#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d7l s ALA 0 N 0.00 3.29 -0.30 5.20 0.00 -1.26 -5.08 121.76 123.61 3d7l s ALA 0 Ca 0.00 -0.75 -0.16 0.00 0.00 0.00 0.00 51.96 51.05 3d7l s ALA 0 Cb 0.00 -2.59 0.19 0.00 0.00 0.00 0.00 23.12 20.71 3d7l s ALA 0 CO 0.00 -0.89 1.16 0.21 0.00 0.00 0.00 175.76 176.24 3d7l s LYS 2 N -5.03 0.16 -0.08 0.00 2.20 -1.26 -5.01 119.74 110.72 3d7l s LYS 2 Ca 0.55 0.30 0.02 0.00 -0.36 0.00 0.00 55.97 56.48 3d7l s LYS 2 Cb -0.11 0.07 0.01 0.00 -1.51 0.00 0.00 37.83 36.30 3d7l s LYS 2 CO 0.45 -0.04 -0.14 0.42 -0.36 0.00 0.00 175.35 175.68 3d7l s ILE 3 N 1.37 1.31 -0.32 5.43 1.01 0.25 -0.74 121.20 129.51 3d7l s ILE 3 Ca -0.07 -0.57 -0.17 0.00 0.00 0.00 0.00 60.65 59.84 3d7l s ILE 3 Cb -0.03 -1.19 -0.01 0.00 0.01 0.00 0.00 42.46 41.24 3d7l s ILE 3 CO -0.13 0.40 0.48 -0.22 0.00 0.00 0.00 174.94 175.47 3d7l s LEU 4 N 0.71 4.26 -0.35 2.97 2.96 -0.02 -0.33 118.68 128.87 3d7l s LEU 4 Ca -0.13 0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.81 3d7l s LEU 4 Cb -0.16 -2.55 0.06 0.00 0.50 0.00 0.00 46.19 44.04 3d7l s LEU 4 CO 0.03 -0.39 0.13 -0.22 -1.32 0.00 0.00 176.35 174.58 3d7l s LEU 5 N 2.29 4.51 -0.21 -0.68 2.96 0.18 -0.96 118.68 126.77 3d7l s LEU 5 Ca 0.18 -1.32 -0.16 0.00 -0.22 0.00 0.00 54.13 52.61 3d7l s LEU 5 Cb -0.16 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.63 3d7l s LEU 5 CO 0.12 -0.38 0.41 -0.63 -1.32 0.00 0.00 176.35 174.55 3d7l s ILE 6 N 1.36 5.19 0.00 6.68 1.01 0.26 -0.84 121.20 134.85 3d7l s ILE 6 Ca -0.00 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.37 3d7l s ILE 6 Cb -0.20 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.53 3d7l s ILE 6 CO 0.01 0.23 0.00 0.61 0.00 0.00 0.00 174.94 175.80 3d7l n GLY 7 N 4.00 0.98 0.27 6.18 0.00 -0.11 -0.52 105.19 115.98 3d7l n GLY 7 Ca -0.08 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.01 3d7l n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d7l h ALA 8 N 0.00 1.73 0.00 4.61 0.00 -1.70 -2.22 119.26 121.68 3d7l h ALA 8 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3d7l h ALA 8 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3d7l h ALA 8 CO 0.00 0.05 -0.11 -1.13 0.00 0.00 0.00 179.25 178.06 3d7l n SER 9 N -4.19 0.39 -4.68 0.00 3.41 -1.26 -1.56 113.62 105.72 3d7l n SER 9 Ca -0.03 0.41 -0.29 0.00 -0.26 0.00 0.00 58.87 58.70 3d7l n SER 9 Cb 0.12 -0.45 0.17 0.00 -0.26 0.00 0.00 64.21 63.79 3d7l n SER 9 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3d7l s GLY 10 N -3.25 1.58 0.08 5.00 0.00 -0.83 -4.74 107.32 105.16 3d7l s GLY 10 Ca 0.12 -0.25 -0.32 0.00 0.00 0.00 0.00 44.72 44.27 3d7l s GLY 10 CO 0.59 0.33 1.62 -0.84 0.00 0.00 0.00 173.10 174.79 3d7l h THR 11 N -1.82 0.29 0.41 0.90 2.02 -1.90 0.25 112.91 113.05 3d7l h THR 11 Ca -0.53 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.63 3d7l h THR 11 Cb 1.31 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 3d7l h THR 11 CO 0.56 0.00 -0.19 0.25 0.37 0.00 0.00 175.52 176.51 3d7l h LEU 12 N -0.83 -0.46 -1.07 2.58 5.85 -1.92 -2.82 115.31 116.63 3d7l h LEU 12 Ca -0.06 0.00 0.24 0.00 0.84 0.00 0.00 57.88 58.91 3d7l h LEU 12 Cb 0.69 0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.72 3d7l h LEU 12 CO 0.04 -0.31 0.61 1.23 -0.34 0.00 0.00 178.44 179.67 3d7l h GLY 13 N -0.57 1.76 1.82 3.75 0.00 -1.65 -0.73 103.07 107.45 3d7l h GLY 13 Ca -0.06 -0.30 -0.20 0.00 0.00 0.00 0.00 47.33 46.78 3d7l h GLY 13 CO 0.09 -0.19 -0.90 1.48 0.00 0.00 0.00 176.54 177.02 3d7l h SER 14 N 0.58 0.21 -0.28 0.19 4.64 0.10 0.12 113.55 119.12 3d7l h SER 14 Ca 0.62 -0.18 -0.08 0.00 -0.47 0.00 0.00 61.79 61.69 3d7l h SER 14 Cb 1.22 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.23 3d7l h SER 14 CO -0.43 1.00 -0.08 0.00 -0.87 0.00 0.00 176.83 176.46 3d7l h ALA 15 N 0.98 1.14 0.04 5.18 0.00 -1.07 -2.37 119.26 123.16 3d7l h ALA 15 Ca -0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 3d7l h ALA 15 Cb 1.54 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3d7l h ALA 15 CO 0.13 0.55 -0.02 0.28 0.00 0.00 0.00 179.25 180.19 3d7l h VAL 16 N 0.61 1.18 -0.73 0.00 2.07 -0.73 -3.01 116.25 115.65 3d7l h VAL 16 Ca 0.11 -0.73 0.16 0.00 0.82 0.00 0.00 66.70 67.06 3d7l h VAL 16 Cb 0.50 1.66 -0.11 0.00 -1.52 0.00 0.00 31.29 31.82 3d7l h VAL 16 CO 0.03 0.18 0.16 0.50 0.02 0.00 0.00 177.57 178.46 3d7l h LYS 17 N -0.38 0.24 -0.84 1.57 3.64 -0.75 -1.63 116.57 118.42 3d7l h LYS 17 Ca -0.01 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 3d7l h LYS 17 Cb 0.35 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.06 3d7l h LYS 17 CO 0.01 0.16 0.54 1.49 -2.27 0.00 0.00 179.45 179.38 3d7l h GLU 18 N 0.25 1.03 0.41 1.90 4.81 -1.31 0.15 114.58 121.83 3d7l h GLU 18 Ca 0.41 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 3d7l h GLU 18 Cb 0.69 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.84 3d7l h GLU 18 CO -0.51 0.68 -0.20 0.00 -0.73 0.00 0.00 179.01 178.25 3d7l h ARG 19 N 1.06 -0.54 -0.02 1.92 3.08 -1.29 -3.36 114.38 115.23 3d7l h ARG 19 Ca 0.33 0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.38 3d7l h ARG 19 Cb -0.02 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 3d7l h ARG 19 CO -0.11 -0.24 -0.16 -0.07 -1.07 0.00 0.00 179.97 178.33 3d7l h LEU 20 N -1.01 0.03 -1.13 3.04 3.38 -1.19 -2.61 115.31 115.83 3d7l h LEU 20 Ca -0.06 -0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.09 3d7l h LEU 20 Cb 0.54 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.19 3d7l h LEU 20 CO 0.09 0.20 0.61 -0.33 0.09 0.00 0.00 178.44 179.10 3d7l h GLU 21 N 0.04 0.69 0.00 1.13 5.08 -1.11 -1.54 114.58 118.87 3d7l h GLU 21 Ca 0.01 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3d7l h GLU 21 Cb 0.30 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 3d7l h GLU 21 CO 0.02 0.46 -0.11 0.87 -1.00 0.00 0.00 179.01 179.25 3d7l h LYS 22 N 0.71 0.00 -0.00 2.33 1.79 -1.62 -3.27 116.57 116.51 3d7l h LYS 22 Ca 0.54 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.01 3d7l h LYS 22 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 3d7l h LYS 22 CO -0.32 0.11 -0.05 1.63 -1.08 0.00 0.00 179.45 179.74 3d7l n LYS 23 N -3.48 5.11 -3.52 3.15 5.02 -0.86 -5.08 118.16 118.50 3d7l n LYS 23 Ca -0.01 -0.12 -0.11 0.00 -2.02 0.00 0.00 58.31 56.05 3d7l n LYS 23 Cb 0.25 -0.65 -0.03 0.00 -0.02 0.00 0.00 35.03 34.58 3d7l n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3d7l s ALA 24 N -0.92 -1.32 -0.10 7.82 0.00 -0.64 -5.01 121.76 121.60 3d7l s ALA 24 Ca 0.01 0.25 -0.30 0.00 0.00 0.00 0.00 51.96 51.92 3d7l s ALA 24 Cb 0.01 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 3d7l s ALA 24 CO 0.04 -0.73 1.46 -2.00 0.00 0.00 0.00 175.76 174.54 3d7l s GLU 25 N -3.78 4.21 -0.24 0.00 2.12 -1.26 -4.40 118.70 115.36 3d7l s GLU 25 Ca 0.02 1.94 -0.07 0.00 0.36 0.00 0.00 54.97 57.23 3d7l s GLU 25 Cb 0.00 -3.85 -0.03 0.00 0.26 0.00 0.00 34.13 30.51 3d7l s GLU 25 CO -0.12 -0.76 0.05 0.08 -0.54 0.00 0.00 175.26 173.97 3d7l s VAL 26 N 3.65 4.22 -0.22 3.70 1.01 -1.26 -0.58 120.40 130.91 3d7l s VAL 26 Ca 0.64 -0.21 -0.14 0.00 0.00 0.00 0.00 61.98 62.28 3d7l s VAL 26 Cb -0.28 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 3d7l s VAL 26 CO 0.23 0.36 0.33 -0.63 0.00 0.00 0.00 175.10 175.39 3d7l s ILE 27 N 1.47 5.24 0.16 2.22 1.01 0.56 -4.98 121.20 126.87 3d7l s ILE 27 Ca 0.06 0.53 -0.03 0.00 0.00 0.00 0.00 60.65 61.21 3d7l s ILE 27 Cb -0.15 -3.66 -0.05 0.00 0.01 0.00 0.00 42.46 38.61 3d7l s ILE 27 CO 0.03 0.26 0.37 0.42 0.00 0.00 0.00 174.94 176.02 3d7l s THR 28 N 1.38 5.19 -0.02 2.92 -4.23 -1.26 -0.65 115.64 118.97 3d7l s THR 28 Ca 0.15 -0.12 -0.06 0.00 -1.18 0.00 0.00 61.69 60.48 3d7l s THR 28 Cb -0.15 -3.66 0.01 0.00 1.34 0.00 0.00 72.50 70.04 3d7l s THR 28 CO 0.07 -0.03 0.14 0.00 -0.54 0.00 0.00 174.62 174.26 3d7l s ALA 29 N -1.73 -0.32 0.21 3.99 0.00 -0.02 -1.66 121.76 122.23 3d7l s ALA 29 Ca 0.40 0.06 -0.18 0.00 0.00 0.00 0.00 51.96 52.24 3d7l s ALA 29 Cb -0.12 -0.03 0.06 0.00 0.00 0.00 0.00 23.12 23.04 3d7l s ALA 29 CO 0.26 -0.15 0.87 0.41 0.00 0.00 0.00 175.76 177.15 3d7l n GLY 30 N 2.05 0.77 0.08 0.00 0.00 -0.01 -0.93 105.19 107.15 3d7l n GLY 30 Ca -0.19 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 3d7l n GLY 30 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3d7l h ARG 31 N 0.00 0.11 0.00 1.61 9.65 -1.91 -0.35 114.38 123.49 3d7l h ARG 31 Ca -0.26 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.57 3d7l h ARG 31 Cb 1.08 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 3d7l h ARG 31 CO 0.34 0.52 0.00 0.72 2.80 0.00 0.00 179.97 184.35 3d7l n HIS 32 N -4.79 0.00 -3.92 2.20 8.25 -1.26 -4.48 115.22 111.22 3d7l n HIS 32 Ca -0.07 -0.25 -0.10 0.00 -0.26 0.00 0.00 57.72 57.04 3d7l n HIS 32 Cb 0.26 -0.02 -0.10 0.00 1.12 0.00 0.00 29.99 31.24 3d7l n HIS 32 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3d7l s SER 33 N -0.50 0.13 0.00 0.41 0.15 -1.26 -5.11 113.70 107.52 3d7l s SER 33 Ca 0.00 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.26 3d7l s SER 33 Cb 0.00 0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 3d7l s SER 33 CO 0.00 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.65 3d7l n GLY 34 N 1.27 3.21 0.39 9.45 0.00 -1.26 -0.83 105.19 117.42 3d7l n GLY 34 Ca -0.22 -1.98 0.17 0.00 0.00 0.00 0.00 46.02 43.99 3d7l n GLY 34 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3d7l h ASP 35 N 0.00 0.54 -4.67 1.61 3.32 -1.69 -3.41 116.42 112.12 3d7l h ASP 35 Ca 0.00 0.06 -0.32 0.00 0.02 0.00 0.00 57.03 56.79 3d7l h ASP 35 Cb 0.00 -0.04 -0.21 0.00 0.22 0.00 0.00 39.33 39.30 3d7l h ASP 35 CO 0.00 0.21 -0.75 -0.69 -1.72 0.00 0.00 179.24 176.29 3d7l s VAL 36 N -5.58 0.73 0.26 -1.35 1.01 -0.73 -5.00 120.40 109.74 3d7l s VAL 36 Ca -0.09 -1.17 0.09 0.00 0.00 0.00 0.00 61.98 60.81 3d7l s VAL 36 Cb 0.23 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 3d7l s VAL 36 CO 0.79 -0.34 0.03 0.42 0.00 0.00 0.00 175.10 176.00 3d7l s THR 37 N -1.38 3.64 -0.25 3.92 -4.23 -1.26 -3.06 115.64 113.01 3d7l s THR 37 Ca -0.07 -1.82 -0.18 0.00 -1.18 0.00 0.00 61.69 58.44 3d7l s THR 37 Cb -0.10 -2.95 0.07 0.00 1.34 0.00 0.00 72.50 70.87 3d7l s THR 37 CO 0.01 -0.37 0.65 0.54 -0.54 0.00 0.00 174.62 174.91 3d7l s VAL 38 N -2.29 -0.00 -0.45 2.29 0.11 -0.14 -4.87 120.40 115.05 3d7l s VAL 38 Ca 0.32 0.01 -0.14 0.00 -2.93 0.00 0.00 61.98 59.23 3d7l s VAL 38 Cb -0.07 -0.93 0.06 0.00 -1.53 0.00 0.00 36.38 33.92 3d7l s VAL 38 CO 0.21 0.00 0.36 -0.62 -3.33 0.00 0.00 175.10 171.72 3d7l s ASP 39 N 1.06 6.06 0.29 3.54 -1.08 -1.26 -3.32 116.67 121.95 3d7l s ASP 39 Ca -0.06 -1.28 0.25 0.00 -0.52 0.00 0.00 52.55 50.94 3d7l s ASP 39 Cb -0.05 -2.15 1.00 0.00 -1.46 0.00 0.00 42.92 40.26 3d7l s ASP 39 CO -0.10 -0.60 1.75 0.16 0.52 0.00 0.00 175.17 176.90 3d7l h ILE 40 N 5.79 0.00 0.00 4.11 3.07 -1.93 -1.29 117.51 127.25 3d7l h ILE 40 Ca -0.27 -0.30 0.00 0.00 1.55 0.00 0.00 64.86 65.84 3d7l h ILE 40 Cb 1.11 1.09 0.00 0.00 -0.27 0.00 0.00 36.82 38.75 3d7l h ILE 40 CO 0.83 0.00 0.00 0.35 -1.05 0.00 0.00 178.15 178.28 3d7l n THR 41 N -2.34 0.11 -4.09 0.16 -2.24 -1.26 -4.29 114.28 100.34 3d7l n THR 41 Ca 0.02 0.03 -0.33 0.00 -2.27 0.00 0.00 64.05 61.51 3d7l n THR 41 Cb 0.26 -0.57 -0.15 0.00 -2.10 0.00 0.00 70.33 67.77 3d7l n THR 41 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3d7l s ASN 42 N -2.73 3.86 0.15 3.42 3.84 -0.49 -5.03 114.94 117.97 3d7l s ASN 42 Ca 0.21 -1.04 -0.21 0.00 0.21 0.00 0.00 52.86 52.04 3d7l s ASN 42 Cb 0.18 -1.53 0.03 0.00 -0.55 0.00 0.00 41.25 39.39 3d7l s ASN 42 CO 0.45 -0.10 1.66 0.40 -2.79 0.00 0.00 177.10 176.71 3d7l h ILE 43 N 6.37 0.54 -0.67 -5.21 2.04 -1.84 -1.90 117.51 116.84 3d7l h ILE 43 Ca -0.32 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 3d7l h ILE 43 Cb 1.09 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3d7l h ILE 43 CO 0.55 0.00 0.31 0.44 0.00 0.00 0.00 178.15 179.45 3d7l h ASP 44 N -0.15 0.86 -0.68 1.72 3.32 -1.96 -1.44 116.42 118.10 3d7l h ASP 44 Ca 0.14 -0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.11 3d7l h ASP 44 Cb 0.35 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3d7l h ASP 44 CO -0.33 0.74 0.44 -1.28 -1.72 0.00 0.00 179.24 177.08 3d7l h SER 45 N 0.95 0.74 -0.40 6.45 0.87 -1.76 0.30 113.55 120.71 3d7l h SER 45 Ca 0.23 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.76 3d7l h SER 45 Cb 0.11 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 3d7l h SER 45 CO -0.03 0.53 0.19 0.40 -0.53 0.00 0.00 176.83 177.39 3d7l h ILE 46 N 0.88 1.18 -0.78 2.23 2.04 -0.72 -2.96 117.51 119.37 3d7l h ILE 46 Ca 0.26 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3d7l h ILE 46 Cb -0.06 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 3d7l h ILE 46 CO -0.07 0.19 0.49 0.11 0.00 0.00 0.00 178.15 178.87 3d7l h LYS 47 N 0.51 1.04 -1.59 2.37 1.57 -0.93 -1.75 116.57 117.79 3d7l h LYS 47 Ca 0.14 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3d7l h LYS 47 Cb 0.13 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3d7l h LYS 47 CO -0.02 0.71 0.00 1.17 -0.57 0.00 0.00 179.45 180.75 3d7l n LYS 48 N -4.51 0.04 0.00 3.15 0.00 0.07 -1.59 118.16 115.32 3d7l n LYS 48 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.39 3d7l n LYS 48 Cb 0.04 -1.39 0.00 0.00 0.00 0.00 0.00 35.03 33.68 3d7l n LYS 48 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 3d7l n TYR 50 N 0.88 0.00 -0.08 5.64 4.01 -0.66 -1.15 117.16 125.80 3d7l n TYR 50 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3d7l n TYR 50 Cb 0.02 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.01 3d7l n TYR 50 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 3d7l h GLU 51 N 0.00 0.39 -0.27 -0.72 5.08 -1.57 -2.28 114.58 115.21 3d7l h GLU 51 Ca 0.00 -0.08 0.04 0.00 -1.00 0.00 0.00 59.36 58.31 3d7l h GLU 51 Cb 0.00 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 3d7l h GLU 51 CO 0.00 0.46 0.06 1.96 -1.00 0.00 0.00 179.01 180.49 3d7l h GLN 52 N 0.24 0.16 -0.19 2.33 4.20 -1.41 -3.24 115.11 117.20 3d7l h GLN 52 Ca 0.08 -0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.65 3d7l h GLN 52 Cb 0.23 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 3d7l h GLN 52 CO -0.00 0.10 -0.44 0.28 -0.67 0.00 0.00 178.83 178.10 3d7l h VAL 53 N 0.16 1.31 -0.29 -0.54 2.07 -1.80 -3.50 116.25 113.66 3d7l h VAL 53 Ca 0.12 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 66.02 3d7l h VAL 53 Cb 0.12 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 3d7l h VAL 53 CO -0.16 0.50 0.00 0.61 0.02 0.00 0.00 177.57 178.54 3d7l n GLY 54 N 0.01 0.09 3.72 2.17 0.00 -0.86 -4.83 105.19 105.48 3d7l n GLY 54 Ca -0.02 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 3d7l n GLY 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d7l s LYS 55 N 0.00 4.56 0.33 1.61 -0.14 -1.26 -4.85 119.74 120.00 3d7l s LYS 55 Ca 0.00 1.61 0.04 0.00 -1.36 0.00 0.00 55.97 56.25 3d7l s LYS 55 Cb 0.00 -3.36 -0.06 0.00 -1.68 0.00 0.00 37.83 32.73 3d7l s LYS 55 CO 0.00 -0.02 0.07 0.14 -0.76 0.00 0.00 175.35 174.78 3d7l s VAL 56 N 0.47 1.08 -0.12 3.17 -7.23 -0.00 -4.95 120.40 112.81 3d7l s VAL 56 Ca 0.52 -2.00 0.18 0.00 -1.81 0.00 0.00 61.98 58.87 3d7l s VAL 56 Cb -0.26 -2.73 -0.21 0.00 0.56 0.00 0.00 36.38 33.74 3d7l s VAL 56 CO 0.31 0.00 0.54 0.47 -0.31 0.00 0.00 175.10 176.10 3d7l n ASP 57 N -0.74 0.48 -3.78 4.85 9.92 0.08 0.16 116.55 127.52 3d7l n ASP 57 Ca -0.03 0.21 -0.13 0.00 -0.53 0.00 0.00 54.79 54.32 3d7l n ASP 57 Cb 0.66 0.67 -0.10 0.00 -0.64 0.00 0.00 41.12 41.71 3d7l n ASP 57 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3d7l s ALA 58 N -2.86 -0.69 -0.13 2.24 0.00 -1.01 -2.04 121.76 117.27 3d7l s ALA 58 Ca -0.06 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.51 3d7l s ALA 58 Cb 0.09 -0.28 0.02 0.00 0.00 0.00 0.00 23.12 22.94 3d7l s ALA 58 CO 0.83 -0.17 -0.16 0.42 0.00 0.00 0.00 175.76 176.68 3d7l s ILE 59 N -0.36 1.64 -0.14 0.00 1.01 -0.58 -0.84 121.20 121.93 3d7l s ILE 59 Ca -0.05 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 59.91 3d7l s ILE 59 Cb -0.03 -1.50 0.02 0.00 0.01 0.00 0.00 42.46 40.95 3d7l s ILE 59 CO 0.01 0.47 -0.17 -0.69 0.00 0.00 0.00 174.94 174.57 3d7l s VAL 60 N 1.17 1.70 -0.30 2.92 1.01 -0.13 -0.78 120.40 125.98 3d7l s VAL 60 Ca -0.02 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.17 3d7l s VAL 60 Cb -0.14 -1.55 0.02 0.00 0.00 0.00 0.00 36.38 34.71 3d7l s VAL 60 CO -0.06 0.48 0.06 -0.55 0.00 0.00 0.00 175.10 175.03 3d7l s SER 61 N 1.18 5.04 -0.49 3.32 0.15 0.40 -0.57 113.70 122.72 3d7l s SER 61 Ca -0.01 -0.85 0.04 0.00 0.70 0.00 0.00 55.95 55.83 3d7l s SER 61 Cb -0.14 -1.84 0.41 0.00 -1.71 0.00 0.00 66.02 62.74 3d7l s SER 61 CO -0.07 -0.21 1.29 0.00 1.20 0.00 0.00 173.24 175.45 3d7l n ALA 62 N 4.82 5.33 -2.24 5.45 0.00 0.32 -2.72 120.51 131.46 3d7l n ALA 62 Ca -0.14 -4.21 -0.15 0.00 0.00 0.00 0.00 53.44 48.93 3d7l n ALA 62 Cb 0.47 -0.78 -0.09 0.00 0.00 0.00 0.00 19.45 19.05 3d7l n ALA 62 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3d7l s THR 63 N -5.34 0.00 0.00 0.00 -1.32 -1.25 -4.51 115.64 103.22 3d7l s THR 63 Ca 0.49 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.98 3d7l s THR 63 Cb 0.41 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 68.90 3d7l s THR 63 CO -0.20 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.82 3d7l n GLY 64 N -0.43 2.99 3.54 6.08 0.00 -1.26 -4.82 105.19 111.30 3d7l n GLY 64 Ca 0.04 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.41 3d7l n GLY 64 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d7l s SER 65 N 0.00 4.22 -0.04 1.61 0.01 -1.26 -4.51 113.70 113.73 3d7l s SER 65 Ca 0.00 -0.42 0.02 0.00 1.31 0.00 0.00 55.95 56.86 3d7l s SER 65 Cb 0.00 -0.75 0.01 0.00 0.21 0.00 0.00 66.02 65.49 3d7l s SER 65 CO 0.00 0.19 -0.10 0.00 0.41 0.00 0.00 173.24 173.75 3d7l s ALA 66 N -1.16 0.95 0.19 1.44 0.00 -1.26 -1.39 121.76 120.54 3d7l s ALA 66 Ca 0.20 -0.33 -0.33 0.00 0.00 0.00 0.00 51.96 51.50 3d7l s ALA 66 Cb -0.11 -0.39 -0.14 0.00 0.00 0.00 0.00 23.12 22.48 3d7l s ALA 66 CO 0.12 0.12 1.53 2.41 0.00 0.00 0.00 175.76 179.94 3d7l n THR 67 N 3.49 0.34 -3.51 0.00 -1.04 -1.26 -4.86 114.28 107.44 3d7l n THR 67 Ca -0.20 -0.09 -0.31 0.00 -2.04 0.00 0.00 64.05 61.41 3d7l n THR 67 Cb 0.53 -1.56 -0.07 0.00 -1.82 0.00 0.00 70.33 67.41 3d7l n THR 67 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 3d7l n PHE 68 N 2.91 3.50 -4.74 -1.42 -0.00 -1.26 -4.06 117.46 112.39 3d7l n PHE 68 Ca 0.15 -3.97 -0.30 0.00 -0.00 0.00 0.00 57.45 53.33 3d7l n PHE 68 Cb 0.30 -0.79 -0.14 0.00 -0.00 0.00 0.00 39.48 38.86 3d7l n PHE 68 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3d7l s SER 69 N -1.72 3.23 0.44 -2.13 0.15 -1.20 -4.98 113.70 107.50 3d7l s SER 69 Ca 0.33 -0.64 -0.24 0.00 0.70 0.00 0.00 55.95 56.11 3d7l s SER 69 Cb 0.05 -0.28 -0.10 0.00 -1.71 0.00 0.00 66.02 63.99 3d7l s SER 69 CO -0.05 0.23 1.02 -2.65 1.20 0.00 0.00 173.24 172.99 3d7l n PRO 70 N 1.49 1.34 -0.23 5.44 -0.02 -1.26 -4.22 135.00 137.54 3d7l n PRO 70 Ca -0.17 0.48 0.03 0.00 -2.02 0.00 0.00 63.50 61.82 3d7l n PRO 70 Cb 0.52 -2.08 0.15 0.00 -0.02 0.00 0.00 33.50 32.07 3d7l n PRO 70 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3d7l h LEU 71 N 1.44 0.09 0.00 2.45 5.85 -1.95 -0.65 115.31 122.54 3d7l h LEU 71 Ca -0.45 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.39 3d7l h LEU 71 Cb 1.34 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3d7l h LEU 71 CO 0.56 0.03 0.00 0.35 -0.34 0.00 0.00 178.44 179.04 3d7l n THR 72 N -5.10 0.43 0.69 1.05 -2.24 -1.26 -1.88 114.28 105.97 3d7l n THR 72 Ca 0.12 0.11 0.08 0.00 -2.27 0.00 0.00 64.05 62.08 3d7l n THR 72 Cb 0.38 -0.75 0.03 0.00 -2.10 0.00 0.00 70.33 67.89 3d7l n THR 72 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d7l n GLU 73 N -1.37 1.50 -2.78 -0.78 4.71 -0.33 -4.92 120.64 116.68 3d7l n GLU 73 Ca 0.08 -1.13 -0.43 0.00 -0.01 0.00 0.00 57.16 55.67 3d7l n GLU 73 Cb 0.20 -1.29 -0.04 0.00 -1.01 0.00 0.00 31.44 29.30 3d7l n GLU 73 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 3d7l s LEU 74 N -1.69 4.00 0.52 -4.62 2.96 -0.73 -4.90 118.68 114.22 3d7l s LEU 74 Ca 0.16 -0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 53.45 3d7l s LEU 74 Cb 0.13 -2.62 0.01 0.00 0.50 0.00 0.00 46.19 44.21 3d7l s LEU 74 CO 0.30 -1.45 0.76 0.42 -1.32 0.00 0.00 176.35 175.06 3d7l s THR 75 N 4.40 3.48 0.27 3.68 -4.23 -1.26 -4.92 115.64 117.06 3d7l s THR 75 Ca 0.28 -0.43 0.01 0.00 -1.18 0.00 0.00 61.69 60.37 3d7l s THR 75 Cb -0.13 -3.32 0.26 0.00 1.34 0.00 0.00 72.50 70.65 3d7l s THR 75 CO 0.15 -0.25 1.74 -0.65 -0.54 0.00 0.00 174.62 175.07 3d7l h PRO 76 N 0.14 0.53 -0.43 3.99 0.11 -1.98 -0.76 132.00 133.60 3d7l h PRO 76 Ca -0.45 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3d7l h PRO 76 Cb 1.27 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3d7l h PRO 76 CO 0.57 0.35 0.25 0.93 -0.21 0.00 0.00 178.00 179.89 3d7l h GLU 77 N 0.54 0.58 -0.70 1.05 3.07 -1.99 -0.04 114.58 117.10 3d7l h GLU 77 Ca 0.50 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 59.24 3d7l h GLU 77 Cb 0.81 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.57 3d7l h GLU 77 CO -0.42 0.44 0.19 0.87 -1.40 0.00 0.00 179.01 178.68 3d7l h LYS 78 N 0.56 1.09 0.00 2.33 1.57 -1.81 -2.87 116.57 117.44 3d7l h LYS 78 Ca 0.15 -0.24 -0.11 0.00 -1.87 0.00 0.00 60.65 58.58 3d7l h LYS 78 Cb 0.01 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 3d7l h LYS 78 CO -0.03 0.95 -0.51 -0.97 -0.57 0.00 0.00 179.45 178.32 3d7l h ASN 79 N 1.04 0.00 0.07 0.86 -0.00 -0.75 -2.88 115.58 113.92 3d7l h ASN 79 Ca 0.22 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.51 3d7l h ASN 79 Cb 0.33 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.65 3d7l h ASN 79 CO -0.00 0.51 -0.04 0.00 -0.00 0.00 0.00 177.43 177.89 3d7l h ALA 80 N 1.49 1.72 0.11 1.57 0.00 -0.77 -2.06 119.26 121.31 3d7l h ALA 80 Ca -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3d7l h ALA 80 Cb 1.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3d7l h ALA 80 CO 0.07 0.06 -0.05 0.28 0.00 0.00 0.00 179.25 179.60 3d7l h VAL 81 N 0.00 1.07 -0.46 0.00 2.07 -1.53 -1.63 116.25 115.77 3d7l h VAL 81 Ca -0.00 -0.73 0.09 0.00 0.82 0.00 0.00 66.70 66.88 3d7l h VAL 81 Cb 0.09 1.53 -0.08 0.00 -1.52 0.00 0.00 31.29 31.30 3d7l h VAL 81 CO 0.01 0.17 -0.08 0.74 0.02 0.00 0.00 177.57 178.43 3d7l h THR 82 N -0.49 0.57 -0.95 2.57 2.02 -1.60 -2.06 112.91 112.97 3d7l h THR 82 Ca -0.01 -0.01 0.13 0.00 0.77 0.00 0.00 66.41 67.28 3d7l h THR 82 Cb 0.40 0.54 -0.08 0.00 -1.74 0.00 0.00 68.15 67.27 3d7l h THR 82 CO 0.02 0.01 0.61 0.40 0.37 0.00 0.00 175.52 176.93 3d7l h ILE 83 N 0.03 0.90 0.00 3.11 2.04 -1.25 -1.24 117.51 121.10 3d7l h ILE 83 Ca 0.22 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3d7l h ILE 83 Cb 0.34 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 3d7l h ILE 83 CO -0.44 0.16 -0.09 0.77 0.00 0.00 0.00 178.15 178.55 3d7l h SER 84 N 0.88 0.00 0.00 1.72 4.64 -0.63 0.37 113.55 120.52 3d7l h SER 84 Ca 0.47 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 3d7l h SER 84 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3d7l h SER 84 CO -0.24 0.00 0.00 -0.24 -0.87 0.00 0.00 176.83 175.49 3d7l n SER 85 N -2.94 0.00 -0.28 4.97 2.88 -0.52 -1.85 113.62 115.89 3d7l n SER 85 Ca 0.04 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.65 3d7l n SER 85 Cb 0.52 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 64.28 3d7l n SER 85 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 3d7l h LYS 86 N 0.00 0.85 0.00 -1.46 1.63 -1.01 -0.64 116.57 115.94 3d7l h LYS 86 Ca 0.00 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 3d7l h LYS 86 Cb 0.00 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.44 3d7l h LYS 86 CO 0.00 0.56 0.00 -0.11 -3.45 0.00 0.00 179.45 176.45 3d7l n LEU 87 N -4.52 0.88 0.08 5.20 0.00 -0.91 -4.01 117.00 113.71 3d7l n LEU 87 Ca 0.15 0.29 -0.07 0.00 0.00 0.00 0.00 56.01 56.37 3d7l n LEU 87 Cb 0.30 -0.33 0.06 0.00 0.00 0.00 0.00 43.42 43.45 3d7l n LEU 87 CO 0.31 -0.33 0.38 1.23 0.00 0.00 0.00 177.39 178.99 3d7l h GLY 88 N 0.00 0.30 0.89 -3.96 0.00 -0.35 -2.51 103.07 97.43 3d7l h GLY 88 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 3d7l h GLY 88 CO 0.00 0.37 0.04 -1.33 0.00 0.00 0.00 176.54 175.62 3d7l h GLY 89 N 1.53 0.13 1.37 4.60 0.00 -0.35 -0.76 103.07 109.60 3d7l h GLY 89 Ca -0.02 -0.07 -0.10 0.00 0.00 0.00 0.00 47.33 47.14 3d7l h GLY 89 CO 0.11 0.06 -0.17 1.46 0.00 0.00 0.00 176.54 178.01 3d7l h GLN 90 N 0.01 0.73 -0.40 4.80 4.20 -1.43 -2.19 115.11 120.83 3d7l h GLN 90 Ca 0.03 -0.26 -0.13 0.00 0.06 0.00 0.00 58.65 58.35 3d7l h GLN 90 Cb 0.13 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 3d7l h GLN 90 CO -0.00 0.86 -0.24 0.82 -0.67 0.00 0.00 178.83 179.59 3d7l h ILE 91 N 0.65 1.28 -0.40 2.54 2.04 -1.38 -2.79 117.51 119.46 3d7l h ILE 91 Ca 0.10 -1.40 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 3d7l h ILE 91 Cb 0.65 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 3d7l h ILE 91 CO 0.05 0.47 0.20 0.78 0.00 0.00 0.00 178.15 179.64 3d7l h ASN 92 N 0.69 0.48 -0.24 1.72 2.35 -1.03 0.13 115.58 119.68 3d7l h ASN 92 Ca 0.08 -0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.82 3d7l h ASN 92 Cb 0.81 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.05 3d7l h ASN 92 CO 0.07 0.41 0.16 -0.07 -1.65 0.00 0.00 177.43 176.35 3d7l h LEU 93 N 0.55 0.20 0.02 1.61 3.38 -1.12 0.87 115.31 120.81 3d7l h LEU 93 Ca 0.14 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3d7l h LEU 93 Cb 0.05 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3d7l h LEU 93 CO -0.02 0.14 -0.01 0.58 0.09 0.00 0.00 178.44 179.22 3d7l h VAL 94 N 0.23 1.49 -0.44 1.22 2.07 -0.85 -2.34 116.25 117.63 3d7l h VAL 94 Ca 0.10 -1.89 0.04 0.00 0.82 0.00 0.00 66.70 65.77 3d7l h VAL 94 Cb 0.12 2.71 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 3d7l h VAL 94 CO -0.02 0.46 0.29 -0.07 0.02 0.00 0.00 177.57 178.26 3d7l h LEU 95 N -0.89 0.37 0.00 2.57 3.38 -0.47 -2.52 115.31 117.75 3d7l h LEU 95 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d7l h LEU 95 Cb 0.78 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3d7l h LEU 95 CO 0.00 0.25 -0.86 0.18 0.09 0.00 0.00 178.44 178.10 3d7l n LEU 96 N -4.48 0.78 -0.16 1.67 4.77 0.26 -4.56 117.00 115.28 3d7l n LEU 96 Ca 0.05 -0.28 0.08 0.00 -0.03 0.00 0.00 56.01 55.83 3d7l n LEU 96 Cb 0.19 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 3d7l n LEU 96 CO 0.35 0.18 0.08 0.61 -1.33 0.00 0.00 177.39 177.28 3d7l n GLY 97 N 1.48 -0.34 0.37 -0.72 0.00 -0.88 -4.58 105.19 100.52 3d7l n GLY 97 Ca 0.04 -0.48 0.06 0.00 0.00 0.00 0.00 46.02 45.64 3d7l n GLY 97 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3d7l h ILE 98 N 0.77 1.00 0.00 -0.61 2.04 -1.78 -0.08 117.51 118.85 3d7l h ILE 98 Ca 0.00 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.52 3d7l h ILE 98 Cb 0.47 -0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 3d7l h ILE 98 CO 0.00 0.18 0.00 0.44 0.00 0.00 0.00 178.15 178.77 3d7l h ASP 99 N 0.99 0.00 0.19 1.72 3.32 -1.91 -2.19 116.42 118.54 3d7l h ASP 99 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 3d7l h ASP 99 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3d7l h ASP 99 CO -0.19 0.00 -0.26 -1.20 -1.72 0.00 0.00 179.24 175.88 3d7l n SER 100 N -2.35 1.17 -4.80 6.45 7.64 -0.05 -4.91 113.62 116.77 3d7l n SER 100 Ca 0.02 -1.00 -0.37 0.00 1.01 0.00 0.00 58.87 58.52 3d7l n SER 100 Cb 0.25 0.16 -0.06 0.00 -1.01 0.00 0.00 64.21 63.55 3d7l n SER 100 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3d7l s LEU 101 N -2.46 4.38 0.82 -3.43 1.43 -0.83 -0.82 118.68 117.77 3d7l s LEU 101 Ca 0.25 0.75 -0.11 0.00 -1.03 0.00 0.00 54.13 53.99 3d7l s LEU 101 Cb 0.19 -2.46 0.09 0.00 0.03 0.00 0.00 46.19 44.04 3d7l s LEU 101 CO 0.51 0.24 1.12 0.20 0.23 0.00 0.00 176.35 178.65 3d7l s ASN 102 N -0.48 3.90 0.23 2.29 0.01 0.12 -4.90 114.94 116.11 3d7l s ASN 102 Ca 0.21 2.01 -0.31 0.00 -0.71 0.00 0.00 52.86 54.05 3d7l s ASN 102 Cb -0.15 -2.55 -0.14 0.00 0.41 0.00 0.00 41.25 38.83 3d7l s ASN 102 CO 0.09 -2.44 1.30 0.47 -1.51 0.00 0.00 177.10 175.01 3d7l n ASP 103 N -3.69 2.24 -0.24 -1.22 10.43 -1.26 -1.13 116.55 121.68 3d7l n ASP 103 Ca 0.10 1.15 -0.03 0.00 2.57 0.00 0.00 54.79 58.58 3d7l n ASP 103 Cb 0.52 -1.36 -0.01 0.00 1.84 0.00 0.00 41.12 42.11 3d7l n ASP 103 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3d7l n LYS 104 N 1.79 -0.89 -1.13 -1.24 4.76 0.81 -4.97 118.16 117.29 3d7l n LYS 104 Ca 0.12 0.43 -0.28 0.00 -2.87 0.00 0.00 58.31 55.71 3d7l n LYS 104 Cb 0.30 -4.22 0.23 0.00 -1.84 0.00 0.00 35.03 29.50 3d7l n LYS 104 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3d7l n GLY 105 N -1.27 -2.54 3.15 0.72 0.00 -0.28 -4.71 105.19 100.26 3d7l n GLY 105 Ca -0.03 -1.53 -0.10 0.00 0.00 0.00 0.00 46.02 44.36 3d7l n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d7l s SER 106 N -4.54 0.09 -0.08 1.61 1.04 -0.87 -0.58 113.70 110.37 3d7l s SER 106 Ca 0.68 -0.44 -0.02 0.00 0.48 0.00 0.00 55.95 56.65 3d7l s SER 106 Cb -0.06 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 3d7l s SER 106 CO 0.52 -0.54 0.03 -0.36 0.98 0.00 0.00 173.24 173.86 3d7l s PHE 107 N -2.61 3.23 -0.09 5.02 0.08 0.97 -1.53 117.98 123.05 3d7l s PHE 107 Ca -0.05 0.24 0.01 0.00 0.12 0.00 0.00 56.93 57.25 3d7l s PHE 107 Cb -0.01 -1.80 0.02 0.00 -0.57 0.00 0.00 43.02 40.66 3d7l s PHE 107 CO -0.04 0.52 -0.12 0.99 -0.10 0.00 0.00 175.22 176.47 3d7l s THR 108 N -0.94 1.20 0.21 0.64 2.01 0.04 -1.81 115.64 116.98 3d7l s THR 108 Ca 0.15 -0.46 0.10 0.00 0.31 0.00 0.00 61.69 61.78 3d7l s THR 108 Cb -0.11 -1.13 -0.04 0.00 0.01 0.00 0.00 72.50 71.22 3d7l s THR 108 CO 0.04 0.38 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.48 3d7l s LEU 109 N 1.09 2.90 -0.15 4.42 1.02 -0.73 -0.46 118.68 126.78 3d7l s LEU 109 Ca -0.06 -0.68 -0.05 0.00 0.02 0.00 0.00 54.13 53.36 3d7l s LEU 109 Cb -0.14 -1.54 -0.04 0.00 0.02 0.00 0.00 46.19 44.48 3d7l s LEU 109 CO -0.02 0.08 0.04 -0.89 0.02 0.00 0.00 176.35 175.58 3d7l s THR 110 N -1.90 4.59 0.00 5.49 2.01 -1.10 -1.11 115.64 123.62 3d7l s THR 110 Ca 0.26 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.14 3d7l s THR 110 Cb -0.08 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.41 3d7l s THR 110 CO 0.15 0.52 0.00 0.35 -0.69 0.00 0.00 174.62 174.95 3d7l n THR 111 N 3.01 0.00 0.00 -0.82 -2.24 0.31 -4.93 114.28 109.61 3d7l n THR 111 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3d7l n THR 111 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3d7l n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d7l n GLY 112 N 5.00 3.64 3.63 3.38 0.00 -1.26 -4.59 105.19 114.98 3d7l n GLY 112 Ca 0.00 -0.62 -0.46 0.00 0.00 0.00 0.00 46.02 44.94 3d7l n GLY 112 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3d7l n ILE 113 N -1.08 0.53 0.00 -0.61 3.06 -0.13 -4.83 119.36 116.30 3d7l n ILE 113 Ca 0.00 -0.21 0.00 0.00 -2.50 0.00 0.00 62.75 60.04 3d7l n ILE 113 Cb 0.00 -2.12 0.00 0.00 0.54 0.00 0.00 39.64 38.06 3d7l n ILE 113 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 3d7l n GLU 116 N 7.56 0.00 -3.42 9.51 1.02 -1.26 -4.48 120.64 129.56 3d7l n GLU 116 Ca 0.26 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 57.14 3d7l n GLU 116 Cb 0.35 -1.88 -0.09 0.00 -0.02 0.00 0.00 31.44 29.80 3d7l n GLU 116 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3d7l n ASP 117 N 0.14 0.95 -4.79 1.62 -0.08 -1.26 -5.12 116.55 108.01 3d7l n ASP 117 Ca 0.00 -2.77 -0.33 0.00 -1.51 0.00 0.00 54.79 50.18 3d7l n ASP 117 Cb 0.00 -0.63 0.03 0.00 2.34 0.00 0.00 41.12 42.85 3d7l n ASP 117 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 3d7l s PRO 118 N -0.96 3.08 0.21 -0.67 0.04 -1.26 -5.07 135.00 130.37 3d7l s PRO 118 Ca 0.33 1.32 0.07 0.00 0.04 0.00 0.00 61.00 62.76 3d7l s PRO 118 Cb 0.08 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 3d7l s PRO 118 CO -0.14 -1.02 -0.11 0.96 0.04 0.00 0.00 177.00 176.73 3d7l s ILE 119 N -2.35 1.61 0.33 0.56 -4.36 -1.26 -5.08 121.20 110.65 3d7l s ILE 119 Ca 0.66 -2.17 -0.29 0.00 -0.26 0.00 0.00 60.65 58.59 3d7l s ILE 119 Cb -0.19 -2.12 -0.11 0.00 1.25 0.00 0.00 42.46 41.30 3d7l s ILE 119 CO 0.38 -0.54 1.46 -0.69 0.24 0.00 0.00 174.94 175.79 3d7l s VAL 120 N -3.05 2.30 0.00 8.37 1.01 -1.26 -1.37 120.40 126.39 3d7l s VAL 120 Ca 0.24 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.50 3d7l s VAL 120 Cb 0.01 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.21 3d7l s VAL 120 CO 0.07 0.06 0.00 0.00 0.00 0.00 0.00 175.10 175.23 3d7l n GLN 121 N 1.15 0.00 -0.03 2.72 6.02 -1.26 -4.94 117.38 121.04 3d7l n GLN 121 Ca 0.03 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.15 3d7l n GLN 121 Cb 0.40 -2.16 0.39 0.00 1.02 0.00 0.00 30.24 29.89 3d7l n GLN 121 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3d7l n GLY 122 N -2.00 0.35 0.35 1.08 0.00 -0.47 -3.22 105.19 101.28 3d7l n GLY 122 Ca 0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 46.02 45.48 3d7l n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d7l h ALA 123 N 4.38 1.17 -0.14 4.61 0.00 -1.84 0.16 119.26 127.60 3d7l h ALA 123 Ca 0.00 -0.08 -0.22 0.00 0.00 0.00 0.00 54.91 54.61 3d7l h ALA 123 Cb 0.63 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3d7l h ALA 123 CO 0.00 0.59 -0.79 1.03 0.00 0.00 0.00 179.25 180.08 3d7l h SER 124 N 1.25 0.93 -0.46 0.00 0.87 -1.80 -3.14 113.55 111.20 3d7l h SER 124 Ca 0.33 -0.64 -0.12 0.00 -1.23 0.00 0.00 61.79 60.13 3d7l h SER 124 Cb -0.11 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.56 3d7l h SER 124 CO -0.07 1.42 -0.17 0.00 -0.53 0.00 0.00 176.83 177.49 3d7l h ALA 125 N 0.53 0.78 0.00 6.23 0.00 -1.61 -2.41 119.26 122.78 3d7l h ALA 125 Ca -0.06 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3d7l h ALA 125 Cb 1.42 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3d7l h ALA 125 CO 0.16 0.66 0.00 0.00 0.00 0.00 0.00 179.25 180.07 3d7l n ALA 126 N -2.51 0.63 0.00 0.00 0.00 0.52 -0.53 120.51 118.63 3d7l n ALA 126 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3d7l n ALA 126 Cb 0.43 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.26 3d7l n ALA 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d7l n ALA 128 N 0.29 0.00 -0.18 0.00 0.00 -0.91 -0.77 120.51 118.94 3d7l n ALA 128 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3d7l n ALA 128 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 3d7l n ALA 128 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3d7l h ASN 129 N 0.00 0.64 -0.70 0.00 2.35 -1.09 -1.14 115.58 115.64 3d7l h ASN 129 Ca 0.00 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 3d7l h ASN 129 Cb 0.00 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.17 3d7l h ASN 129 CO 0.00 0.55 0.35 1.23 -1.65 0.00 0.00 177.43 177.91 3d7l h GLY 130 N 0.68 1.07 0.94 2.83 0.00 -1.20 -1.51 103.07 105.89 3d7l h GLY 130 Ca 0.18 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 3d7l h GLY 130 CO -0.03 0.50 0.15 0.00 0.00 0.00 0.00 176.54 177.16 3d7l h ALA 131 N 1.17 0.37 -0.23 3.60 0.00 -1.73 -1.93 119.26 120.51 3d7l h ALA 131 Ca 0.24 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 3d7l h ALA 131 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3d7l h ALA 131 CO -0.03 -0.09 -0.39 0.28 0.00 0.00 0.00 179.25 179.02 3d7l h VAL 132 N 0.34 1.30 0.12 0.00 2.07 -1.12 -1.08 116.25 117.87 3d7l h VAL 132 Ca 0.10 -1.54 -0.01 0.00 0.82 0.00 0.00 66.70 66.08 3d7l h VAL 132 Cb 0.09 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 3d7l h VAL 132 CO -0.01 0.48 -0.06 0.74 0.02 0.00 0.00 177.57 178.74 3d7l h THR 133 N 0.44 0.99 -0.46 2.57 2.02 -1.08 -1.98 112.91 115.42 3d7l h THR 133 Ca 0.04 -0.45 -0.06 0.00 0.77 0.00 0.00 66.41 66.70 3d7l h THR 133 Cb 0.87 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.55 3d7l h THR 133 CO 0.07 0.11 0.05 0.00 0.37 0.00 0.00 175.52 176.12 3d7l h ALA 134 N 0.48 0.62 -0.19 6.16 0.00 -1.31 -1.86 119.26 123.17 3d7l h ALA 134 Ca -0.02 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.70 3d7l h ALA 134 Cb 0.30 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 3d7l h ALA 134 CO 0.03 0.38 -0.18 0.35 0.00 0.00 0.00 179.25 179.82 3d7l h PHE 135 N 0.65 -0.46 -0.52 0.00 3.57 -1.17 -2.07 116.94 116.94 3d7l h PHE 135 Ca 0.14 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3d7l h PHE 135 Cb 0.43 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 3d7l h PHE 135 CO 0.03 -0.25 0.34 0.00 -2.23 0.00 0.00 178.31 176.19 3d7l h ALA 136 N 0.88 0.66 -0.30 2.41 0.00 -1.23 0.34 119.26 122.02 3d7l h ALA 136 Ca 0.12 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.01 3d7l h ALA 136 Cb 0.37 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3d7l h ALA 136 CO -0.31 0.12 0.14 -0.22 0.00 0.00 0.00 179.25 178.98 3d7l h LYS 137 N 0.70 0.29 -0.12 0.00 3.64 -1.24 -1.95 116.57 117.88 3d7l h LYS 137 Ca 0.19 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 3d7l h LYS 137 Cb -0.06 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3d7l h LYS 137 CO -0.04 0.19 -0.09 1.03 -2.27 0.00 0.00 179.45 178.27 3d7l h SER 138 N 0.30 0.29 -0.92 4.20 0.87 -1.12 -3.26 113.55 113.91 3d7l h SER 138 Ca 0.13 -0.46 0.12 0.00 -1.23 0.00 0.00 61.79 60.35 3d7l h SER 138 Cb 0.06 -0.08 -0.07 0.00 -0.44 0.00 0.00 62.40 61.87 3d7l h SER 138 CO -0.10 0.68 0.59 0.00 -0.53 0.00 0.00 176.83 177.47 3d7l h ALA 139 N 0.61 1.67 -1.17 6.23 0.00 -0.26 -2.59 119.26 123.75 3d7l h ALA 139 Ca 0.02 0.01 0.34 0.00 0.00 0.00 0.00 54.91 55.28 3d7l h ALA 139 Cb 0.59 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.11 3d7l h ALA 139 CO 0.02 0.11 0.78 0.00 0.00 0.00 0.00 179.25 180.17 3d7l h ALA 140 N 1.57 2.62 0.00 0.00 0.00 -1.39 0.88 119.26 122.93 3d7l h ALA 140 Ca 0.44 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3d7l h ALA 140 Cb 0.52 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3d7l h ALA 140 CO -0.21 -1.07 -0.11 0.44 0.00 0.00 0.00 179.25 178.30 3d7l n ILE 141 N -4.51 0.14 -3.74 0.00 -5.35 -0.97 -4.93 119.36 100.00 3d7l n ILE 141 Ca 0.29 -0.07 -0.38 0.00 -0.27 0.00 0.00 62.75 62.32 3d7l n ILE 141 Cb 1.14 -0.38 -0.12 0.00 -1.74 0.00 0.00 39.64 38.54 3d7l n ILE 141 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3d7l s GLU 142 N -3.03 2.39 0.12 6.28 2.02 0.30 -5.20 118.70 121.58 3d7l s GLU 142 Ca 0.12 -1.49 0.01 0.00 0.02 0.00 0.00 54.97 53.64 3d7l s GLU 142 Cb 0.17 -3.55 -0.04 0.00 0.10 0.00 0.00 34.13 30.80 3d7l s GLU 142 CO 0.58 -0.88 -0.03 -1.25 0.02 0.00 0.00 175.26 173.70 3d7l s PRO 144 N 1.30 0.91 -1.43 0.39 0.04 -1.26 -5.12 135.00 129.83 3d7l s PRO 144 Ca 0.02 -1.40 -0.00 0.00 0.04 0.00 0.00 61.00 59.67 3d7l s PRO 144 Cb -0.22 -0.15 0.00 0.00 0.04 0.00 0.00 34.50 34.17 3d7l s PRO 144 CO -0.00 -0.08 0.00 0.54 0.04 0.00 0.00 177.00 177.50 3d7l n ARG 145 N -0.10 -1.95 -1.02 4.56 1.74 -1.26 -2.18 116.66 116.44 3d7l n ARG 145 Ca -0.10 0.81 -0.01 0.00 -0.77 0.00 0.00 57.85 57.78 3d7l n ARG 145 Cb 0.62 -5.45 -0.00 0.00 -1.02 0.00 0.00 32.46 26.61 3d7l n ARG 145 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3d7l n GLY 146 N -0.91 0.48 3.76 -0.13 0.00 -1.26 -0.13 105.19 107.00 3d7l n GLY 146 Ca -0.20 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.13 3d7l n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d7l s ILE 147 N -1.94 2.78 0.21 -0.61 1.01 -0.93 -4.17 121.20 117.56 3d7l s ILE 147 Ca 0.00 0.75 0.08 0.00 0.00 0.00 0.00 60.65 61.48 3d7l s ILE 147 Cb 0.00 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 3d7l s ILE 147 CO 0.00 0.17 0.01 -0.13 0.00 0.00 0.00 174.94 174.99 3d7l s ARG 148 N -1.42 2.41 -0.12 2.79 0.52 0.25 -4.80 118.95 118.59 3d7l s ARG 148 Ca 0.51 -1.20 -0.05 0.00 -0.52 0.00 0.00 55.73 54.47 3d7l s ARG 148 Cb -0.39 -2.31 0.06 0.00 0.52 0.00 0.00 34.95 32.82 3d7l s ARG 148 CO 0.50 0.42 0.25 -1.50 0.02 0.00 0.00 175.30 174.99 3d7l s ILE 149 N -1.94 -0.24 0.27 1.52 2.07 -1.26 -0.02 121.20 121.60 3d7l s ILE 149 Ca 0.29 0.22 0.03 0.00 -1.41 0.00 0.00 60.65 59.78 3d7l s ILE 149 Cb -0.08 -0.41 -0.06 0.00 0.13 0.00 0.00 42.46 42.04 3d7l s ILE 149 CO 0.19 0.09 0.05 0.20 -1.91 0.00 0.00 174.94 173.57 3d7l s ASN 150 N 1.89 1.75 0.13 4.50 0.01 -0.75 -0.49 114.94 121.99 3d7l s ASN 150 Ca -0.03 -1.32 0.09 0.00 -0.71 0.00 0.00 52.86 50.89 3d7l s ASN 150 Cb -0.11 0.04 -0.04 0.00 0.41 0.00 0.00 41.25 41.55 3d7l s ASN 150 CO -0.08 -0.62 -0.22 0.42 -1.51 0.00 0.00 177.10 175.09 3d7l s THR 151 N -3.51 1.93 -0.14 1.60 -4.23 0.54 -1.78 115.64 110.07 3d7l s THR 151 Ca 0.34 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 59.11 3d7l s THR 151 Cb 0.07 -1.79 -0.01 0.00 1.34 0.00 0.00 72.50 72.12 3d7l s THR 151 CO 0.12 -0.10 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.26 3d7l s VAL 152 N -1.42 2.77 -0.36 2.29 1.01 -0.27 -0.59 120.40 123.84 3d7l s VAL 152 Ca 0.12 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.37 3d7l s VAL 152 Cb -0.09 -2.16 0.10 0.00 0.00 0.00 0.00 36.38 34.24 3d7l s VAL 152 CO 0.06 0.52 0.09 -0.55 0.00 0.00 0.00 175.10 175.22 3d7l s SER 153 N 0.54 4.91 0.32 3.32 0.15 -0.13 -0.53 113.70 122.28 3d7l s SER 153 Ca -0.10 -2.06 -0.08 0.00 0.70 0.00 0.00 55.95 54.41 3d7l s SER 153 Cb -0.16 -1.69 -0.06 0.00 -1.71 0.00 0.00 66.02 62.40 3d7l s SER 153 CO 0.04 -0.42 0.64 -2.16 1.20 0.00 0.00 173.24 172.54 3d7l s PRO 154 N 0.99 3.74 0.97 5.44 0.05 -1.26 -0.75 135.00 144.18 3d7l s PRO 154 Ca 0.09 0.27 -0.15 0.00 0.05 0.00 0.00 61.00 61.26 3d7l s PRO 154 Cb -0.20 -2.54 0.18 0.00 0.05 0.00 0.00 34.50 31.99 3d7l s PRO 154 CO -0.06 0.14 1.20 1.21 0.05 0.00 0.00 177.00 179.53 3d7l s ASN 155 N -2.95 3.04 0.27 6.66 3.84 -0.73 -0.96 114.94 124.11 3d7l s ASN 155 Ca 0.48 0.65 -0.30 0.00 0.21 0.00 0.00 52.86 53.90 3d7l s ASN 155 Cb -0.11 -0.98 -0.14 0.00 -0.55 0.00 0.00 41.25 39.48 3d7l s ASN 155 CO 0.28 -2.81 1.21 0.55 -2.79 0.00 0.00 177.10 173.54 3d7l n VAL 156 N -3.89 1.54 -2.89 -5.21 3.14 -1.26 -4.75 118.33 105.01 3d7l n VAL 156 Ca 0.11 -0.38 -0.40 0.00 -2.96 0.00 0.00 64.34 60.70 3d7l n VAL 156 Cb 0.60 -1.25 -0.05 0.00 -1.06 0.00 0.00 33.84 32.07 3d7l n VAL 156 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3d7l s LEU 157 N 0.02 4.55 0.27 6.55 1.43 -1.26 -1.00 118.68 129.24 3d7l s LEU 157 Ca 0.63 1.68 0.01 0.00 -1.03 0.00 0.00 54.13 55.41 3d7l s LEU 157 Cb -0.68 -3.39 0.61 0.00 0.03 0.00 0.00 46.19 42.76 3d7l s LEU 157 CO 0.56 0.10 1.73 -0.33 0.23 0.00 0.00 176.35 178.64 3d7l h GLU 158 N 4.84 0.47 0.00 1.70 5.08 -1.14 0.47 114.58 126.01 3d7l h GLU 158 Ca -0.45 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3d7l h GLU 158 Cb 1.21 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.35 3d7l h GLU 158 CO 0.69 0.31 0.00 -0.85 -1.00 0.00 0.00 179.01 178.16 3d7l n GLU 159 N -4.98 0.25 0.00 2.33 0.00 -1.26 -1.97 120.64 115.01 3d7l n GLU 159 Ca 0.19 0.11 0.05 0.00 0.00 0.00 0.00 57.16 57.51 3d7l n GLU 159 Cb 0.53 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.48 3d7l n GLU 159 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 3d7l n SER 160 N -1.30 1.34 -0.23 -1.84 7.64 0.01 -4.77 113.62 114.48 3d7l n SER 160 Ca 0.09 -1.17 -0.00 0.00 1.01 0.00 0.00 58.87 58.80 3d7l n SER 160 Cb 0.15 0.35 0.23 0.00 -1.01 0.00 0.00 64.21 63.93 3d7l n SER 160 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 3d7l h TRP 161 N 1.27 0.97 -0.79 1.43 -0.00 -0.51 0.99 115.95 119.32 3d7l h TRP 161 Ca 0.00 0.01 0.14 0.00 -0.00 0.00 0.00 58.89 59.05 3d7l h TRP 161 Cb 0.34 -0.33 -0.14 0.00 -0.00 0.00 0.00 29.16 29.03 3d7l h TRP 161 CO 0.00 0.63 -0.29 0.38 -0.00 0.00 0.00 178.44 179.16 3d7l h ASP 162 N 1.04 -1.04 0.44 2.65 3.04 -1.86 -0.14 116.42 120.54 3d7l h ASP 162 Ca 0.28 0.26 -0.30 0.00 -3.24 0.00 0.00 57.03 54.02 3d7l h ASP 162 Cb -0.09 0.59 -0.04 0.00 -1.04 0.00 0.00 39.33 38.75 3d7l h ASP 162 CO -0.06 -0.29 -1.71 0.07 -2.04 0.00 0.00 179.24 175.22 3d7l h LYS 163 N -0.05 0.09 0.00 4.15 2.10 -1.69 -3.40 116.57 117.77 3d7l h LYS 163 Ca 0.33 -0.16 0.00 0.00 -2.00 0.00 0.00 60.65 58.83 3d7l h LYS 163 Cb 0.59 0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 3d7l h LYS 163 CO -0.83 0.77 -0.57 1.28 -2.00 0.00 0.00 179.45 178.09 3d7l n LEU 164 N -3.21 0.55 -0.25 7.07 4.77 0.26 -4.42 117.00 121.77 3d7l n LEU 164 Ca -0.19 0.02 0.04 0.00 -0.03 0.00 0.00 56.01 55.85 3d7l n LEU 164 Cb 1.04 -0.22 0.17 0.00 -2.33 0.00 0.00 43.42 42.08 3d7l n LEU 164 CO 0.45 0.09 1.02 -0.08 -1.33 0.00 0.00 177.39 177.55 3d7l h GLU 165 N 0.00 0.45 -0.16 3.23 4.81 -1.23 -1.91 114.58 119.77 3d7l h GLU 165 Ca 0.00 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.25 3d7l h GLU 165 Cb 0.56 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 3d7l h GLU 165 CO 0.00 0.29 0.26 -1.35 -0.73 0.00 0.00 179.01 177.48 3d7l h PRO 166 N 0.46 0.00 0.00 0.92 0.11 -1.86 -1.63 132.00 130.00 3d7l h PRO 166 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3d7l h PRO 166 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3d7l h PRO 166 CO -0.37 0.00 -1.03 1.19 -0.21 0.00 0.00 178.00 177.58 3d7l n PHE 167 N -3.46 0.07 -2.49 0.65 3.72 -0.73 -4.44 117.46 110.78 3d7l n PHE 167 Ca 0.01 0.02 -0.11 0.00 -0.05 0.00 0.00 57.45 57.32 3d7l n PHE 167 Cb 0.36 -0.21 0.04 0.00 -0.94 0.00 0.00 39.48 38.73 3d7l n PHE 167 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3d7l n PHE 168 N -1.71 1.93 -1.72 1.38 3.01 -0.64 -4.77 117.46 114.95 3d7l n PHE 168 Ca 0.03 -2.24 -0.43 0.00 1.01 0.00 0.00 57.45 55.82 3d7l n PHE 168 Cb 0.39 -0.28 -0.03 0.00 -0.01 0.00 0.00 39.48 39.55 3d7l n PHE 168 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3d7l n GLU 169 N -0.61 2.65 -0.55 -1.08 1.02 -1.06 -1.28 120.64 119.72 3d7l n GLU 169 Ca 0.23 0.95 0.00 0.00 -0.02 0.00 0.00 57.16 58.32 3d7l n GLU 169 Cb 0.86 -2.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.52 3d7l n GLU 169 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d7l n GLY 170 N 3.22 1.48 3.84 0.62 0.00 -1.26 -5.03 105.19 108.05 3d7l n GLY 170 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 3d7l n GLY 170 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d7l s PHE 171 N -3.39 3.19 -0.28 1.61 0.08 -0.40 -5.06 117.98 113.72 3d7l s PHE 171 Ca 0.00 1.23 0.02 0.00 0.12 0.00 0.00 56.93 58.31 3d7l s PHE 171 Cb 0.00 -2.96 0.07 0.00 -0.57 0.00 0.00 43.02 39.56 3d7l s PHE 171 CO 0.00 -1.26 -0.06 -1.17 -0.10 0.00 0.00 175.22 172.63 3d7l s LEU 172 N -5.50 3.80 0.72 -0.37 2.96 -1.26 -5.12 118.68 113.91 3d7l s LEU 172 Ca 0.58 -1.54 -0.11 0.00 -0.22 0.00 0.00 54.13 52.85 3d7l s LEU 172 Cb -0.13 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 44.99 3d7l s LEU 172 CO 0.54 -0.24 1.07 -2.16 -1.32 0.00 0.00 176.35 174.23 3d7l s PRO 173 N 1.09 2.71 0.07 0.98 0.04 -1.26 -4.86 135.00 133.76 3d7l s PRO 173 Ca -0.04 0.98 0.07 0.00 0.04 0.00 0.00 61.00 62.04 3d7l s PRO 173 Cb -0.20 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 3d7l s PRO 173 CO -0.05 -1.27 -0.13 0.14 0.04 0.00 0.00 177.00 175.73 3d7l s VAL 174 N -3.02 3.19 0.28 -0.36 -7.23 -0.17 -4.67 120.40 108.42 3d7l s VAL 174 Ca 0.59 -1.18 -0.29 0.00 -1.81 0.00 0.00 61.98 59.29 3d7l s VAL 174 Cb -0.15 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.27 3d7l s VAL 174 CO 0.55 0.23 1.32 -2.84 -0.31 0.00 0.00 175.10 174.06 3d7l s PRO 175 N -1.82 4.36 0.31 4.82 0.02 -1.26 -0.63 135.00 140.80 3d7l s PRO 175 Ca 0.18 2.17 0.04 0.00 0.02 0.00 0.00 61.00 63.41 3d7l s PRO 175 Cb -0.11 -3.12 0.65 0.00 0.02 0.00 0.00 34.50 31.94 3d7l s PRO 175 CO 0.10 -0.23 1.85 0.00 -0.33 0.00 0.00 177.00 178.38 3d7l h ALA 176 N 4.29 1.63 -0.97 -1.55 0.00 -1.95 -0.65 119.26 120.06 3d7l h ALA 176 Ca -0.47 0.02 0.22 0.00 0.00 0.00 0.00 54.91 54.68 3d7l h ALA 176 Cb 1.22 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 3d7l h ALA 176 CO 0.71 0.13 0.63 0.00 0.00 0.00 0.00 179.25 180.72 3d7l h ALA 177 N 1.56 2.12 -0.09 0.00 0.00 -1.90 -0.60 119.26 120.35 3d7l h ALA 177 Ca 0.48 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 55.28 3d7l h ALA 177 Cb 0.56 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.34 3d7l h ALA 177 CO -0.24 -0.46 -0.53 -0.22 0.00 0.00 0.00 179.25 177.80 3d7l h LYS 178 N 0.47 0.51 -0.57 0.00 3.64 -1.49 -3.07 116.57 116.06 3d7l h LYS 178 Ca 0.53 -0.43 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 3d7l h LYS 178 Cb 1.22 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 33.11 3d7l h LYS 178 CO -0.25 1.07 0.38 0.28 -2.27 0.00 0.00 179.45 178.66 3d7l h VAL 179 N 0.10 1.14 0.00 2.00 2.07 -1.21 -2.70 116.25 117.64 3d7l h VAL 179 Ca -0.04 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 3d7l h VAL 179 Cb 1.18 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3d7l h VAL 179 CO 0.11 0.14 -0.17 0.00 0.02 0.00 0.00 177.57 177.66 3d7l h ALA 180 N 1.65 1.66 -0.90 1.67 0.00 -1.03 -1.95 119.26 120.35 3d7l h ALA 180 Ca 0.21 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3d7l h ALA 180 Cb -0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3d7l h ALA 180 CO -0.05 0.22 0.59 0.00 0.00 0.00 0.00 179.25 180.01 3d7l h ARG 181 N 0.00 1.19 -0.73 0.00 3.08 -1.43 -1.45 114.38 115.03 3d7l h ARG 181 Ca -0.00 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 3d7l h ARG 181 Cb 0.32 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 3d7l h ARG 181 CO 0.02 0.79 0.34 0.00 -1.07 0.00 0.00 179.97 180.05 3d7l h ALA 182 N 1.43 0.95 -0.34 0.04 0.00 -1.44 0.23 119.26 120.13 3d7l h ALA 182 Ca 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3d7l h ALA 182 Cb -0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 3d7l h ALA 182 CO -0.07 0.52 0.18 0.74 0.00 0.00 0.00 179.25 180.62 3d7l h PHE 183 N 1.03 0.47 -0.86 0.00 0.04 -1.45 0.38 116.94 116.56 3d7l h PHE 183 Ca 0.25 -0.01 0.04 0.00 2.80 0.00 0.00 57.97 61.04 3d7l h PHE 183 Cb 0.14 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.09 3d7l h PHE 183 CO 0.01 0.38 0.55 1.49 -0.60 0.00 0.00 178.31 180.14 3d7l h GLU 184 N 0.42 1.03 -0.42 1.51 4.81 -0.91 -0.20 114.58 120.82 3d7l h GLU 184 Ca 0.12 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 3d7l h GLU 184 Cb 0.07 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 3d7l h GLU 184 CO -0.02 0.68 0.20 -0.22 -0.73 0.00 0.00 179.01 178.93 3d7l h LYS 185 N 1.06 0.40 -0.37 1.92 3.64 -0.30 0.37 116.57 123.29 3d7l h LYS 185 Ca 0.35 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 3d7l h LYS 185 Cb 0.03 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 3d7l h LYS 185 CO -0.12 0.26 0.17 1.03 -2.27 0.00 0.00 179.45 178.52 3d7l h SER 186 N 0.41 0.49 -0.21 4.20 0.87 -0.31 0.22 113.55 119.22 3d7l h SER 186 Ca 0.18 -0.14 -0.12 0.00 -1.23 0.00 0.00 61.79 60.48 3d7l h SER 186 Cb 0.10 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3d7l h SER 186 CO -0.13 0.49 -0.33 0.58 -0.53 0.00 0.00 176.83 176.91 3d7l h VAL 187 N 0.45 1.33 0.00 2.23 2.07 -0.84 -3.37 116.25 118.12 3d7l h VAL 187 Ca 0.12 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 66.10 3d7l h VAL 187 Cb 0.14 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3d7l h VAL 187 CO -0.01 0.48 -1.92 0.49 0.02 0.00 0.00 177.57 176.62 3d7l n PHE 188 N -4.31 0.00 -0.55 1.57 3.72 0.10 -4.92 117.46 113.07 3d7l n PHE 188 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 3d7l n PHE 188 Cb 0.49 -0.46 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 3d7l n PHE 188 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3d7l n GLY 189 N 1.35 -1.61 0.23 1.37 0.00 0.06 -5.05 105.19 101.55 3d7l n GLY 189 Ca -0.04 -1.56 0.02 0.00 0.00 0.00 0.00 46.02 44.44 3d7l n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d7l n ALA 190 N -3.00 1.75 -2.32 4.61 0.00 -1.26 -4.95 120.51 115.34 3d7l n ALA 190 Ca 0.00 -1.11 -0.26 0.00 0.00 0.00 0.00 53.44 52.06 3d7l n ALA 190 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.17 3d7l n ALA 190 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3d7l s GLN 191 N -0.57 3.42 0.06 0.00 -0.21 -1.26 -5.09 119.66 116.00 3d7l s GLN 191 Ca 0.05 0.03 -0.10 0.00 0.02 0.00 0.00 55.36 55.37 3d7l s GLN 191 Cb 0.04 -2.42 0.00 0.00 1.00 0.00 0.00 33.01 31.64 3d7l s GLN 191 CO 0.00 -0.21 0.21 -0.08 -2.12 0.00 0.00 175.29 173.10 3d7l s THR 192 N -2.69 0.12 -0.54 -0.19 -1.32 -1.26 -4.63 115.64 105.13 3d7l s THR 192 Ca 0.47 -0.95 0.00 0.00 -1.21 0.00 0.00 61.69 60.00 3d7l s THR 192 Cb -0.10 -1.07 0.00 0.00 -1.51 0.00 0.00 72.50 69.82 3d7l s THR 192 CO 0.43 -0.53 0.00 0.61 -2.21 0.00 0.00 174.62 172.92 3d7l n GLY 193 N 0.39 0.74 3.88 6.08 0.00 0.36 -4.96 105.19 111.68 3d7l n GLY 193 Ca -0.17 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 3d7l n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d7l s GLU 194 N -1.96 3.64 -0.32 1.61 0.41 -1.26 -4.61 118.70 116.22 3d7l s GLU 194 Ca 0.00 -0.02 -0.04 0.00 -0.41 0.00 0.00 54.97 54.50 3d7l s GLU 194 Cb 0.00 -2.97 0.04 0.00 -1.78 0.00 0.00 34.13 29.42 3d7l s GLU 194 CO 0.00 0.56 0.05 0.45 -0.49 0.00 0.00 175.26 175.83 3d7l s SER 195 N -2.00 5.08 -0.56 -0.19 0.15 -1.26 -0.34 113.70 114.58 3d7l s SER 195 Ca 0.34 -1.15 -0.19 0.00 0.70 0.00 0.00 55.95 55.65 3d7l s SER 195 Cb -0.13 -1.80 0.08 0.00 -1.71 0.00 0.00 66.02 62.47 3d7l s SER 195 CO 0.20 -0.28 0.69 -0.31 1.20 0.00 0.00 173.24 174.74 3d7l s TYR 196 N 1.34 2.99 0.02 3.44 2.02 0.24 -4.96 117.35 122.45 3d7l s TYR 196 Ca -0.03 -0.77 -0.29 0.00 -0.37 0.00 0.00 57.07 55.62 3d7l s TYR 196 Cb -0.19 -3.86 -0.04 0.00 -0.40 0.00 0.00 41.96 37.47 3d7l s TYR 196 CO 0.01 -1.22 0.91 -0.65 -1.57 0.00 0.00 175.55 173.03 3d7l s GLN 197 N 2.77 4.57 -0.70 -0.62 -0.21 -1.26 -0.95 119.66 123.25 3d7l s GLN 197 Ca 0.14 1.32 0.05 0.00 0.02 0.00 0.00 55.36 56.88 3d7l s GLN 197 Cb -0.22 -3.43 0.17 0.00 1.00 0.00 0.00 33.01 30.53 3d7l s GLN 197 CO 0.09 0.07 0.49 0.08 -2.12 0.00 0.00 175.29 173.90 3d7l s VAL 198 N 0.62 2.89 -1.92 1.09 1.01 0.07 -4.92 120.40 119.24 3d7l s VAL 198 Ca 0.47 -4.27 0.15 0.00 0.00 0.00 0.00 61.98 58.33 3d7l s VAL 198 Cb -0.21 -2.90 0.12 0.00 0.00 0.00 0.00 36.38 33.39 3d7l s VAL 198 CO 0.27 -1.01 0.99 -1.22 0.00 0.00 0.00 175.10 174.13