 0.00 -0.63 0.00 0.00 43.02 42.27 1b73 s PHE 6 CO 0.12 -0.07 0.50 0.34 -0.05 0.00 0.00 175.22 176.06 1b73 s ASP 7 N -0.28 0.27 0.05 1.98 -1.08 -0.55 -2.51 116.67 114.56 1b73 s ASP 7 Ca -0.03 -1.16 0.07 0.00 -0.52 0.00 0.00 52.55 50.91 1b73 s ASP 7 Cb -0.02 0.64 -0.23 0.00 -1.46 0.00 0.00 42.92 41.85 1b73 s ASP 7 CO 0.00 -1.25 1.02 0.77 0.52 0.00 0.00 175.17 176.24 1b73 h SER 8 N 2.19 0.08 0.00 -0.34 4.64 -1.85 0.28 113.55 118.54 1b73 h SER 8 Ca -0.28 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1b73 h SER 8 Cb 1.25 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1b73 h SER 8 CO 0.38 1.09 0.00 0.61 -0.87 0.00 0.00 176.83 178.03 1b73 n GLY 9 N 1.47 4.78 0.49 -0.77 0.00 -1.26 -1.77 105.19 108.12 1b73 n GLY 9 Ca -0.08 -0.71 0.06 0.00 0.00 0.00 0.00 46.02 45.30 1b73 n GLY 9 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1b73 n VAL 10 N 0.00 0.00 0.30 1.61 0.24 -1.26 -4.55 118.33 114.68 1b73 n VAL 10 Ca 0.00 -0.50 0.19 0.00 -2.04 0.00 0.00 64.34 62.00 1b73 n VAL 10 Cb 0.00 1.26 0.96 0.00 -1.47 0.00 0.00 33.84 34.59 1b73 n VAL 10 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1b73 h GLY 11 N 2.47 0.00 1.66 7.63 0.00 -1.99 -1.83 103.07 111.01 1b73 h GLY 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1b73 h GLY 11 CO 0.00 0.00 -0.20 0.61 0.00 0.00 0.00 176.54 176.95 1b73 n GLY 12 N -0.80 -1.48 0.00 4.60 0.00 -1.26 -3.47 105.19 102.78 1b73 n GLY 12 Ca -0.02 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.93 1b73 n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b73 n LEU 13 N -1.75 0.00 0.04 0.99 4.77 -0.69 -2.07 117.00 118.29 1b73 n LEU 13 Ca 0.06 0.31 -0.03 0.00 -0.03 0.00 0.00 56.01 56.31 1b73 n LEU 13 Cb 0.37 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1b73 n LEU 13 CO 0.31 -0.13 0.08 0.74 -1.33 0.00 0.00 177.39 177.05 1b73 h THR 14 N 0.00 0.00 -0.13 -5.08 2.02 -1.75 -2.91 112.91 105.05 1b73 h THR 14 Ca 0.00 -0.85 0.05 0.00 0.77 0.00 0.00 66.41 66.37 1b73 h THR 14 Cb 0.17 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.52 1b73 h THR 14 CO 0.00 0.00 -0.37 0.58 0.37 0.00 0.00 175.52 176.10 1b73 h VAL 15 N -1.05 0.22 -1.23 3.16 2.07 -1.75 -1.88 116.25 115.78 1b73 h VAL 15 Ca -0.02 0.00 0.37 0.00 0.82 0.00 0.00 66.70 67.87 1b73 h VAL 15 Cb 0.15 0.22 -0.11 0.00 -1.52 0.00 0.00 31.29 30.03 1b73 h VAL 15 CO 0.03 0.00 0.81 0.25 0.02 0.00 0.00 177.57 178.68 1b73 h LEU 16 N -0.44 0.28 -0.24 2.57 6.46 -1.55 0.54 115.31 122.93 1b73 h LEU 16 Ca 0.09 0.10 -0.21 0.00 -0.12 0.00 0.00 57.88 57.74 1b73 h LEU 16 Cb 0.59 0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 40.58 1b73 h LEU 16 CO -0.38 -0.06 -0.88 0.11 -0.62 0.00 0.00 178.44 176.60 1b73 h LYS 17 N 0.18 0.36 0.38 1.25 1.57 -1.15 -2.58 116.57 116.59 1b73 h LYS 17 Ca 0.72 -0.37 -0.02 0.00 -1.87 0.00 0.00 60.65 59.11 1b73 h LYS 17 Cb 2.21 0.10 0.00 0.00 0.08 0.00 0.00 32.23 34.63 1b73 h LYS 17 CO -0.32 1.04 -0.18 0.00 -0.57 0.00 0.00 179.45 179.42 1b73 h ALA 18 N 0.83 -0.51 -2.07 3.86 0.00 0.56 -2.25 119.26 119.67 1b73 h ALA 18 Ca -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1b73 h ALA 18 Cb 1.51 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1b73 h ALA 18 CO 0.15 -0.61 0.00 -0.89 0.00 0.00 0.00 179.25 177.90 1b73 n ILE 19 N -5.17 0.00 -0.53 0.00 5.41 0.10 -1.41 119.36 117.76 1b73 n ILE 19 Ca -0.10 1.15 0.41 0.00 1.00 0.00 0.00 62.75 65.21 1b73 n ILE 19 Cb 0.28 -1.81 0.64 0.00 -0.71 0.00 0.00 39.64 38.05 1b73 n ILE 19 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1b73 n ARG 20 N -1.42 -0.01 0.05 0.38 3.00 -0.97 0.99 116.66 118.68 1b73 n ARG 20 Ca 0.00 0.92 -0.12 0.00 -0.00 0.00 0.00 57.85 58.65 1b73 n ARG 20 Cb 0.00 -2.03 -0.13 0.00 0.00 0.00 0.00 32.46 30.30 1b73 n ARG 20 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.63 176.66 1b73 h ASN 21 N 0.00 0.19 0.01 6.15 -1.24 -0.72 -3.29 115.58 116.68 1b73 h ASN 21 Ca 0.75 -0.26 -0.02 0.00 0.71 0.00 0.00 56.30 57.48 1b73 h ASN 21 Cb 2.88 -0.06 -0.00 0.00 0.73 0.00 0.00 38.32 41.87 1b73 h ASN 21 CO -0.10 1.22 -0.11 -0.09 -1.29 0.00 0.00 177.43 177.05 1b73 h ARG 22 N 0.03 0.02 -3.14 6.67 2.43 0.19 -3.37 114.38 117.21 1b73 h ARG 22 Ca -0.18 -0.03 -0.79 0.00 -0.81 0.00 0.00 59.98 58.17 1b73 h ARG 22 Cb 1.94 0.01 -0.29 0.00 -0.42 0.00 0.00 29.97 31.21 1b73 h ARG 22 CO 0.14 1.01 0.58 0.66 -1.51 0.00 0.00 179.97 180.85 1b73 n TYR 23 N -4.57 3.48 0.28 2.20 4.01 0.61 -4.88 117.16 118.28 1b73 n TYR 23 Ca -0.11 -3.19 0.13 0.00 -0.16 0.00 0.00 57.90 54.56 1b73 n TYR 23 Cb 0.51 -1.39 0.67 0.00 -0.31 0.00 0.00 39.34 38.82 1b73 n TYR 23 CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 1b73 h ARG 24 N 5.84 0.00 0.00 -0.72 0.11 -1.73 -2.76 114.38 115.13 1b73 h ARG 24 Ca 0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.27 1b73 h ARG 24 Cb 0.72 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.80 1b73 h ARG 24 CO 1.18 0.00 0.00 1.63 0.10 0.00 0.00 179.97 182.88 1b73 n LYS 25 N -2.61 -0.49 -2.34 0.08 4.76 -1.26 -4.79 118.16 111.51 1b73 n LYS 25 Ca -0.02 -0.61 -0.34 0.00 -2.87 0.00 0.00 58.31 54.47 1b73 n LYS 25 Cb 0.35 -0.99 -0.01 0.00 -1.84 0.00 0.00 35.03 32.54 1b73 n LYS 25 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1b73 s VAL 26 N -0.12 3.49 0.12 -0.18 0.11 -1.04 -1.87 120.40 120.90 1b73 s VAL 26 Ca 0.00 0.90 -0.11 0.00 -2.93 0.00 0.00 61.98 59.84 1b73 s VAL 26 Cb 0.00 -3.36 -0.06 0.00 -1.53 0.00 0.00 36.38 31.43 1b73 s VAL 26 CO 0.00 -0.23 0.46 -1.81 -3.33 0.00 0.00 175.10 170.19 1b73 s ASP 27 N -1.98 6.68 0.07 3.54 -0.00 -0.70 -4.18 116.67 120.10 1b73 s ASP 27 Ca 0.69 0.87 0.04 0.00 -0.00 0.00 0.00 52.55 54.15 1b73 s ASP 27 Cb -0.20 -2.21 -0.03 0.00 -0.00 0.00 0.00 42.92 40.49 1b73 s ASP 27 CO 0.25 0.11 -0.11 -0.63 -0.00 0.00 0.00 175.17 174.79 1b73 s ILE 28 N -1.49 0.90 -0.17 0.77 1.01 -0.83 0.17 121.20 121.57 1b73 s ILE 28 Ca 0.37 -1.31 -0.04 0.00 0.00 0.00 0.00 60.65 59.67 1b73 s ILE 28 Cb -0.14 -0.99 0.08 0.00 0.01 0.00 0.00 42.46 41.43 1b73 s ILE 28 CO 0.19 -0.34 0.28 -0.69 0.00 0.00 0.00 174.94 174.38 1b73 s VAL 29 N -1.54 -0.43 0.02 2.92 1.01 -0.75 -1.30 120.40 120.33 1b73 s VAL 29 Ca -0.03 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.06 1b73 s VAL 29 Cb -0.09 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1b73 s VAL 29 CO 0.01 -0.01 0.11 -0.47 0.00 0.00 0.00 175.10 174.74 1b73 s TYR 30 N 2.42 3.33 -0.11 5.22 5.04 0.56 -1.77 117.35 132.05 1b73 s TYR 30 Ca 0.04 0.20 -0.04 0.00 -2.44 0.00 0.00 57.07 54.84 1b73 s TYR 30 Cb -0.14 -1.73 0.05 0.00 0.35 0.00 0.00 41.96 40.49 1b73 s TYR 30 CO -0.11 0.56 0.09 -1.17 -1.34 0.00 0.00 175.55 173.59 1b73 s LEU 31 N -2.02 0.19 -0.12 6.97 2.96 -0.82 -1.89 118.68 123.94 1b73 s LEU 31 Ca 0.27 -0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 53.89 1b73 s LEU 31 Cb -0.12 -0.12 -0.04 0.00 0.50 0.00 0.00 46.19 46.41 1b73 s LEU 31 CO 0.18 -0.30 0.17 -0.83 -1.32 0.00 0.00 176.35 174.25 1b73 s GLY 32 N 2.18 2.17 -1.18 7.98 0.00 -0.26 -1.48 107.32 116.73 1b73 s GLY 32 Ca 0.04 -0.61 -0.06 0.00 0.00 0.00 0.00 44.72 44.09 1b73 s GLY 32 CO -0.06 -0.22 1.81 1.34 0.00 0.00 0.00 173.10 175.96 1b73 n ASP 33 N 2.27 6.37 0.22 1.64 2.03 0.99 -2.49 116.55 127.59 1b73 n ASP 33 Ca -0.19 -3.31 0.06 0.00 0.52 0.00 0.00 54.79 51.87 1b73 n ASP 33 Cb 0.54 -1.34 0.50 0.00 -0.72 0.00 0.00 41.12 40.11 1b73 n ASP 33 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1b73 h THR 34 N 3.22 1.08 0.00 5.18 1.35 -1.74 -1.05 112.91 120.96 1b73 h THR 34 Ca 0.39 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 1b73 h THR 34 Cb 0.53 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 1b73 h THR 34 CO 1.44 0.21 0.00 0.00 -0.25 0.00 0.00 175.52 176.91 1b73 h ALA 35 N 1.79 1.00 0.00 6.62 0.00 -1.83 -2.95 119.26 123.90 1b73 h ALA 35 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b73 h ALA 35 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1b73 h ALA 35 CO 0.03 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.82 1b73 n ARG 36 N -2.41 0.11 -0.02 0.00 1.74 -1.10 -4.99 116.66 109.99 1b73 n ARG 36 Ca 0.02 -0.49 0.01 0.00 -0.77 0.00 0.00 57.85 56.62 1b73 n ARG 36 Cb 0.24 -0.76 0.03 0.00 -1.02 0.00 0.00 32.46 30.95 1b73 n ARG 36 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1b73 n VAL 37 N -0.08 -0.02 -1.81 1.55 3.14 -0.42 -3.71 118.33 116.99 1b73 n VAL 37 Ca 0.00 0.11 -0.42 0.00 -2.96 0.00 0.00 64.34 61.07 1b73 n VAL 37 Cb 0.20 -0.17 -0.01 0.00 -1.06 0.00 0.00 33.84 32.80 1b73 n VAL 37 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1b73 n PRO 38 N -3.27 2.68 0.20 1.45 -0.04 -1.26 -4.66 135.00 130.10 1b73 n PRO 38 Ca 0.02 -2.61 -0.13 0.00 -0.04 0.00 0.00 63.50 60.74 1b73 n PRO 38 Cb 0.06 -3.29 -0.08 0.00 -0.04 0.00 0.00 33.50 30.16 1b73 n PRO 38 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1b73 h TYR 39 N 6.67 -0.48 0.00 0.54 0.05 -1.96 -3.36 116.97 118.43 1b73 h TYR 39 Ca 0.52 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.28 1b73 h TYR 39 Cb 0.69 0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.59 1b73 h TYR 39 CO 1.42 -0.15 0.00 0.41 -1.05 0.00 0.00 178.16 178.78 1b73 n GLY 40 N -0.37 0.00 0.00 3.88 0.00 -1.26 -0.53 105.19 106.92 1b73 n GLY 40 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1b73 n GLY 40 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1b73 n ILE 41 N 0.12 0.00 -1.07 -0.61 -5.35 -1.26 -3.55 119.36 107.64 1b73 n ILE 41 Ca 0.00 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.18 1b73 n ILE 41 Cb 0.00 -0.08 0.13 0.00 -1.74 0.00 0.00 39.64 37.96 1b73 n ILE 41 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1b73 s ARG 42 N -1.40 1.47 1.00 6.28 1.81 0.31 -5.01 118.95 123.41 1b73 s ARG 42 Ca 0.00 1.13 -0.12 0.00 -1.72 0.00 0.00 55.73 55.02 1b73 s ARG 42 Cb 0.00 -1.81 0.19 0.00 -0.45 0.00 0.00 34.95 32.88 1b73 s ARG 42 CO 0.00 -2.18 1.08 -1.12 -0.68 0.00 0.00 175.30 172.40 1b73 s SER 43 N -3.18 2.47 0.07 0.23 0.01 -1.26 -4.81 113.70 107.23 1b73 s SER 43 Ca 0.64 1.58 -0.34 0.00 1.31 0.00 0.00 55.95 59.13 1b73 s SER 43 Cb -0.19 -2.24 -0.18 0.00 0.21 0.00 0.00 66.02 63.62 1b73 s SER 43 CO 0.57 -3.28 1.60 0.50 0.41 0.00 0.00 173.24 173.04 1b73 h LYS 44 N -1.99 -0.97 -0.00 12.44 3.64 -1.97 0.02 116.57 127.73 1b73 h LYS 44 Ca -0.53 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1b73 h LYS 44 Cb 1.30 0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 33.34 1b73 h LYS 44 CO 0.51 -0.64 0.12 -0.44 -2.27 0.00 0.00 179.45 176.73 1b73 h ASP 45 N -1.00 0.00 0.15 4.20 3.32 -1.96 0.56 116.42 121.68 1b73 h ASP 45 Ca -0.09 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.71 1b73 h ASP 45 Cb 0.80 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.37 1b73 h ASP 45 CO 0.10 0.00 -1.21 0.74 -1.72 0.00 0.00 179.24 177.15 1b73 h THR 46 N 0.00 1.25 -0.43 0.35 2.02 -1.71 -2.69 112.91 111.70 1b73 h THR 46 Ca 0.00 -2.51 -0.07 0.00 0.77 0.00 0.00 66.41 64.60 1b73 h THR 46 Cb 0.24 2.96 -0.02 0.00 -1.74 0.00 0.00 68.15 69.60 1b73 h THR 46 CO -0.00 0.74 -0.01 0.40 0.37 0.00 0.00 175.52 177.02 1b73 h ILE 47 N -0.23 1.23 0.00 3.11 2.04 0.96 -0.52 117.51 124.09 1b73 h ILE 47 Ca -0.24 -0.95 -0.14 0.00 1.00 0.00 0.00 64.86 64.54 1b73 h ILE 47 Cb 1.80 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 1b73 h ILE 47 CO 0.14 0.33 -0.65 0.40 0.00 0.00 0.00 178.15 178.36 1b73 h ILE 48 N 0.66 1.41 0.05 -0.67 2.04 -1.19 -2.59 117.51 117.22 1b73 h ILE 48 Ca 0.13 -2.29 -0.19 0.00 1.00 0.00 0.00 64.86 63.51 1b73 h ILE 48 Cb 0.42 2.26 0.02 0.00 -0.74 0.00 0.00 36.82 38.78 1b73 h ILE 48 CO 0.02 0.64 -0.79 -0.09 0.00 0.00 0.00 178.15 177.93 1b73 h ARG 49 N 0.00 0.44 -0.01 2.37 2.43 -1.04 -2.00 114.38 116.57 1b73 h ARG 49 Ca -0.01 -0.54 -0.06 0.00 -0.81 0.00 0.00 59.98 58.56 1b73 h ARG 49 Cb 1.20 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.91 1b73 h ARG 49 CO 0.09 1.20 -0.30 1.88 -1.51 0.00 0.00 179.97 181.32 1b73 h TYR 50 N -0.07 0.01 0.05 2.20 0.05 -1.20 -2.21 116.97 115.81 1b73 h TYR 50 Ca -0.11 -0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.50 1b73 h TYR 50 Cb 1.51 -0.00 0.02 0.00 1.01 0.00 0.00 36.73 39.27 1b73 h TYR 50 CO 0.15 0.31 -0.68 0.77 -1.05 0.00 0.00 178.16 177.66 1b73 h SER 51 N 0.01 0.51 -0.02 3.88 0.02 -1.53 -2.59 113.55 113.83 1b73 h SER 51 Ca -0.00 -0.83 0.02 0.00 -0.84 0.00 0.00 61.79 60.14 1b73 h SER 51 Cb 0.53 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.89 1b73 h SER 51 CO 0.04 1.29 -0.10 -0.07 -1.14 0.00 0.00 176.83 176.84 1b73 h LEU 52 N -0.21 -0.30 -0.54 5.07 4.07 -1.23 -1.17 115.31 121.00 1b73 h LEU 52 Ca -0.10 0.05 0.03 0.00 0.08 0.00 0.00 57.88 57.94 1b73 h LEU 52 Cb 1.44 0.13 -0.04 0.00 1.08 0.00 0.00 40.66 43.27 1b73 h LEU 52 CO 0.13 -0.15 0.32 -0.33 -1.08 0.00 0.00 178.44 177.34 1b73 h GLU 53 N -0.17 0.61 -0.15 1.13 5.08 -1.48 0.13 114.58 119.75 1b73 h GLU 53 Ca 0.05 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.22 1b73 h GLU 53 Cb 0.23 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1b73 h GLU 53 CO -0.12 0.41 -0.54 0.00 -1.00 0.00 0.00 179.01 177.76 1b73 h ALA 55 N 1.08 0.47 -0.65 0.00 0.00 -0.74 -2.47 119.26 116.95 1b73 h ALA 55 Ca 0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1b73 h ALA 55 Cb 1.05 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1b73 h ALA 55 CO 0.09 0.50 0.22 0.78 0.00 0.00 0.00 179.25 180.84 1b73 h GLY 56 N 0.54 1.06 0.60 0.00 0.00 -0.72 0.37 103.07 104.91 1b73 h GLY 56 Ca 0.05 -0.59 0.03 0.00 0.00 0.00 0.00 47.33 46.83 1b73 h GLY 56 CO 0.08 0.55 -0.12 -2.75 0.00 0.00 0.00 176.54 174.29 1b73 h PHE 57 N 0.95 -0.31 -0.35 5.60 3.04 -1.06 0.36 116.94 125.17 1b73 h PHE 57 Ca 0.22 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 62.07 1b73 h PHE 57 Cb 0.25 0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.90 1b73 h PHE 57 CO 0.02 -0.18 -0.22 -0.07 -2.02 0.00 0.00 178.31 175.83 1b73 h LEU 58 N -0.17 0.69 0.10 0.59 3.38 -1.13 -2.73 115.31 116.05 1b73 h LEU 58 Ca 0.07 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1b73 h LEU 58 Cb 0.27 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1b73 h LEU 58 CO -0.18 0.90 -0.08 0.50 0.09 0.00 0.00 178.44 179.67 1b73 h LYS 59 N 0.60 -0.19 0.00 1.13 3.64 0.27 0.54 116.57 122.56 1b73 h LYS 59 Ca 0.09 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1b73 h LYS 59 Cb 0.70 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1b73 h LYS 59 CO 0.05 -0.13 0.00 -0.25 -2.27 0.00 0.00 179.45 176.86 1b73 n ASP 60 N -5.20 0.00 -1.06 4.20 10.43 0.07 0.11 116.55 125.11 1b73 n ASP 60 Ca -0.08 -0.29 0.12 0.00 2.57 0.00 0.00 54.79 57.11 1b73 n ASP 60 Cb 0.12 0.00 0.19 0.00 1.84 0.00 0.00 41.12 43.27 1b73 n ASP 60 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1b73 n LYS 61 N -0.98 2.41 -2.14 -1.24 3.00 0.19 -4.95 118.16 114.46 1b73 n LYS 61 Ca 0.06 -2.10 -0.02 0.00 -0.00 0.00 0.00 58.31 56.26 1b73 n LYS 61 Cb 0.03 -1.49 0.00 0.00 0.00 0.00 0.00 35.03 33.57 1b73 n LYS 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1b73 n GLY 62 N 1.44 0.41 3.91 3.14 0.00 0.30 -5.06 105.19 109.33 1b73 n GLY 62 Ca 0.17 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 45.14 1b73 n GLY 62 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b73 s VAL 63 N -2.26 3.90 -0.14 1.61 -7.23 -1.18 -4.83 120.40 110.27 1b73 s VAL 63 Ca 0.01 0.09 0.13 0.00 -1.81 0.00 0.00 61.98 60.40 1b73 s VAL 63 Cb -0.00 -3.54 -0.24 0.00 0.56 0.00 0.00 36.38 33.16 1b73 s VAL 63 CO 0.01 -0.57 0.30 0.47 -0.31 0.00 0.00 175.10 175.00 1b73 n ASP 64 N -2.55 0.65 -4.02 4.85 8.00 -0.23 -4.89 116.55 118.35 1b73 n ASP 64 Ca 0.04 0.17 -0.08 0.00 0.71 0.00 0.00 54.79 55.63 1b73 n ASP 64 Cb 0.57 0.34 -0.09 0.00 -0.02 0.00 0.00 41.12 41.92 1b73 n ASP 64 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1b73 s ILE 65 N -2.54 0.19 -0.16 0.53 -4.36 -1.25 -4.07 121.20 109.54 1b73 s ILE 65 Ca -0.11 -1.62 -0.01 0.00 -0.26 0.00 0.00 60.65 58.65 1b73 s ILE 65 Cb 0.07 -1.49 0.05 0.00 1.25 0.00 0.00 42.46 42.33 1b73 s ILE 65 CO 0.81 -0.86 -0.01 -0.63 0.24 0.00 0.00 174.94 174.48 1b73 s ILE 66 N -3.91 0.79 -0.25 8.37 1.01 -0.52 -2.00 121.20 124.69 1b73 s ILE 66 Ca 0.07 -0.48 -0.15 0.00 0.00 0.00 0.00 60.65 60.08 1b73 s ILE 66 Cb 0.07 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1b73 s ILE 66 CO -0.10 0.04 0.39 -0.69 0.00 0.00 0.00 174.94 174.58 1b73 s VAL 67 N 1.76 5.18 -0.42 2.92 1.01 0.19 -1.47 120.40 129.57 1b73 s VAL 67 Ca 0.01 0.64 -0.06 0.00 0.00 0.00 0.00 61.98 62.56 1b73 s VAL 67 Cb -0.15 -3.72 0.10 0.00 0.00 0.00 0.00 36.38 32.61 1b73 s VAL 67 CO -0.07 0.18 0.23 0.54 0.00 0.00 0.00 175.10 175.99 1b73 s VAL 68 N 1.83 3.75 -2.00 2.92 0.11 -0.47 -0.53 120.40 126.00 1b73 s VAL 68 Ca 0.17 -1.74 0.13 0.00 -2.93 0.00 0.00 61.98 57.61 1b73 s VAL 68 Cb -0.15 -3.42 0.36 0.00 -1.53 0.00 0.00 36.38 31.64 1b73 s VAL 68 CO 0.09 -0.60 1.29 0.00 -3.33 0.00 0.00 175.10 172.55 1b73 n ALA 69 N 4.76 2.31 -2.74 1.54 0.00 -1.04 -3.52 120.51 121.82 1b73 n ALA 69 Ca -0.07 -0.08 -0.36 0.00 0.00 0.00 0.00 53.44 52.93 1b73 n ALA 69 Cb 0.42 -1.21 -0.07 0.00 0.00 0.00 0.00 19.45 18.59 1b73 n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b73 h ASN 71 N 6.31 0.69 -0.37 0.00 4.21 -1.93 -1.45 115.58 123.03 1b73 h ASN 71 Ca -0.44 -0.20 -0.09 0.00 1.21 0.00 0.00 56.30 56.78 1b73 h ASN 71 Cb 1.17 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 38.17 1b73 h ASN 71 CO 0.72 0.83 -0.09 0.74 -1.29 0.00 0.00 177.43 178.34 1b73 h THR 72 N 0.64 1.26 0.13 2.81 2.02 -1.95 -1.31 112.91 116.50 1b73 h THR 72 Ca 0.11 -1.15 -0.32 0.00 0.77 0.00 0.00 66.41 65.81 1b73 h THR 72 Cb 0.57 1.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1b73 h THR 72 CO 0.04 0.40 -1.62 0.00 0.37 0.00 0.00 175.52 174.70 1b73 h ALA 73 N 1.16 0.27 0.00 6.16 0.00 -1.89 -3.13 119.26 121.83 1b73 h ALA 73 Ca 0.13 -1.15 -0.04 0.00 0.00 0.00 0.00 54.91 53.85 1b73 h ALA 73 Cb 0.58 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1b73 h ALA 73 CO 0.04 1.14 -0.19 0.77 0.00 0.00 0.00 179.25 181.01 1b73 h SER 74 N 0.08 0.00 1.21 0.00 0.02 -1.28 0.53 113.55 114.11 1b73 h SER 74 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1b73 h SER 74 Cb 2.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.58 1b73 h SER 74 CO 0.16 0.19 -0.34 0.00 -1.14 0.00 0.00 176.83 175.69 1b73 h ALA 75 N 1.81 0.78 0.00 3.77 0.00 -1.29 -3.38 119.26 120.96 1b73 h ALA 75 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b73 h ALA 75 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1b73 h ALA 75 CO 0.02 0.00 -0.59 0.66 0.00 0.00 0.00 179.25 179.34 1b73 n TYR 76 N -2.29 0.00 0.75 0.00 4.02 -1.05 -4.83 117.16 113.76 1b73 n TYR 76 Ca 0.04 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 58.02 1b73 n TYR 76 Cb 0.45 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 39.85 1b73 n TYR 76 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1b73 n ALA 77 N -1.46 2.47 0.06 -0.72 0.00 0.18 -4.68 120.51 116.35 1b73 n ALA 77 Ca 0.00 -0.65 0.04 0.00 0.00 0.00 0.00 53.44 52.82 1b73 n ALA 77 Cb 0.30 -0.62 0.43 0.00 0.00 0.00 0.00 19.45 19.56 1b73 n ALA 77 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1b73 h LEU 78 N 3.59 0.37 0.03 0.00 4.07 -1.74 -0.97 115.31 120.66 1b73 h LEU 78 Ca 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 1b73 h LEU 78 Cb 0.77 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1b73 h LEU 78 CO 0.00 0.33 -0.01 -0.33 -1.08 0.00 0.00 178.44 177.34 1b73 h GLU 79 N 0.41 -0.03 -0.66 1.13 4.39 -1.93 -2.60 114.58 115.30 1b73 h GLU 79 Ca 0.11 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.83 1b73 h GLU 79 Cb 0.06 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.68 1b73 h GLU 79 CO -0.01 0.29 0.42 0.00 -1.16 0.00 0.00 179.01 178.55 1b73 h ARG 80 N -0.36 0.83 0.57 2.33 2.47 -1.86 -0.71 114.38 117.65 1b73 h ARG 80 Ca -0.00 -0.05 -0.03 0.00 -1.26 0.00 0.00 59.98 58.64 1b73 h ARG 80 Cb 0.34 -0.19 0.01 0.00 -1.65 0.00 0.00 29.97 28.48 1b73 h ARG 80 CO 0.01 0.55 -0.28 -0.07 0.56 0.00 0.00 179.97 180.74 1b73 h LEU 81 N 0.85 -0.65 -0.44 3.04 3.38 -1.15 -1.87 115.31 118.47 1b73 h LEU 81 Ca 0.25 -0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.31 1b73 h LEU 81 Cb -0.05 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 1b73 h LEU 81 CO -0.08 -0.42 -0.09 0.11 0.09 0.00 0.00 178.44 178.05 1b73 h LYS 82 N -0.83 0.01 0.00 1.13 1.57 -1.31 0.22 116.57 117.36 1b73 h LYS 82 Ca -0.08 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1b73 h LYS 82 Cb 0.62 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1b73 h LYS 82 CO 0.13 0.01 0.00 -0.22 -0.57 0.00 0.00 179.45 178.80 1b73 h LYS 83 N 0.01 0.00 0.00 3.15 3.64 -1.07 -3.23 116.57 119.08 1b73 h LYS 83 Ca 0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1b73 h LYS 83 Cb 0.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1b73 h LYS 83 CO -0.44 0.00 -1.00 0.39 -2.27 0.00 0.00 179.45 176.13 1b73 n GLU 84 N -2.90 1.55 -4.00 1.90 1.02 -0.14 -4.94 120.64 113.14 1b73 n GLU 84 Ca -0.01 -0.04 -0.35 0.00 -0.02 0.00 0.00 57.16 56.74 1b73 n GLU 84 Cb 0.18 -1.04 -0.14 0.00 -0.02 0.00 0.00 31.44 30.42 1b73 n GLU 84 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1b73 s ILE 85 N -2.19 3.43 -0.58 -3.67 -1.09 0.60 -5.00 121.20 112.70 1b73 s ILE 85 Ca -0.01 -0.48 -0.07 0.00 -2.23 0.00 0.00 60.65 57.86 1b73 s ILE 85 Cb 0.04 -2.55 -0.19 0.00 -1.58 0.00 0.00 42.46 38.18 1b73 s ILE 85 CO 0.26 0.43 3.23 -3.20 -1.23 0.00 0.00 174.94 174.43 1b73 n ASN 86 N 4.62 6.21 -3.94 3.58 5.15 -1.26 -4.58 115.26 125.03 1b73 n ASN 86 Ca -0.18 -2.47 -0.09 0.00 -0.60 0.00 0.00 54.58 51.24 1b73 n ASN 86 Cb 0.51 -1.40 -0.06 0.00 -0.53 0.00 0.00 39.78 38.30 1b73 n ASN 86 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1b73 s VAL 87 N 1.57 0.03 0.20 3.44 -7.23 -1.26 -5.11 120.40 112.04 1b73 s VAL 87 Ca 0.64 -1.29 -0.30 0.00 -1.81 0.00 0.00 61.98 59.22 1b73 s VAL 87 Cb 0.25 -1.96 -0.09 0.00 0.56 0.00 0.00 36.38 35.14 1b73 s VAL 87 CO -0.02 -0.12 1.37 -2.84 -0.31 0.00 0.00 175.10 173.18 1b73 s PRO 88 N -3.98 4.34 -0.11 4.82 0.02 -1.26 -4.81 135.00 134.02 1b73 s PRO 88 Ca 0.18 2.14 0.03 0.00 0.02 0.00 0.00 61.00 63.38 1b73 s PRO 88 Cb 0.01 -3.18 0.00 0.00 0.02 0.00 0.00 34.50 31.36 1b73 s PRO 88 CO 0.04 -0.34 -0.23 0.08 -0.33 0.00 0.00 177.00 176.21 1b73 s VAL 89 N 0.26 2.03 -0.12 3.83 1.01 -1.26 -1.45 120.40 124.71 1b73 s VAL 89 Ca 0.59 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1b73 s VAL 89 Cb -0.38 -1.77 0.02 0.00 0.00 0.00 0.00 36.38 34.25 1b73 s VAL 89 CO 0.38 0.55 -0.13 -0.36 0.00 0.00 0.00 175.10 175.55 1b73 s PHE 90 N 0.50 1.86 0.63 5.22 0.40 -0.54 -4.98 117.98 121.06 1b73 s PHE 90 Ca -0.15 -0.94 0.07 0.00 -0.60 0.00 0.00 56.93 55.32 1b73 s PHE 90 Cb -0.17 -1.40 0.11 0.00 0.51 0.00 0.00 43.02 42.07 1b73 s PHE 90 CO 0.06 -0.53 0.87 0.20 0.70 0.00 0.00 175.22 176.51 1b73 s GLY 91 N 1.31 1.71 0.00 4.36 0.00 -1.26 -1.37 107.32 112.07 1b73 s GLY 91 Ca -0.00 -2.12 0.23 0.00 0.00 0.00 0.00 44.72 42.82 1b73 s GLY 91 CO -0.06 -1.59 1.30 1.55 0.00 0.00 0.00 173.10 174.29 1b73 n VAL 92 N -2.44 0.20 -0.07 1.40 3.14 -1.23 -4.48 118.33 114.84 1b73 n VAL 92 Ca 0.17 -0.60 -0.10 0.00 -2.96 0.00 0.00 64.34 60.84 1b73 n VAL 92 Cb 0.62 1.29 -0.08 0.00 -1.06 0.00 0.00 33.84 34.61 1b73 n VAL 92 CO 0.00 0.00 0.00 0.40 -6.46 0.00 0.00 176.83 170.77 1b73 h ILE 93 N 4.50 0.91 -0.64 1.55 2.04 -1.92 -3.26 117.51 120.69 1b73 h ILE 93 Ca 0.00 -1.78 0.07 0.00 1.00 0.00 0.00 64.86 64.15 1b73 h ILE 93 Cb 0.97 1.81 -0.04 0.00 -0.74 0.00 0.00 36.82 38.82 1b73 h ILE 93 CO 0.00 0.31 0.42 -0.08 0.00 0.00 0.00 178.15 178.80 1b73 h GLU 94 N -1.00 0.59 0.00 2.37 4.57 -1.97 -0.01 114.58 119.14 1b73 h GLU 94 Ca -0.07 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 57.98 1b73 h GLU 94 Cb 0.72 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.16 1b73 h GLU 94 CO -0.04 0.39 -0.45 -1.35 -1.18 0.00 0.00 179.01 176.38 1b73 h PRO 95 N 0.61 0.00 -0.09 0.92 0.11 -1.79 -2.32 132.00 129.44 1b73 h PRO 95 Ca 0.28 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.37 1b73 h PRO 95 Cb 0.32 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.42 1b73 h PRO 95 CO -0.09 0.45 -0.04 0.78 -0.21 0.00 0.00 178.00 178.89 1b73 h GLY 96 N 2.58 0.19 0.99 -0.55 0.00 -1.40 -2.66 103.07 102.23 1b73 h GLY 96 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1b73 h GLY 96 CO 0.06 0.16 0.08 -2.08 0.00 0.00 0.00 176.54 174.75 1b73 h VAL 97 N -0.19 1.02 -0.38 4.60 2.07 -0.93 0.19 116.25 122.64 1b73 h VAL 97 Ca 0.02 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.56 1b73 h VAL 97 Cb 0.49 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1b73 h VAL 97 CO 0.01 0.03 -0.11 0.50 0.02 0.00 0.00 177.57 178.02 1b73 h LYS 98 N 0.16 -0.03 0.02 1.57 1.63 -1.47 0.64 116.57 119.09 1b73 h LYS 98 Ca 0.05 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1b73 h LYS 98 Cb -0.01 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.62 1b73 h LYS 98 CO -0.02 -0.02 -0.01 1.49 -3.45 0.00 0.00 179.45 177.45 1b73 h GLU 99 N -0.03 -0.03 0.31 1.90 4.57 -1.18 0.16 114.58 120.28 1b73 h GLU 99 Ca 0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.37 1b73 h GLU 99 Cb 0.30 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1b73 h GLU 99 CO -0.40 0.07 -0.40 0.00 -1.18 0.00 0.00 179.01 177.09 1b73 h ALA 100 N 0.86 -0.82 -0.96 2.92 0.00 0.14 0.26 119.26 121.66 1b73 h ALA 100 Ca -0.00 -0.12 0.24 0.00 0.00 0.00 0.00 54.91 55.03 1b73 h ALA 100 Cb 0.11 0.61 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 1b73 h ALA 100 CO 0.00 -1.01 0.65 -0.07 0.00 0.00 0.00 179.25 178.82 1b73 h LEU 101 N -0.76 0.31 0.23 0.00 3.38 0.62 -0.53 115.31 118.56 1b73 h LEU 101 Ca -0.02 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1b73 h LEU 101 Cb 0.71 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1b73 h LEU 101 CO -0.12 0.10 -0.11 0.50 0.09 0.00 0.00 178.44 178.89 1b73 h LYS 102 N 0.30 -0.30 -0.73 1.13 3.64 0.46 -3.33 116.57 117.73 1b73 h LYS 102 Ca 0.50 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 60.03 1b73 h LYS 102 Cb 1.45 0.07 -0.09 0.00 -0.41 0.00 0.00 32.23 33.26 1b73 h LYS 102 CO -0.17 -0.04 0.31 0.87 -2.27 0.00 0.00 179.45 178.16 1b73 h LYS 103 N -1.02 0.48 -6.76 1.90 1.79 0.22 -3.44 116.57 109.74 1b73 h LYS 103 Ca -0.03 -0.03 -0.52 0.00 -2.18 0.00 0.00 60.65 57.89 1b73 h LYS 103 Cb 0.40 -0.11 0.22 0.00 -1.58 0.00 0.00 32.23 31.16 1b73 h LYS 103 CO 0.05 0.32 -0.67 0.45 -1.08 0.00 0.00 179.45 178.52 1b73 n SER 104 N -4.96 -2.20 0.00 0.86 2.88 -0.28 -4.97 113.62 104.96 1b73 n SER 104 Ca 0.13 0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.93 1b73 n SER 104 Cb 0.36 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 1b73 n SER 104 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1b73 n ARG 105 N -1.69 0.00 0.00 -1.46 5.12 -1.26 -4.77 116.66 112.60 1b73 n ARG 105 Ca 0.06 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 56.10 1b73 n ARG 105 Cb 0.55 -0.46 0.23 0.00 -1.16 0.00 0.00 32.46 31.62 1b73 n ARG 105 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1b73 n ASN 106 N -2.85 2.52 -2.40 0.55 6.94 -1.26 -4.97 115.26 113.79 1b73 n ASN 106 Ca 0.00 -1.84 -0.15 0.00 -0.02 0.00 0.00 54.58 52.57 1b73 n ASN 106 Cb 0.41 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.82 1b73 n ASN 106 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1b73 n LYS 107 N 0.97 -2.03 -3.74 -3.83 4.01 -1.26 -4.87 118.16 107.40 1b73 n LYS 107 Ca 0.16 0.74 -0.36 0.00 -0.51 0.00 0.00 58.31 58.33 1b73 n LYS 107 Cb 0.52 -5.35 -0.10 0.00 -0.51 0.00 0.00 35.03 29.59 1b73 n LYS 107 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1b73 s LYS 108 N -4.98 2.48 0.24 1.97 1.02 -1.26 0.76 119.74 119.97 1b73 s LYS 108 Ca 0.00 -2.51 0.12 0.00 0.02 0.00 0.00 55.97 53.60 1b73 s LYS 108 Cb 0.00 -3.68 -0.05 0.00 -0.52 0.00 0.00 37.83 33.58 1b73 s LYS 108 CO 0.00 -1.16 -0.22 -1.50 -0.92 0.00 0.00 175.35 171.55 1b73 s ILE 109 N -0.03 2.43 0.24 2.17 -1.16 -0.63 -2.48 121.20 121.75 1b73 s ILE 109 Ca 0.17 -2.25 0.08 0.00 -0.51 0.00 0.00 60.65 58.13 1b73 s ILE 109 Cb -0.21 -2.23 -0.05 0.00 0.61 0.00 0.00 42.46 40.58 1b73 s ILE 109 CO -0.03 -0.28 -0.12 -0.83 -2.81 0.00 0.00 174.94 170.87 1b73 s GLY 110 N -3.16 1.63 -0.05 1.50 0.00 -0.69 -0.90 107.32 105.65 1b73 s GLY 110 Ca 0.26 -1.77 0.01 0.00 0.00 0.00 0.00 44.72 43.22 1b73 s GLY 110 CO 0.13 -1.81 -0.04 0.14 0.00 0.00 0.00 173.10 171.52 1b73 s VAL 111 N -2.93 0.52 -0.21 1.40 1.01 0.24 -0.67 120.40 119.75 1b73 s VAL 111 Ca 0.26 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 1b73 s VAL 111 Cb 0.00 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.83 1b73 s VAL 111 CO 0.10 0.23 -0.11 -0.63 0.00 0.00 0.00 175.10 174.68 1b73 s ILE 112 N 1.04 2.74 0.30 2.22 1.01 -1.09 -1.41 121.20 126.01 1b73 s ILE 112 Ca -0.09 -0.74 -0.08 0.00 0.00 0.00 0.00 60.65 59.73 1b73 s ILE 112 Cb -0.14 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.11 1b73 s ILE 112 CO -0.01 0.45 0.49 -0.83 0.00 0.00 0.00 174.94 175.05 1b73 s GLY 113 N 1.38 0.98 0.67 6.18 0.00 -1.06 0.16 107.32 115.63 1b73 s GLY 113 Ca 0.05 -1.18 -0.17 0.00 0.00 0.00 0.00 44.72 43.41 1b73 s GLY 113 CO -0.08 -0.79 1.26 -0.51 0.00 0.00 0.00 173.10 172.98 1b73 s THR 114 N -3.43 2.16 0.45 0.90 -4.23 -1.26 -0.99 115.64 109.23 1b73 s THR 114 Ca 0.26 0.09 0.23 0.00 -1.18 0.00 0.00 61.69 61.10 1b73 s THR 114 Cb -0.01 -2.92 0.43 0.00 1.34 0.00 0.00 72.50 71.35 1b73 s THR 114 CO 0.14 -0.03 1.81 -0.65 -0.54 0.00 0.00 174.62 175.35 1b73 h PRO 115 N 0.30 0.26 0.00 3.99 0.11 -1.81 -0.43 132.00 134.41 1b73 h PRO 115 Ca -0.50 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.44 1b73 h PRO 115 Cb 1.32 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.35 1b73 h PRO 115 CO 0.52 0.17 -0.74 0.00 -0.21 0.00 0.00 178.00 177.75 1b73 h ALA 116 N 1.57 0.64 0.00 -0.75 0.00 -1.89 -2.40 119.26 116.43 1b73 h ALA 116 Ca 0.55 -0.67 -0.20 0.00 0.00 0.00 0.00 54.91 54.59 1b73 h ALA 116 Cb 1.62 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 1b73 h ALA 116 CO -0.19 0.92 -1.37 1.79 0.00 0.00 0.00 179.25 180.41 1b73 h THR 117 N 0.00 0.73 0.00 0.00 1.35 -1.73 -2.90 112.91 110.36 1b73 h THR 117 Ca -0.01 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.52 1b73 h THR 117 Cb 1.43 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 1b73 h THR 117 CO 0.10 0.42 0.00 0.58 -0.25 0.00 0.00 175.52 176.36 1b73 h VAL 118 N 0.00 0.00 0.13 6.82 2.07 -1.13 -3.19 116.25 120.95 1b73 h VAL 118 Ca -0.17 -0.71 -0.34 0.00 0.82 0.00 0.00 66.70 66.29 1b73 h VAL 118 Cb 1.70 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.16 1b73 h VAL 118 CO 0.06 0.00 -1.81 0.50 0.02 0.00 0.00 177.57 176.35 1b73 h LYS 119 N 0.00 0.28 -0.88 1.57 1.63 -1.48 -3.35 116.57 114.33 1b73 h LYS 119 Ca 0.00 -0.48 0.21 0.00 -0.85 0.00 0.00 60.65 59.53 1b73 h LYS 119 Cb 0.81 0.18 -0.12 0.00 -0.60 0.00 0.00 32.23 32.50 1b73 h LYS 119 CO 0.00 1.17 0.39 0.66 -3.45 0.00 0.00 179.45 178.21 1b73 h SER 120 N 0.08 0.34 0.00 4.20 4.64 -1.50 -3.46 113.55 117.85 1b73 h SER 120 Ca -0.35 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 1b73 h SER 120 Cb 2.05 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 64.27 1b73 h SER 120 CO 0.13 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 1b73 n GLY 121 N -1.34 0.81 0.32 -0.77 0.00 -1.24 -4.94 105.19 98.03 1b73 n GLY 121 Ca 0.21 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.26 1b73 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b73 h ALA 122 N 0.00 1.63 0.01 4.61 0.00 -1.88 0.13 119.26 123.76 1b73 h ALA 122 Ca 0.00 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1b73 h ALA 122 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1b73 h ALA 122 CO 0.00 0.34 -0.01 1.88 0.00 0.00 0.00 179.25 181.46 1b73 h TYR 123 N 0.67 -0.02 0.04 0.00 0.05 -1.92 -2.69 116.97 113.10 1b73 h TYR 123 Ca 0.18 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.98 1b73 h TYR 123 Cb -0.06 0.01 -0.05 0.00 1.01 0.00 0.00 36.73 37.64 1b73 h TYR 123 CO 0.00 0.75 -0.46 1.96 -1.05 0.00 0.00 178.16 179.36 1b73 h GLN 124 N -0.85 -0.62 0.00 4.88 7.50 -1.90 -1.83 115.11 122.29 1b73 h GLN 124 Ca -0.00 0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.19 1b73 h GLN 124 Cb 0.78 0.14 0.00 0.00 0.05 0.00 0.00 27.48 28.45 1b73 h GLN 124 CO 0.00 -0.41 0.00 0.54 -1.50 0.00 0.00 178.83 177.46 1b73 n ARG 125 N -5.46 0.00 -0.07 1.46 1.74 0.02 -1.17 116.66 113.17 1b73 n ARG 125 Ca -0.07 0.59 0.22 0.00 -0.77 0.00 0.00 57.85 57.82 1b73 n ARG 125 Cb 0.39 -1.31 0.42 0.00 -1.02 0.00 0.00 32.46 30.94 1b73 n ARG 125 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1b73 h LYS 126 N 0.00 0.00 0.12 5.56 1.57 -1.43 0.48 116.57 122.87 1b73 h LYS 126 Ca 0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 1b73 h LYS 126 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1b73 h LYS 126 CO 0.00 0.00 -1.56 -0.07 -0.57 0.00 0.00 179.45 177.25 1b73 h LEU 127 N 0.00 0.40 0.23 2.94 3.38 -0.78 -3.33 115.31 118.15 1b73 h LEU 127 Ca 0.36 -0.86 -0.01 0.00 0.09 0.00 0.00 57.88 57.45 1b73 h LEU 127 Cb 2.47 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 43.09 1b73 h LEU 127 CO -0.00 1.68 -0.11 -0.33 0.09 0.00 0.00 178.44 179.77 1b73 h GLU 128 N -0.22 -0.30 0.00 1.13 5.08 0.14 -2.59 114.58 117.83 1b73 h GLU 128 Ca -0.34 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1b73 h GLU 128 Cb 1.83 0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.15 1b73 h GLU 128 CO 0.06 -0.14 0.00 -0.85 -1.00 0.00 0.00 179.01 177.09 1b73 n GLU 129 N -5.19 0.29 -0.04 2.33 0.28 -0.50 0.87 120.64 118.68 1b73 n GLU 129 Ca -0.09 0.00 0.05 0.00 -0.16 0.00 0.00 57.16 56.95 1b73 n GLU 129 Cb 0.17 -1.28 0.07 0.00 1.43 0.00 0.00 31.44 31.82 1b73 n GLU 129 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1b73 n GLY 130 N -0.33 0.44 1.65 -1.84 0.00 -1.00 -5.01 105.19 99.10 1b73 n GLY 130 Ca 0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 46.02 45.77 1b73 n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b73 n GLY 131 N 0.48 -0.47 3.64 -0.02 0.00 0.25 -5.07 105.19 104.00 1b73 n GLY 131 Ca 0.07 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 1b73 n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b73 s ALA 132 N -2.59 -1.86 -0.69 4.61 0.00 -1.06 -4.88 121.76 115.29 1b73 s ALA 132 Ca 0.01 2.25 -0.27 0.00 0.00 0.00 0.00 51.96 53.94 1b73 s ALA 132 Cb -0.00 -1.35 0.03 0.00 0.00 0.00 0.00 23.12 21.81 1b73 s ALA 132 CO 0.07 -0.36 1.24 -0.51 0.00 0.00 0.00 175.76 176.20 1b73 s ASP 133 N 1.10 6.24 0.13 0.00 1.01 0.23 -3.93 116.67 121.45 1b73 s ASP 133 Ca -0.06 -0.33 -0.30 0.00 0.71 0.00 0.00 52.55 52.58 1b73 s ASP 133 Cb -0.05 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.27 1b73 s ASP 133 CO -0.11 -1.71 1.08 -0.69 0.21 0.00 0.00 175.17 173.94 1b73 s VAL 134 N 5.42 4.10 -0.33 -1.27 1.01 -1.25 -1.60 120.40 126.48 1b73 s VAL 134 Ca 0.36 1.71 0.03 0.00 0.00 0.00 0.00 61.98 64.09 1b73 s VAL 134 Cb -0.08 -4.09 0.10 0.00 0.00 0.00 0.00 36.38 32.30 1b73 s VAL 134 CO 0.18 0.25 0.05 -0.36 0.00 0.00 0.00 175.10 175.21 1b73 s PHE 135 N 0.14 3.46 0.32 5.22 0.40 -0.07 -4.97 117.98 122.47 1b73 s PHE 135 Ca 0.51 -2.80 0.07 0.00 -0.60 0.00 0.00 56.93 54.11 1b73 s PHE 135 Cb -0.28 -2.71 -0.02 0.00 0.51 0.00 0.00 43.02 40.53 1b73 s PHE 135 CO 0.32 -0.94 0.39 0.00 0.70 0.00 0.00 175.22 175.69 1b73 s ALA 136 N 1.01 4.04 -0.22 5.36 0.00 -1.26 -0.60 121.76 130.09 1b73 s ALA 136 Ca 0.10 -1.48 -0.27 0.00 0.00 0.00 0.00 51.96 50.30 1b73 s ALA 136 Cb -0.19 -1.51 0.12 0.00 0.00 0.00 0.00 23.12 21.54 1b73 s ALA 136 CO -0.10 0.03 0.99 0.21 0.00 0.00 0.00 175.76 176.89 1b73 s LYS 137 N -4.07 0.58 0.35 0.00 2.47 -0.50 -4.90 119.74 113.67 1b73 s LYS 137 Ca 0.42 0.42 -0.10 0.00 -1.56 0.00 0.00 55.97 55.15 1b73 s LYS 137 Cb -0.08 0.28 -0.07 0.00 -1.46 0.00 0.00 37.83 36.50 1b73 s LYS 137 CO 0.29 -0.12 0.70 0.00 0.16 0.00 0.00 175.35 176.37 1b73 s ALA 138 N -0.35 3.42 0.30 3.13 0.00 -1.26 -2.55 121.76 124.45 1b73 s ALA 138 Ca 0.00 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.43 1b73 s ALA 138 Cb -0.03 -2.60 -0.10 0.00 0.00 0.00 0.00 23.12 20.38 1b73 s ALA 138 CO -0.02 0.15 1.39 0.00 0.00 0.00 0.00 175.76 177.28 1b73 s PRO 140 N -1.12 4.27 -0.93 0.00 0.04 -1.26 -4.60 135.00 131.40 1b73 s PRO 140 Ca 0.54 0.88 -0.20 0.00 0.04 0.00 0.00 61.00 62.27 1b73 s PRO 140 Cb -0.42 -3.58 0.11 0.00 0.04 0.00 0.00 34.50 30.66 1b73 s PRO 140 CO 0.49 -0.30 1.18 -0.51 0.04 0.00 0.00 177.00 177.91 1b73 s LEU 141 N 2.07 4.65 -0.25 -3.56 2.01 -1.26 -4.86 118.68 117.48 1b73 s LEU 141 Ca 0.35 -1.81 -0.03 0.00 0.01 0.00 0.00 54.13 52.65 1b73 s LEU 141 Cb -0.16 -2.44 -0.17 0.00 0.01 0.00 0.00 46.19 43.43 1b73 s LEU 141 CO 0.12 -1.20 -0.17 0.49 1.01 0.00 0.00 176.35 176.60 1b73 n PHE 142 N 7.17 0.18 -0.36 0.29 3.72 -1.26 -4.66 117.46 122.55 1b73 n PHE 142 Ca 0.23 0.05 0.26 0.00 -0.05 0.00 0.00 57.45 57.94 1b73 n PHE 142 Cb 0.49 -1.02 0.53 0.00 -0.94 0.00 0.00 39.48 38.54 1b73 n PHE 142 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1b73 h ALA 143 N -0.21 2.26 0.58 4.37 0.00 -1.89 -2.48 119.26 121.89 1b73 h ALA 143 Ca -0.58 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1b73 h ALA 143 Cb 1.84 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 1b73 h ALA 143 CO -0.14 -0.78 -0.42 -1.35 0.00 0.00 0.00 179.25 176.56 1b73 h PRO 144 N 0.32 -0.92 0.88 0.00 0.11 -2.01 -3.34 132.00 127.03 1b73 h PRO 144 Ca 0.69 0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.82 1b73 h PRO 144 Cb 1.79 0.21 0.01 0.00 0.11 0.00 0.00 31.00 33.12 1b73 h PRO 144 CO -0.41 -0.61 -0.42 -0.07 -0.21 0.00 0.00 178.00 176.28 1b73 h LEU 145 N -0.95 -1.00 -8.58 2.35 3.38 -1.78 -3.45 115.31 105.28 1b73 h LEU 145 Ca -0.08 0.03 -0.52 0.00 0.09 0.00 0.00 57.88 57.41 1b73 h LEU 145 Cb 0.78 0.26 -0.22 0.00 0.09 0.00 0.00 40.66 41.57 1b73 h LEU 145 CO 0.04 -0.67 -0.81 0.00 0.09 0.00 0.00 178.44 177.09 1b73 s ALA 146 N -5.53 1.62 0.22 1.53 0.00 -0.97 -5.12 121.76 113.51 1b73 s ALA 146 Ca -0.17 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 50.34 1b73 s ALA 146 Cb 0.02 -0.21 -0.09 0.00 0.00 0.00 0.00 23.12 22.84 1b73 s ALA 146 CO 0.52 0.31 1.20 -1.21 0.00 0.00 0.00 175.76 176.58 1b73 s GLU 147 N -1.77 4.50 0.53 0.00 2.02 -1.26 -3.61 118.70 119.11 1b73 s GLU 147 Ca 0.04 1.92 0.31 0.00 0.02 0.00 0.00 54.97 57.26 1b73 s GLU 147 Cb -0.10 -3.21 1.47 0.00 0.10 0.00 0.00 34.13 32.39 1b73 s GLU 147 CO 0.03 -0.06 1.89 0.93 0.02 0.00 0.00 175.26 178.08 1b73 h GLU 148 N 4.76 0.01 0.00 1.61 4.39 -1.90 0.22 114.58 123.67 1b73 h GLU 148 Ca -0.45 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1b73 h GLU 148 Cb 1.21 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.86 1b73 h GLU 148 CO 0.72 0.01 0.05 0.78 -1.16 0.00 0.00 179.01 179.41 1b73 h GLY 149 N 0.01 0.00 1.07 -3.84 0.00 -1.99 0.79 103.07 99.11 1b73 h GLY 149 Ca 0.42 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.53 1b73 h GLY 149 CO -0.01 0.00 -0.80 -2.00 0.00 0.00 0.00 176.54 173.72 1b73 h LEU 150 N 0.00 0.81 -1.17 3.11 5.85 -0.93 -3.24 115.31 119.74 1b73 h LEU 150 Ca 0.00 -0.70 0.00 0.00 0.84 0.00 0.00 57.88 58.02 1b73 h LEU 150 Cb 0.09 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.88 1b73 h LEU 150 CO 0.00 1.39 0.00 0.18 -0.34 0.00 0.00 178.44 179.67 1b73 n LEU 151 N -4.01 1.15 -4.86 2.25 7.99 0.27 -4.84 117.00 114.95 1b73 n LEU 151 Ca -0.09 -0.57 -0.36 0.00 -0.01 0.00 0.00 56.01 54.97 1b73 n LEU 151 Cb 0.76 -0.43 -0.06 0.00 -0.11 0.00 0.00 43.42 43.59 1b73 n LEU 151 CO 0.52 0.25 -0.01 -0.70 -1.51 0.00 0.00 177.39 175.94 1b73 s GLU 152 N -0.81 3.69 0.41 3.23 2.12 -1.19 -3.38 118.70 122.77 1b73 s GLU 152 Ca 0.00 0.12 0.00 0.00 0.36 0.00 0.00 54.97 55.45 1b73 s GLU 152 Cb 0.00 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.24 1b73 s GLU 152 CO 0.00 0.69 0.00 0.41 -0.54 0.00 0.00 175.26 175.82 1b73 n GLY 153 N 1.56 -1.90 0.00 -1.50 0.00 -1.26 -4.34 105.19 97.76 1b73 n GLY 153 Ca -0.14 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1b73 n GLY 153 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b73 n GLU 154 N -3.43 0.00 0.22 1.61 -0.58 -1.26 0.58 120.64 117.78 1b73 n GLU 154 Ca 0.01 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.82 1b73 n GLU 154 Cb 0.48 0.00 0.50 0.00 -0.57 0.00 0.00 31.44 31.85 1b73 n GLU 154 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1b73 h ILE 155 N 0.00 0.94 -0.04 -3.67 2.10 -1.87 -3.13 117.51 111.84 1b73 h ILE 155 Ca 0.00 -0.98 -0.17 0.00 1.08 0.00 0.00 64.86 64.79 1b73 h ILE 155 Cb 0.00 1.57 0.01 0.00 -1.09 0.00 0.00 36.82 37.31 1b73 h ILE 155 CO 0.00 0.26 -0.64 0.00 -1.08 0.00 0.00 178.15 176.69 1b73 h THR 156 N 0.00 1.38 0.00 2.19 1.03 0.13 -2.31 112.91 115.32 1b73 h THR 156 Ca -0.00 -2.01 0.00 0.00 -0.01 0.00 0.00 66.41 64.39 1b73 h THR 156 Cb 0.55 2.40 0.00 0.00 -1.07 0.00 0.00 68.15 70.03 1b73 h THR 156 CO 0.03 0.60 0.00 0.54 -0.01 0.00 0.00 175.52 176.68 1b73 n ARG 157 N -4.16 0.62 -0.00 0.00 5.12 -1.20 -2.00 116.66 115.04 1b73 n ARG 157 Ca -0.10 0.00 0.03 0.00 -1.93 0.00 0.00 57.85 55.86 1b73 n ARG 157 Cb 0.68 -1.43 -0.05 0.00 -1.16 0.00 0.00 32.46 30.51 1b73 n ARG 157 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1b73 n LYS 158 N -0.93 1.71 0.09 5.56 5.02 -1.15 -4.14 118.16 124.32 1b73 n LYS 158 Ca 0.13 -0.04 -0.08 0.00 -2.02 0.00 0.00 58.31 56.29 1b73 n LYS 158 Cb 0.06 -1.04 -0.05 0.00 -0.02 0.00 0.00 35.03 33.97 1b73 n LYS 158 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1b73 h VAL 159 N 0.00 0.38 0.00 -0.18 2.07 -0.82 -3.24 116.25 114.46 1b73 h VAL 159 Ca 0.00 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1b73 h VAL 159 Cb 0.26 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1b73 h VAL 159 CO 0.00 0.10 0.00 0.52 0.02 0.00 0.00 177.57 178.21 1b73 n VAL 160 N -4.99 0.00 -0.50 2.57 0.31 -1.03 -1.03 118.33 113.66 1b73 n VAL 160 Ca -0.06 1.22 0.42 0.00 -0.01 0.00 0.00 64.34 65.90 1b73 n VAL 160 Cb 0.21 -1.74 0.73 0.00 -0.91 0.00 0.00 33.84 32.13 1b73 n VAL 160 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1b73 h GLU 161 N 0.00 0.05 0.01 5.55 5.08 -1.74 0.82 114.58 124.35 1b73 h GLU 161 Ca 0.00 -0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.14 1b73 h GLU 161 Cb 0.00 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 1b73 h GLU 161 CO 0.00 0.03 -1.02 1.25 -1.00 0.00 0.00 179.01 178.27 1b73 h HIS 162 N 0.05 0.02 0.00 4.33 2.76 -1.10 -2.76 115.15 118.45 1b73 h HIS 162 Ca 0.77 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.89 1b73 h HIS 162 Cb 2.86 -0.00 -0.01 0.00 1.55 0.00 0.00 27.41 31.81 1b73 h HIS 162 CO -0.00 1.01 -0.21 1.88 -1.30 0.00 0.00 177.93 179.31 1b73 h TYR 163 N 0.00 0.00 -0.50 5.26 -1.99 0.13 -3.31 116.97 116.57 1b73 h TYR 163 Ca -0.02 0.00 -0.32 0.00 2.00 0.00 0.00 58.73 60.39 1b73 h TYR 163 Cb 1.78 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 40.38 1b73 h TYR 163 CO 0.00 0.89 0.37 1.28 -0.00 0.00 0.00 178.16 180.70 1b73 n LEU 164 N -4.61 6.38 0.00 3.88 4.77 0.13 -4.51 117.00 123.03 1b73 n LEU 164 Ca -0.12 -3.33 0.00 0.00 -0.03 0.00 0.00 56.01 52.53 1b73 n LEU 164 Cb 0.43 -1.09 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1b73 n LEU 164 CO 0.26 1.28 0.21 1.17 -1.33 0.00 0.00 177.39 178.97 1b73 n LYS 165 N 0.53 0.00 -0.27 3.23 4.81 -1.04 -2.48 118.16 122.94 1b73 n LYS 165 Ca 0.31 0.41 0.08 0.00 -0.87 0.00 0.00 58.31 58.24 1b73 n LYS 165 Cb 0.58 -1.14 0.21 0.00 0.02 0.00 0.00 35.03 34.70 1b73 n LYS 165 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1b73 h GLU 166 N 0.00 0.21 -0.65 1.64 4.11 -1.87 0.51 114.58 118.53 1b73 h GLU 166 Ca 0.00 -0.01 0.14 0.00 0.07 0.00 0.00 59.36 59.56 1b73 h GLU 166 Cb 0.00 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 1b73 h GLU 166 CO 0.00 0.14 0.44 0.74 0.07 0.00 0.00 179.01 180.40 1b73 h PHE 167 N 0.22 0.30 0.00 2.06 -1.00 -1.87 -3.40 116.94 113.24 1b73 h PHE 167 Ca 0.46 0.01 0.00 0.00 2.81 0.00 0.00 57.97 61.25 1b73 h PHE 167 Cb 0.83 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.30 1b73 h PHE 167 CO -0.30 0.12 0.00 1.17 -1.61 0.00 0.00 178.31 177.69 1b73 n LYS 168 N -4.44 0.00 -0.72 1.51 3.00 0.18 -1.35 118.16 116.34 1b73 n LYS 168 Ca 0.12 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.44 1b73 n LYS 168 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.57 1b73 n LYS 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1b73 n GLY 169 N 0.00 0.63 0.08 3.14 0.00 -1.26 -4.73 105.19 103.04 1b73 n GLY 169 Ca 0.00 -0.19 0.03 0.00 0.00 0.00 0.00 46.02 45.87 1b73 n GLY 169 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b73 n LYS 170 N 0.11 0.64 -3.85 1.61 5.02 -0.45 -4.98 118.16 116.25 1b73 n LYS 170 Ca 0.01 0.05 -0.21 0.00 -2.02 0.00 0.00 58.31 56.14 1b73 n LYS 170 Cb 0.79 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 34.08 1b73 n LYS 170 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1b73 s ILE 171 N -3.09 4.05 0.00 -0.18 -4.36 -1.21 -4.71 121.20 111.70 1b73 s ILE 171 Ca -0.05 -1.28 0.00 0.00 -0.26 0.00 0.00 60.65 59.06 1b73 s ILE 171 Cb 0.10 -3.35 0.00 0.00 1.25 0.00 0.00 42.46 40.46 1b73 s ILE 171 CO 0.84 -0.24 0.01 -0.90 0.24 0.00 0.00 174.94 174.89 1b73 n ASP 172 N -1.37 0.02 -3.86 4.36 5.68 -1.03 -5.03 116.55 115.32 1b73 n ASP 172 Ca -0.04 -0.57 -0.12 0.00 -0.50 0.00 0.00 54.79 53.57 1b73 n ASP 172 Cb 0.59 0.02 -0.11 0.00 -1.14 0.00 0.00 41.12 40.47 1b73 n ASP 172 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1b73 s THR 173 N -0.02 0.04 -0.06 2.12 2.01 -1.26 -3.16 115.64 115.31 1b73 s THR 173 Ca 0.00 -0.34 -0.04 0.00 0.31 0.00 0.00 61.69 61.63 1b73 s THR 173 Cb 0.00 -0.29 0.03 0.00 0.01 0.00 0.00 72.50 72.25 1b73 s THR 173 CO 0.00 -0.18 0.14 -0.22 -0.69 0.00 0.00 174.62 173.67 1b73 s LEU 174 N -0.60 1.06 -0.38 4.42 2.96 -0.33 -1.71 118.68 124.11 1b73 s LEU 174 Ca -0.07 0.30 -0.14 0.00 -0.22 0.00 0.00 54.13 53.99 1b73 s LEU 174 Cb -0.04 0.42 0.00 0.00 0.50 0.00 0.00 46.19 47.07 1b73 s LEU 174 CO 0.01 -0.10 0.30 -0.63 -1.32 0.00 0.00 176.35 174.61 1b73 s ILE 175 N 0.67 5.24 -1.17 6.68 1.01 0.15 0.10 121.20 133.87 1b73 s ILE 175 Ca -0.05 -0.36 -0.20 0.00 0.00 0.00 0.00 60.65 60.04 1b73 s ILE 175 Cb -0.07 -3.85 0.05 0.00 0.01 0.00 0.00 42.46 38.61 1b73 s ILE 175 CO -0.03 -0.18 1.64 -0.22 0.00 0.00 0.00 174.94 176.15 1b73 s LEU 176 N 1.80 3.65 0.02 2.97 2.96 -1.26 -2.66 118.68 126.15 1b73 s LEU 176 Ca 0.07 -1.96 -0.05 0.00 -0.22 0.00 0.00 54.13 51.97 1b73 s LEU 176 Cb -0.18 -2.58 -0.02 0.00 0.50 0.00 0.00 46.19 43.92 1b73 s LEU 176 CO 0.11 -1.45 1.08 1.23 -1.32 0.00 0.00 176.35 176.00 1b73 h GLY 177 N 13.09 -1.37 -6.13 7.98 0.00 0.12 -3.43 103.07 113.34 1b73 h GLY 177 Ca 0.33 0.62 -0.12 0.00 0.00 0.00 0.00 47.33 48.15 1b73 h GLY 177 CO 1.43 -0.49 -0.42 0.00 0.00 0.00 0.00 176.54 177.06 1b73 s THR 179 N 2.57 4.76 0.07 0.00 -1.32 -1.26 -4.63 115.64 115.83 1b73 s THR 179 Ca 0.03 0.89 0.08 0.00 -1.21 0.00 0.00 61.69 61.48 1b73 s THR 179 Cb -0.13 -4.18 -0.03 0.00 -1.51 0.00 0.00 72.50 66.65 1b73 s THR 179 CO -0.13 -0.39 -0.22 -1.00 -2.21 0.00 0.00 174.62 170.67 1b73 s HIS 180 N 3.02 1.94 0.34 9.09 3.76 -1.26 -4.93 115.29 127.26 1b73 s HIS 180 Ca 0.31 -0.39 -0.29 0.00 -0.15 0.00 0.00 55.06 54.53 1b73 s HIS 180 Cb -0.13 -1.12 -0.11 0.00 1.11 0.00 0.00 32.58 32.32 1b73 s HIS 180 CO 0.16 0.16 1.55 -0.47 -0.85 0.00 0.00 174.74 175.28 1b73 s TYR 181 N -0.92 2.63 -2.07 1.40 5.04 -1.26 0.08 117.35 122.25 1b73 s TYR 181 Ca 0.09 0.98 0.13 0.00 -2.44 0.00 0.00 57.07 55.82 1b73 s TYR 181 Cb -0.09 -4.07 0.55 0.00 0.35 0.00 0.00 41.96 38.70 1b73 s TYR 181 CO 0.03 -3.34 1.38 -0.35 -1.34 0.00 0.00 175.55 171.93 1b73 n PRO 182 N 1.20 1.37 -1.18 4.97 -0.04 -1.26 -4.72 135.00 135.34 1b73 n PRO 182 Ca 0.04 -0.57 -0.19 0.00 -0.04 0.00 0.00 63.50 62.75 1b73 n PRO 182 Cb 0.38 -1.24 -0.12 0.00 -0.04 0.00 0.00 33.50 32.48 1b73 n PRO 182 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1b73 n LEU 183 N -0.13 5.99 -4.66 1.53 4.77 0.11 -4.71 117.00 119.90 1b73 n LEU 183 Ca 0.10 -3.57 -0.29 0.00 -0.03 0.00 0.00 56.01 52.23 1b73 n LEU 183 Cb 0.17 -1.39 0.19 0.00 -2.33 0.00 0.00 43.42 40.05 1b73 n LEU 183 CO 0.08 1.76 0.63 -0.76 -1.33 0.00 0.00 177.39 177.77 1b73 s LEU 184 N -0.55 1.48 0.15 2.23 1.43 -1.26 -4.09 118.68 118.07 1b73 s LEU 184 Ca 0.65 1.19 -0.16 0.00 -1.03 0.00 0.00 54.13 54.78 1b73 s LEU 184 Cb 0.31 -3.33 0.03 0.00 0.03 0.00 0.00 46.19 43.23 1b73 s LEU 184 CO -0.06 -3.27 1.79 0.50 0.23 0.00 0.00 176.35 175.55 1b73 h LYS 185 N -1.99 0.43 0.00 1.70 3.64 -1.96 -2.77 116.57 115.63 1b73 h LYS 185 Ca -0.55 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1b73 h LYS 185 Cb 1.33 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 1b73 h LYS 185 CO 0.57 0.29 0.00 1.63 -2.27 0.00 0.00 179.45 179.67 1b73 n LYS 186 N -4.88 0.30 -0.01 1.90 4.76 -1.26 -1.01 118.16 117.97 1b73 n LYS 186 Ca 0.01 0.03 -0.12 0.00 -2.87 0.00 0.00 58.31 55.35 1b73 n LYS 186 Cb 0.06 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 31.61 1b73 n LYS 186 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1b73 h GLU 187 N 0.00 0.09 0.04 1.97 4.39 -1.79 -3.34 114.58 115.94 1b73 h GLU 187 Ca 0.00 -0.15 -0.07 0.00 0.34 0.00 0.00 59.36 59.49 1b73 h GLU 187 Cb 0.31 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1b73 h GLU 187 CO 0.00 0.74 -0.31 -0.84 -1.16 0.00 0.00 179.01 177.43 1b73 h ILE 188 N 0.02 1.66 0.00 3.13 3.07 -1.37 -2.96 117.51 121.07 1b73 h ILE 188 Ca -0.31 -2.39 0.00 0.00 1.55 0.00 0.00 64.86 63.71 1b73 h ILE 188 Cb 2.01 3.27 0.00 0.00 -0.27 0.00 0.00 36.82 41.84 1b73 h ILE 188 CO 0.09 0.63 0.00 1.17 -1.05 0.00 0.00 178.15 178.98 1b73 n LYS 189 N -4.46 0.29 -0.08 0.16 4.81 -0.18 -0.74 118.16 117.96 1b73 n LYS 189 Ca -0.13 0.00 -0.18 0.00 -0.87 0.00 0.00 58.31 57.14 1b73 n LYS 189 Cb 0.59 -1.22 -0.06 0.00 0.02 0.00 0.00 35.03 34.36 1b73 n LYS 189 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1b73 n LYS 190 N -0.72 0.36 0.36 1.64 4.01 -1.24 -3.76 118.16 118.81 1b73 n LYS 190 Ca 0.03 0.15 -0.18 0.00 -0.51 0.00 0.00 58.31 57.80 1b73 n LYS 190 Cb 0.01 -1.11 -0.09 0.00 -0.51 0.00 0.00 35.03 33.34 1b73 n LYS 190 CO 0.00 0.00 0.00 0.35 -1.11 0.00 0.00 177.40 176.64 1b73 h PHE 191 N -0.57 -0.95 0.00 2.13 3.57 -1.04 -2.86 116.94 117.22 1b73 h PHE 191 Ca -0.42 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1b73 h PHE 191 Cb 1.38 0.33 0.00 0.00 2.79 0.00 0.00 35.95 40.45 1b73 h PHE 191 CO -0.05 -0.56 0.00 -0.07 -2.23 0.00 0.00 178.31 175.40 1b73 h LEU 192 N -0.94 0.00 0.00 0.59 3.38 -1.21 -3.50 115.31 113.63 1b73 h LEU 192 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1b73 h LEU 192 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1b73 h LEU 192 CO 0.11 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.25 1b73 n GLY 193 N -0.15 -2.13 3.51 0.83 0.00 -1.08 -4.73 105.19 101.45 1b73 n GLY 193 Ca 0.00 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 1b73 n GLY 193 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1b73 n ASP 194 N -2.08 0.31 -4.70 1.61 4.64 -1.25 -4.63 116.55 110.45 1b73 n ASP 194 Ca 0.00 -0.27 -0.24 0.00 -1.38 0.00 0.00 54.79 52.90 1b73 n ASP 194 Cb 0.00 -1.00 -0.07 0.00 -1.04 0.00 0.00 41.12 39.01 1b73 n ASP 194 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1b73 s ALA 195 N 7.76 3.43 -0.54 -1.67 0.00 -1.26 -5.08 121.76 124.41 1b73 s ALA 195 Ca 1.25 -1.96 -0.20 0.00 0.00 0.00 0.00 51.96 51.05 1b73 s ALA 195 Cb -0.87 -0.51 0.06 0.00 0.00 0.00 0.00 23.12 21.80 1b73 s ALA 195 CO 0.44 -0.02 0.72 -2.00 0.00 0.00 0.00 175.76 174.90 1b73 s GLU 196 N -3.82 3.14 -0.12 0.00 2.56 -1.19 -4.99 118.70 114.28 1b73 s GLU 196 Ca 0.38 -0.85 -0.24 0.00 0.00 0.00 0.00 54.97 54.26 1b73 s GLU 196 Cb 0.00 -4.13 -0.03 0.00 2.00 0.00 0.00 34.13 31.98 1b73 s GLU 196 CO 0.22 -1.37 0.75 0.08 -0.56 0.00 0.00 175.26 174.38 1b73 s VAL 197 N 2.98 4.97 0.22 3.70 1.01 -1.26 -1.19 120.40 130.84 1b73 s VAL 197 Ca 0.18 1.50 -0.30 0.00 0.00 0.00 0.00 61.98 63.36 1b73 s VAL 197 Cb -0.19 -4.07 -0.09 0.00 0.00 0.00 0.00 36.38 32.03 1b73 s VAL 197 CO 0.12 0.14 1.18 -0.69 0.00 0.00 0.00 175.10 175.85 1b73 s VAL 198 N 1.50 3.47 -0.74 2.92 1.01 0.11 -4.94 120.40 123.73 1b73 s VAL 198 Ca 0.37 1.32 -0.17 0.00 0.00 0.00 0.00 61.98 63.50 1b73 s VAL 198 Cb -0.17 -3.84 0.15 0.00 0.00 0.00 0.00 36.38 32.52 1b73 s VAL 198 CO 0.15 0.25 0.81 -0.62 0.00 0.00 0.00 175.10 175.69 1b73 s ASP 199 N -0.20 6.48 0.59 3.32 2.15 -1.26 -4.37 116.67 123.38 1b73 s ASP 199 Ca 0.50 -2.03 0.34 0.00 0.43 0.00 0.00 52.55 51.79 1b73 s ASP 199 Cb -0.33 -2.29 1.86 0.00 -0.30 0.00 0.00 42.92 41.87 1b73 s ASP 199 CO 0.39 -0.90 2.22 0.28 -0.17 0.00 0.00 175.17 176.99 1b73 h SER 200 N 8.61 0.00 0.13 -0.34 0.02 -1.92 -0.48 113.55 119.56 1b73 h SER 200 Ca -0.06 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.63 1b73 h SER 200 Cb 1.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1b73 h SER 200 CO 0.98 0.03 -1.31 -1.28 -1.14 0.00 0.00 176.83 174.11 1b73 h SER 201 N 0.00 0.42 0.09 3.07 0.87 -1.94 -2.78 113.55 113.28 1b73 h SER 201 Ca -0.00 -0.88 -0.14 0.00 -1.23 0.00 0.00 61.79 59.54 1b73 h SER 201 Cb 0.13 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1b73 h SER 201 CO 0.00 1.59 -0.47 -0.08 -0.53 0.00 0.00 176.83 177.34 1b73 h GLU 202 N -0.28 0.45 -0.00 2.24 4.57 -1.90 -2.42 114.58 117.24 1b73 h GLU 202 Ca -0.27 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 57.65 1b73 h GLU 202 Cb 1.77 0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 30.37 1b73 h GLU 202 CO 0.09 0.83 0.00 0.00 -1.18 0.00 0.00 179.01 178.75 1b73 h ALA 203 N 1.13 0.00 0.60 2.92 0.00 -1.24 -2.58 119.26 120.10 1b73 h ALA 203 Ca 0.02 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1b73 h ALA 203 Cb 0.97 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 1b73 h ALA 203 CO 0.08 -0.42 -0.38 1.25 0.00 0.00 0.00 179.25 179.79 1b73 h LEU 204 N -0.15 -0.96 -0.89 0.00 5.85 -1.48 -2.38 115.31 115.30 1b73 h LEU 204 Ca 0.00 0.05 0.13 0.00 0.84 0.00 0.00 57.88 58.91 1b73 h LEU 204 Cb 0.16 0.28 -0.14 0.00 0.37 0.00 0.00 40.66 41.33 1b73 h LEU 204 CO -0.00 -0.58 -0.40 -1.28 -0.34 0.00 0.00 178.44 175.84 1b73 h SER 205 N -0.92 -1.45 -0.58 1.25 0.87 -1.48 0.19 113.55 111.43 1b73 h SER 205 Ca -0.08 0.29 0.09 0.00 -1.23 0.00 0.00 61.79 60.87 1b73 h SER 205 Cb 0.74 0.74 -0.07 0.00 -0.44 0.00 0.00 62.40 63.36 1b73 h SER 205 CO 0.07 -0.29 0.18 0.25 -0.53 0.00 0.00 176.83 176.52 1b73 h LEU 206 N -0.05 0.14 -0.78 2.23 6.46 -1.47 -2.66 115.31 119.18 1b73 h LEU 206 Ca 0.30 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 58.14 1b73 h LEU 206 Cb 0.57 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.59 1b73 h LEU 206 CO -0.91 0.09 0.14 -1.54 -0.62 0.00 0.00 178.44 175.60 1b73 n SER 207 N -5.04 0.31 -0.74 1.25 3.41 0.67 -1.62 113.62 111.85 1b73 n SER 207 Ca 0.08 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.39 1b73 n SER 207 Cb 0.27 -0.58 0.17 0.00 -0.26 0.00 0.00 64.21 63.81 1b73 n SER 207 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1b73 n LEU 208 N -1.91 2.43 -0.29 1.04 4.77 -1.00 -4.66 117.00 117.38 1b73 n LEU 208 Ca -0.01 -0.82 0.11 0.00 -0.03 0.00 0.00 56.01 55.26 1b73 n LEU 208 Cb 0.16 -0.01 0.27 0.00 -2.33 0.00 0.00 43.42 41.51 1b73 n LEU 208 CO 0.05 0.42 1.01 -0.74 -1.33 0.00 0.00 177.39 176.80 1b73 h HIS 209 N 3.65 0.53 0.00 -1.77 2.76 -1.47 -2.02 115.15 116.83 1b73 h HIS 209 Ca 0.00 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1b73 h HIS 209 Cb 0.84 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.70 1b73 h HIS 209 CO 0.00 -0.06 0.00 -0.91 -1.30 0.00 0.00 177.93 175.66 1b73 h ASN 210 N 0.36 0.00 0.28 3.26 2.35 -1.86 -3.22 115.58 116.76 1b73 h ASN 210 Ca 0.52 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 56.11 1b73 h ASN 210 Cb 0.96 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.30 1b73 h ASN 210 CO -0.53 0.00 -1.87 0.49 -1.65 0.00 0.00 177.43 173.87 1b73 n PHE 211 N -2.40 0.37 -3.11 1.19 3.72 -0.83 -4.91 117.46 111.48 1b73 n PHE 211 Ca 0.05 0.12 -0.40 0.00 -0.05 0.00 0.00 57.45 57.17 1b73 n PHE 211 Cb 0.41 -0.85 -0.05 0.00 -0.94 0.00 0.00 39.48 38.04 1b73 n PHE 211 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1b73 s ILE 212 N -3.03 5.05 -0.45 4.37 1.01 -0.82 -5.04 121.20 122.29 1b73 s ILE 212 Ca -0.07 1.26 -0.17 0.00 0.00 0.00 0.00 60.65 61.67 1b73 s ILE 212 Cb 0.10 -3.97 0.04 0.00 0.01 0.00 0.00 42.46 38.64 1b73 s ILE 212 CO 0.85 0.18 0.44 -0.75 0.00 0.00 0.00 174.94 175.66 1b73 s LYS 213 N 1.38 3.06 -0.95 2.79 2.20 -1.26 -4.93 119.74 122.03 1b73 s LYS 213 Ca 0.32 -0.95 -0.26 0.00 -0.36 0.00 0.00 55.97 54.71 1b73 s LYS 213 Cb -0.16 -4.03 -0.20 0.00 -1.51 0.00 0.00 37.83 31.93 1b73 s LYS 213 CO 0.13 -0.94 2.24 -3.47 -0.36 0.00 0.00 175.35 172.95 1b73 n ASP 214 N 5.55 1.49 -3.64 1.43 -0.08 -1.26 -4.63 116.55 115.42 1b73 n ASP 214 Ca -0.09 -2.04 -0.15 0.00 -1.51 0.00 0.00 54.79 51.00 1b73 n ASP 214 Cb 0.46 -1.69 -0.08 0.00 2.34 0.00 0.00 41.12 42.15 1b73 n ASP 214 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1b73 s ASP 215 N 9.49 -0.51 0.00 1.67 2.15 -1.26 -4.80 116.67 123.41 1b73 s ASP 215 Ca 0.86 0.68 0.00 0.00 0.43 0.00 0.00 52.55 54.53 1b73 s ASP 215 Cb -0.09 0.68 0.00 0.00 -0.30 0.00 0.00 42.92 43.21 1b73 s ASP 215 CO 0.14 -0.43 0.00 0.61 -0.17 0.00 0.00 175.17 175.32 1b73 n GLY 216 N 1.61 2.36 0.00 2.66 0.00 -1.06 -3.01 105.19 107.75 1b73 n GLY 216 Ca -0.18 -1.65 0.09 0.00 0.00 0.00 0.00 46.02 44.27 1b73 n GLY 216 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1b73 n SER 217 N 0.00 0.00 -0.64 1.61 7.64 -1.24 -4.61 113.62 116.39 1b73 n SER 217 Ca 0.00 -0.63 -0.08 0.00 1.01 0.00 0.00 58.87 59.17 1b73 n SER 217 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 1b73 n SER 217 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1b73 n SER 218 N -0.96 -4.92 -4.64 6.43 2.88 -0.78 -5.00 113.62 106.62 1b73 n SER 218 Ca 0.13 0.21 -0.29 0.00 -1.33 0.00 0.00 58.87 57.59 1b73 n SER 218 Cb 0.06 -3.15 0.19 0.00 -0.75 0.00 0.00 64.21 60.55 1b73 n SER 218 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1b73 s SER 219 N -2.48 2.40 -0.19 -3.46 1.04 -1.26 -4.88 113.70 104.88 1b73 s SER 219 Ca 0.00 1.42 -0.08 0.00 0.48 0.00 0.00 55.95 57.78 1b73 s SER 219 Cb 0.00 -2.11 0.08 0.00 0.10 0.00 0.00 66.02 64.09 1b73 s SER 219 CO 0.00 -3.30 0.41 -0.22 0.98 0.00 0.00 173.24 171.11 1b73 s LEU 220 N -6.62 -0.46 -0.07 2.42 2.96 -1.26 -1.96 118.68 113.70 1b73 s LEU 220 Ca 0.66 0.95 0.02 0.00 -0.22 0.00 0.00 54.13 55.54 1b73 s LEU 220 Cb -0.20 1.33 0.01 0.00 0.50 0.00 0.00 46.19 47.83 1b73 s LEU 220 CO 0.59 -0.22 -0.14 -1.61 -1.32 0.00 0.00 176.35 173.66 1b73 s GLU 221 N 2.21 1.88 -0.17 1.98 2.02 -0.42 -5.00 118.70 121.20 1b73 s GLU 221 Ca -0.04 -0.47 -0.02 0.00 0.02 0.00 0.00 54.97 54.45 1b73 s GLU 221 Cb -0.11 -1.53 -0.01 0.00 0.10 0.00 0.00 34.13 32.58 1b73 s GLU 221 CO -0.13 0.04 -0.09 -0.51 0.02 0.00 0.00 175.26 174.60 1b73 s LEU 222 N 0.63 2.83 0.10 1.80 1.02 -1.26 -0.32 118.68 123.47 1b73 s LEU 222 Ca -0.15 -0.34 0.07 0.00 0.02 0.00 0.00 54.13 53.73 1b73 s LEU 222 Cb -0.16 -1.68 -0.03 0.00 0.02 0.00 0.00 46.19 44.34 1b73 s LEU 222 CO 0.04 0.09 -0.18 -0.36 0.02 0.00 0.00 176.35 175.96 1b73 s PHE 223 N 0.84 1.58 -0.10 0.29 0.40 -0.79 -1.98 117.98 118.22 1b73 s PHE 223 Ca -0.03 -0.45 -0.22 0.00 -0.60 0.00 0.00 56.93 55.63 1b73 s PHE 223 Cb -0.15 -0.86 0.05 0.00 0.51 0.00 0.00 43.02 42.57 1b73 s PHE 223 CO 0.01 0.17 0.53 -0.06 0.70 0.00 0.00 175.22 176.56 1b73 s PHE 224 N -1.39 -0.51 -1.67 0.36 0.40 -1.20 -1.10 117.98 112.87 1b73 s PHE 224 Ca 0.05 1.02 0.09 0.00 -0.60 0.00 0.00 56.93 57.49 1b73 s PHE 224 Cb -0.09 0.24 0.30 0.00 0.51 0.00 0.00 43.02 43.98 1b73 s PHE 224 CO 0.04 -0.43 1.18 0.25 0.70 0.00 0.00 175.22 176.96 1b73 n THR 225 N 1.74 0.61 -3.28 0.64 -2.24 -1.04 -0.60 114.28 110.11 1b73 n THR 225 Ca -0.18 -0.46 0.03 0.00 -2.27 0.00 0.00 64.05 61.17 1b73 n THR 225 Cb 0.56 0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.82 1b73 n THR 225 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1b73 s ASP 226 N -0.83 -0.77 -0.59 3.42 2.15 -1.26 -4.15 116.67 114.64 1b73 s ASP 226 Ca 0.22 0.72 -0.06 0.00 0.43 0.00 0.00 52.55 53.86 1b73 s ASP 226 Cb 0.13 1.74 -0.12 0.00 -0.30 0.00 0.00 42.92 44.37 1b73 s ASP 226 CO 0.12 -0.15 2.48 0.18 -0.17 0.00 0.00 175.17 177.64 1b73 n LEU 227 N 5.29 4.85 -4.10 -1.34 7.99 -1.26 -4.64 117.00 123.79 1b73 n LEU 227 Ca -0.07 -2.84 -0.36 0.00 -0.01 0.00 0.00 56.01 52.73 1b73 n LEU 227 Cb 0.52 -1.10 0.07 0.00 -0.11 0.00 0.00 43.42 42.80 1b73 n LEU 227 CO -0.05 1.01 -1.43 -1.20 -1.51 0.00 0.00 177.39 174.21 1b73 n SER 228 N 3.38 -3.48 0.00 -1.43 7.64 -1.26 -4.93 113.62 113.54 1b73 n SER 228 Ca 0.42 0.05 0.00 0.00 1.01 0.00 0.00 58.87 60.35 1b73 n SER 228 Cb 0.38 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 1b73 n SER 228 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1b73 n PRO 229 N 1.12 0.00 0.00 1.43 -0.04 -1.26 -3.67 135.00 132.58 1b73 n PRO 229 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1b73 n PRO 229 Cb 0.66 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.12 1b73 n PRO 229 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1b73 n ASN 230 N 0.00 0.82 -0.04 3.54 3.02 -1.26 -4.34 115.26 117.00 1b73 n ASN 230 Ca 0.00 -1.85 -0.03 0.00 -0.03 0.00 0.00 54.58 52.67 1b73 n ASN 230 Cb 0.00 -0.41 -0.02 0.00 -0.61 0.00 0.00 39.78 38.73 1b73 n ASN 230 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1b73 h LEU 231 N 0.07 -0.47 -1.18 3.41 5.85 -1.92 -0.98 115.31 120.08 1b73 h LEU 231 Ca 0.00 0.06 0.35 0.00 0.84 0.00 0.00 57.88 59.13 1b73 h LEU 231 Cb 0.41 0.19 -0.13 0.00 0.37 0.00 0.00 40.66 41.50 1b73 h LEU 231 CO 0.00 -0.10 0.67 1.56 -0.34 0.00 0.00 178.44 180.23 1b73 h GLN 232 N -0.09 0.26 -0.18 1.25 7.50 -1.83 0.18 115.11 122.20 1b73 h GLN 232 Ca 0.02 -0.02 -0.12 0.00 0.50 0.00 0.00 58.65 59.04 1b73 h GLN 232 Cb 0.14 -0.06 0.00 0.00 0.05 0.00 0.00 27.48 27.62 1b73 h GLN 232 CO -0.16 0.17 -0.34 0.35 -1.50 0.00 0.00 178.83 177.35 1b73 h PHE 233 N 0.26 0.69 -0.75 2.96 -0.00 -1.68 -2.98 116.94 115.44 1b73 h PHE 233 Ca 0.74 -0.25 -0.00 0.00 -0.00 0.00 0.00 57.97 58.45 1b73 h PHE 233 Cb 1.91 -0.13 -0.04 0.00 -0.00 0.00 0.00 35.95 37.69 1b73 h PHE 233 CO -0.01 0.98 0.45 -0.07 -0.00 0.00 0.00 178.31 179.66 1b73 h LEU 234 N 0.20 0.90 -0.51 0.59 3.38 0.61 -2.08 115.31 118.40 1b73 h LEU 234 Ca 0.01 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 57.96 1b73 h LEU 234 Cb 0.94 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 1b73 h LEU 234 CO 0.08 0.70 0.24 0.40 0.09 0.00 0.00 178.44 179.96 1b73 h ILE 235 N 1.03 0.93 -0.40 1.22 2.04 -1.30 -1.03 117.51 120.00 1b73 h ILE 235 Ca 0.27 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 66.00 1b73 h ILE 235 Cb -0.03 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.43 1b73 h ILE 235 CO -0.05 0.09 0.18 0.50 0.00 0.00 0.00 178.15 178.87 1b73 h LYS 236 N 0.48 0.36 -0.35 2.37 3.64 -1.30 -0.99 116.57 120.77 1b73 h LYS 236 Ca 0.23 -0.02 -0.16 0.00 -1.27 0.00 0.00 60.65 59.43 1b73 h LYS 236 Cb 0.16 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1b73 h LYS 236 CO -0.17 0.24 -0.41 -0.07 -2.27 0.00 0.00 179.45 176.76 1b73 h LEU 237 N 0.37 0.94 0.08 5.20 3.38 -0.97 -2.21 115.31 122.10 1b73 h LEU 237 Ca 0.18 -0.44 -0.12 0.00 0.09 0.00 0.00 57.88 57.58 1b73 h LEU 237 Cb 0.11 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.61 1b73 h LEU 237 CO -0.14 1.23 -0.53 0.40 0.09 0.00 0.00 178.44 179.48 1b73 h ILE 238 N 0.71 1.58 0.00 1.22 2.04 -1.11 -3.37 117.51 118.58 1b73 h ILE 238 Ca 0.05 -2.39 -0.10 0.00 1.00 0.00 0.00 64.86 63.42 1b73 h ILE 238 Cb 1.00 3.16 -0.01 0.00 -0.74 0.00 0.00 36.82 40.22 1b73 h ILE 238 CO 0.10 0.66 -0.47 -0.07 0.00 0.00 0.00 178.15 178.37 1b73 h LEU 239 N -0.52 0.00 0.00 1.44 3.38 -1.32 -3.48 115.31 114.81 1b73 h LEU 239 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1b73 h LEU 239 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1b73 h LEU 239 CO 0.10 0.47 0.00 0.61 0.09 0.00 0.00 178.44 179.71 1b73 n GLY 240 N 1.20 2.83 0.00 0.83 0.00 -0.84 -5.02 105.19 104.20 1b73 n GLY 240 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1b73 n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b73 n ARG 241 N -0.93 0.00 -4.10 1.61 5.12 -1.19 -4.95 116.66 112.21 1b73 n ARG 241 Ca 0.00 0.00 -0.35 0.00 -1.93 0.00 0.00 57.85 55.57 1b73 n ARG 241 Cb 0.00 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.19 1b73 n ARG 241 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1b73 s ASP 242 N -0.28 5.19 -0.11 0.55 1.01 -1.26 -3.57 116.67 118.19 1b73 s ASP 242 Ca 0.00 -0.07 0.02 0.00 0.71 0.00 0.00 52.55 53.21 1b73 s ASP 242 Cb 0.00 -1.88 -0.01 0.00 1.01 0.00 0.00 42.92 42.04 1b73 s ASP 242 CO 0.00 0.13 -0.18 -0.31 0.21 0.00 0.00 175.17 175.01 1b73 s TYR 243 N 0.64 2.68 0.29 4.23 1.51 -1.26 -5.06 117.35 120.38 1b73 s TYR 243 Ca 0.01 -0.82 -0.29 0.00 -1.01 0.00 0.00 57.07 54.96 1b73 s TYR 243 Cb -0.14 -1.77 -0.10 0.00 -0.11 0.00 0.00 41.96 39.84 1b73 s TYR 243 CO 0.02 -0.30 1.34 -2.14 -1.11 0.00 0.00 175.55 173.36 1b73 s PRO 244 N 0.31 4.34 0.34 -1.71 0.02 -1.26 -4.98 135.00 132.05 1b73 s PRO 244 Ca -0.14 2.22 0.08 0.00 0.02 0.00 0.00 61.00 63.18 1b73 s PRO 244 Cb -0.17 -3.10 -0.04 0.00 0.02 0.00 0.00 34.50 31.21 1b73 s PRO 244 CO 0.07 -0.26 0.16 0.14 -0.33 0.00 0.00 177.00 176.78 1b73 s VAL 245 N -0.65 3.08 0.26 3.83 -7.23 -1.26 -4.46 120.40 113.97 1b73 s VAL 245 Ca 0.53 -1.65 0.05 0.00 -1.81 0.00 0.00 61.98 59.09 1b73 s VAL 245 Cb -0.40 -3.00 -0.06 0.00 0.56 0.00 0.00 36.38 33.48 1b73 s VAL 245 CO 0.48 -0.18 -0.02 -1.59 -0.31 0.00 0.00 175.10 173.48 1b73 s LYS 246 N -3.87 1.46 -0.09 4.82 0.00 -0.84 -5.02 119.74 116.21 1b73 s LYS 246 Ca 0.38 -1.75 -0.11 0.00 0.00 0.00 0.00 55.97 54.49 1b73 s LYS 246 Cb -0.03 -0.86 -0.05 0.00 0.00 0.00 0.00 37.83 36.89 1b73 s LYS 246 CO 0.23 -0.06 0.27 -1.17 0.00 0.00 0.00 175.35 174.62 1b73 s LEU 247 N -3.38 4.39 -0.26 2.77 0.20 -1.26 -3.27 118.68 117.86 1b73 s LEU 247 Ca 0.30 0.65 -0.28 0.00 0.69 0.00 0.00 54.13 55.49 1b73 s LEU 247 Cb 0.05 -2.32 -0.04 0.00 -0.43 0.00 0.00 46.19 43.45 1b73 s LEU 247 CO 0.11 0.31 2.13 0.00 -0.29 0.00 0.00 176.35 178.61 1b73 s ALA 248 N -0.71 2.69 0.00 5.97 0.00 0.23 -0.45 121.76 129.50 1b73 s ALA 248 Ca 0.18 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.74 1b73 s ALA 248 Cb -0.14 -4.08 0.00 0.00 0.00 0.00 0.00 23.12 18.90 1b73 s ALA 248 CO 0.07 -2.87 0.00 0.39 0.00 0.00 0.00 175.76 173.36 1b73 n GLU 249 N 8.71 0.00 0.00 0.00 1.02 -1.26 -4.85 120.64 124.26 1b73 n GLU 249 Ca 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1b73 n GLU 249 Cb 0.46 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.47 1b73 n GLU 249 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b73 n GLY 250 N -0.46 0.57 0.28 0.62 0.00 0.40 -4.77 105.19 101.83 1b73 n GLY 250 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1b73 n GLY 250 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b73 h VAL 251 N 0.00 1.14 0.00 1.61 2.07 -1.99 -3.51 116.25 115.58 1b73 h VAL 251 Ca 0.00 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1b73 h VAL 251 Cb 0.00 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1b73 h VAL 251 CO 0.00 0.18 0.00 0.49 0.02 0.00 0.00 177.57 178.26