#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d7l s ILE 3 N 0.00 1.46 -0.28 3.15 1.01 0.19 -0.61 121.20 126.12 3d7l s ILE 3 Ca 0.00 -0.67 -0.18 0.00 0.00 0.00 0.00 60.65 59.81 3d7l s ILE 3 Cb 0.00 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.14 3d7l s ILE 3 CO 0.00 0.43 0.52 -0.22 0.00 0.00 0.00 174.94 175.66 3d7l s LEU 4 N 0.59 4.10 -0.26 2.97 2.96 0.62 -0.19 118.68 129.47 3d7l s LEU 4 Ca -0.15 0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 54.14 3d7l s LEU 4 Cb -0.16 -2.65 0.02 0.00 0.50 0.00 0.00 46.19 43.90 3d7l s LEU 4 CO 0.05 -0.33 -0.03 -0.22 -1.32 0.00 0.00 176.35 174.50 3d7l s LEU 5 N 2.34 3.33 -0.25 -0.68 2.96 -0.32 0.10 118.68 126.16 3d7l s LEU 5 Ca 0.21 -0.83 -0.10 0.00 -0.22 0.00 0.00 54.13 53.18 3d7l s LEU 5 Cb -0.16 -1.71 -0.05 0.00 0.50 0.00 0.00 46.19 44.78 3d7l s LEU 5 CO 0.10 -0.14 0.16 -0.63 -1.32 0.00 0.00 176.35 174.52 3d7l s ILE 6 N 1.36 5.26 0.00 6.68 1.01 0.17 -0.50 121.20 135.19 3d7l s ILE 6 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.80 3d7l s ILE 6 Cb -0.17 -3.46 0.00 0.00 0.01 0.00 0.00 42.46 38.84 3d7l s ILE 6 CO -0.03 0.33 0.00 0.61 0.00 0.00 0.00 174.94 175.85 3d7l n GLY 7 N 4.48 1.56 0.30 6.18 0.00 0.11 -0.79 105.19 117.03 3d7l n GLY 7 Ca -0.15 -0.22 0.17 0.00 0.00 0.00 0.00 46.02 45.82 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 1.14 0.00 4.61 0.00 -1.73 -2.90 119.26 120.38 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 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3d7l h ALA 8 CO 0.00 0.05 -0.67 -1.13 0.00 0.00 0.00 179.25 177.50 3d7l n SER 9 N -3.34 0.64 -4.60 0.00 3.41 -1.26 -2.33 113.62 106.14 3d7l n SER 9 Ca -0.02 -0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.30 3d7l n SER 9 Cb 0.18 0.29 0.20 0.00 -0.26 0.00 0.00 64.21 64.63 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 -3.53 1.56 0.14 5.00 0.00 -1.10 -4.75 107.32 104.64 3d7l s GLY 10 Ca 0.07 -0.22 -0.21 0.00 0.00 0.00 0.00 44.72 44.35 3d7l s GLY 10 CO 0.73 0.42 1.67 -0.84 0.00 0.00 0.00 173.10 175.08 3d7l h THR 11 N -2.17 0.61 -0.10 0.90 2.02 -1.91 0.19 112.91 112.45 3d7l h THR 11 Ca -0.57 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.45 3d7l h THR 11 Cb 1.33 0.61 0.01 0.00 -1.74 0.00 0.00 68.15 68.36 3d7l h THR 11 CO 0.54 0.00 -0.56 0.25 0.37 0.00 0.00 175.52 176.12 3d7l h LEU 12 N -0.14 0.67 -0.61 2.58 5.85 -1.92 -3.12 115.31 118.62 3d7l h LEU 12 Ca 0.11 -0.65 0.11 0.00 0.84 0.00 0.00 57.88 58.29 3d7l h LEU 12 Cb 0.30 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 41.05 3d7l h LEU 12 CO -0.26 1.21 0.16 1.23 -0.34 0.00 0.00 178.44 180.43 3d7l h GLY 13 N 0.18 0.81 1.28 3.75 0.00 -1.65 -0.95 103.07 106.50 3d7l h GLY 13 Ca -0.04 -0.05 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 3d7l h GLY 13 CO 0.11 -0.10 -0.41 1.48 0.00 0.00 0.00 176.54 177.62 3d7l h SER 14 N 0.29 0.84 -0.40 0.19 4.64 -0.54 0.86 113.55 119.43 3d7l h SER 14 Ca 0.32 -0.39 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 3d7l h SER 14 Cb 0.47 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 3d7l h SER 14 CO -0.39 1.14 0.21 0.00 -0.87 0.00 0.00 176.83 176.92 3d7l h ALA 15 N 0.90 0.52 -0.27 5.18 0.00 -1.45 -0.06 119.26 124.08 3d7l h ALA 15 Ca 0.05 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.91 3d7l h ALA 15 Cb 0.97 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 3d7l h ALA 15 CO 0.09 0.06 0.02 0.28 0.00 0.00 0.00 179.25 179.70 3d7l h VAL 16 N 0.51 0.83 -0.46 0.00 2.07 -1.02 -2.67 116.25 115.51 3d7l h VAL 16 Ca 0.14 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.71 3d7l h VAL 16 Cb 0.09 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.50 3d7l h VAL 16 CO -0.02 0.02 -0.01 0.50 0.02 0.00 0.00 177.57 178.08 3d7l h LYS 17 N 0.10 0.10 -0.88 1.57 3.64 -0.36 -2.02 116.57 118.72 3d7l h LYS 17 Ca 0.13 -0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.63 3d7l h LYS 17 Cb 0.16 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 31.87 3d7l h LYS 17 CO -0.20 0.06 0.50 0.93 -2.27 0.00 0.00 179.45 178.47 3d7l h GLU 18 N 0.10 0.73 -0.05 1.90 5.08 -0.68 -0.48 114.58 121.18 3d7l h GLU 18 Ca 0.23 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.41 3d7l h GLU 18 Cb 0.34 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.43 3d7l h GLU 18 CO -0.39 0.48 -0.50 0.00 -1.00 0.00 0.00 179.01 177.60 3d7l h ARG 19 N 0.75 0.43 -0.23 2.33 3.08 -1.27 -3.36 114.38 116.12 3d7l h ARG 19 Ca 0.46 -0.39 -0.17 0.00 0.07 0.00 0.00 59.98 59.94 3d7l h ARG 19 Cb 0.55 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 3d7l h ARG 19 CO -0.31 1.04 -0.55 -0.07 -1.07 0.00 0.00 179.97 179.01 3d7l h LEU 20 N -0.04 0.77 -1.49 3.04 3.38 -1.04 -3.11 115.31 116.81 3d7l h LEU 20 Ca -0.05 -0.41 0.28 0.00 0.09 0.00 0.00 57.88 57.78 3d7l h LEU 20 Cb 1.18 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 3d7l h LEU 20 CO 0.10 1.17 0.69 -0.33 0.09 0.00 0.00 178.44 180.16 3d7l h GLU 21 N 0.53 0.31 0.00 1.13 5.08 -1.24 -0.14 114.58 120.25 3d7l h GLU 21 Ca 0.01 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 3d7l h GLU 21 Cb 1.13 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 3d7l h GLU 21 CO 0.11 0.20 -0.14 0.87 -1.00 0.00 0.00 179.01 179.06 3d7l h LYS 22 N 0.32 0.00 0.00 2.33 6.56 -1.69 -3.31 116.57 120.77 3d7l h LYS 22 Ca 0.58 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.17 3d7l h LYS 22 Cb 1.62 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.28 3d7l h LYS 22 CO -0.24 0.14 -0.21 1.63 -2.06 0.00 0.00 179.45 178.71 3d7l n LYS 23 N -4.05 5.38 -3.80 3.15 5.02 -0.23 -5.07 118.16 118.56 3d7l n LYS 23 Ca -0.02 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.17 3d7l n LYS 23 Cb 0.22 -0.59 -0.07 0.00 -0.02 0.00 0.00 35.03 34.57 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 -1.18 -0.41 -0.13 7.82 0.00 -0.23 -5.01 121.76 122.61 3d7l s ALA 24 Ca 0.00 -0.44 -0.29 0.00 0.00 0.00 0.00 51.96 51.22 3d7l s ALA 24 Cb 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.61 3d7l s ALA 24 CO 0.00 -0.53 1.26 -2.00 0.00 0.00 0.00 175.76 174.49 3d7l s GLU 25 N -3.71 4.27 -0.22 0.00 2.12 -1.26 -4.33 118.70 115.57 3d7l s GLU 25 Ca 0.03 1.69 -0.05 0.00 0.36 0.00 0.00 54.97 57.00 3d7l s GLU 25 Cb 0.04 -3.70 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 3d7l s GLU 25 CO -0.10 -0.63 -0.01 0.08 -0.54 0.00 0.00 175.26 174.05 3d7l s VAL 26 N 3.11 3.71 -0.23 3.70 1.01 -1.26 0.53 120.40 130.97 3d7l s VAL 26 Ca 0.56 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 62.05 3d7l s VAL 26 Cb -0.23 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 3d7l s VAL 26 CO 0.17 0.41 0.14 -0.63 0.00 0.00 0.00 175.10 175.20 3d7l s ILE 27 N 1.34 5.27 0.05 2.22 -1.09 0.74 -4.96 121.20 124.77 3d7l s ILE 27 Ca 0.04 0.15 -0.05 0.00 -2.23 0.00 0.00 60.65 58.56 3d7l s ILE 27 Cb -0.15 -3.45 -0.05 0.00 -1.58 0.00 0.00 42.46 37.24 3d7l s ILE 27 CO -0.00 0.37 0.28 0.42 -1.23 0.00 0.00 174.94 174.78 3d7l s THR 28 N 0.93 5.29 0.01 2.92 -4.23 -1.26 -1.17 115.64 118.12 3d7l s THR 28 Ca 0.07 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.63 3d7l s THR 28 Cb -0.13 -3.59 -0.01 0.00 1.34 0.00 0.00 72.50 70.11 3d7l s THR 28 CO 0.03 0.25 -0.02 0.00 -0.54 0.00 0.00 174.62 174.35 3d7l s ALA 29 N -1.42 0.08 0.29 3.99 0.00 0.35 -1.69 121.76 123.36 3d7l s ALA 29 Ca 0.32 -0.36 -0.20 0.00 0.00 0.00 0.00 51.96 51.72 3d7l s ALA 29 Cb -0.13 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.13 3d7l s ALA 29 CO 0.20 -0.09 0.83 0.20 0.00 0.00 0.00 175.76 176.89 3d7l s GLY 30 N -0.88 0.09 0.10 0.00 0.00 -0.87 0.09 107.32 105.86 3d7l s GLY 30 Ca -0.10 -0.42 -0.12 0.00 0.00 0.00 0.00 44.72 44.09 3d7l s GLY 30 CO -0.01 0.17 1.29 -0.09 0.00 0.00 0.00 173.10 174.46 3d7l h ARG 31 N 2.00 0.73 -0.00 2.90 2.43 -1.89 -0.27 114.38 120.27 3d7l h ARG 31 Ca -0.26 -0.64 0.00 0.00 -0.81 0.00 0.00 59.98 58.27 3d7l h ARG 31 Cb 1.24 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.94 3d7l h ARG 31 CO 0.32 1.25 -0.10 0.72 -1.51 0.00 0.00 179.97 180.64 3d7l n HIS 32 N -3.90 0.00 -4.16 2.20 8.25 -1.26 -4.54 115.22 111.81 3d7l n HIS 32 Ca -0.08 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.25 3d7l n HIS 32 Cb 0.78 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.81 3d7l n HIS 32 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3d7l s SER 33 N -1.06 0.35 0.00 0.41 1.04 -1.26 -5.10 113.70 108.07 3d7l s SER 33 Ca 0.01 -1.35 0.00 0.00 0.48 0.00 0.00 55.95 55.10 3d7l s SER 33 Cb 0.02 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.61 3d7l s SER 33 CO 0.10 -0.97 0.00 0.61 0.98 0.00 0.00 173.24 173.96 3d7l n GLY 34 N -0.36 2.26 0.34 7.32 0.00 -1.26 -2.05 105.19 111.44 3d7l n GLY 34 Ca 0.02 -2.06 0.11 0.00 0.00 0.00 0.00 46.02 44.09 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 0.32 -4.25 1.61 3.32 -1.71 -3.41 116.42 112.30 3d7l h ASP 35 Ca 0.00 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.65 3d7l h ASP 35 Cb 0.00 -0.07 -0.26 0.00 0.22 0.00 0.00 39.33 39.22 3d7l h ASP 35 CO 0.00 0.20 -0.78 -0.69 -1.72 0.00 0.00 179.24 176.25 3d7l s VAL 36 N -5.34 0.85 0.07 -1.35 1.01 -0.76 -5.00 120.40 109.87 3d7l s VAL 36 Ca -0.07 -0.73 -0.03 0.00 0.00 0.00 0.00 61.98 61.15 3d7l s VAL 36 Cb 0.19 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 3d7l s VAL 36 CO 0.73 0.04 0.26 0.42 0.00 0.00 0.00 175.10 176.56 3d7l s THR 37 N -0.63 5.32 -0.14 3.92 -4.23 -1.26 -3.12 115.64 115.49 3d7l s THR 37 Ca 0.01 -0.16 -0.10 0.00 -1.18 0.00 0.00 61.69 60.26 3d7l s THR 37 Cb -0.06 -3.61 0.05 0.00 1.34 0.00 0.00 72.50 70.22 3d7l s THR 37 CO 0.00 0.17 0.36 0.54 -0.54 0.00 0.00 174.62 175.15 3d7l s VAL 38 N -1.50 -0.02 -0.43 2.29 0.11 -0.11 -4.90 120.40 115.85 3d7l s VAL 38 Ca 0.35 0.06 -0.12 0.00 -2.93 0.00 0.00 61.98 59.34 3d7l s VAL 38 Cb -0.13 -0.53 0.06 0.00 -1.53 0.00 0.00 36.38 34.26 3d7l s VAL 38 CO 0.24 0.02 0.29 -0.62 -3.33 0.00 0.00 175.10 171.71 3d7l s ASP 39 N 0.83 5.83 0.60 3.54 2.15 -1.26 -3.28 116.67 125.08 3d7l s ASP 39 Ca -0.05 -1.33 0.38 0.00 0.43 0.00 0.00 52.55 51.98 3d7l s ASP 39 Cb -0.06 -2.06 1.86 0.00 -0.30 0.00 0.00 42.92 42.35 3d7l s ASP 39 CO -0.06 -0.54 2.17 0.16 -0.17 0.00 0.00 175.17 176.73 3d7l h ILE 40 N 5.92 0.03 -0.00 4.11 3.07 -1.94 0.12 117.51 128.81 3d7l h ILE 40 Ca -0.25 -0.29 0.00 0.00 1.55 0.00 0.00 64.86 65.87 3d7l h ILE 40 Cb 1.10 1.28 0.00 0.00 -0.27 0.00 0.00 36.82 38.92 3d7l h ILE 40 CO 0.78 0.01 -0.02 0.35 -1.05 0.00 0.00 178.15 178.22 3d7l n THR 41 N -3.11 0.00 -3.91 0.16 -2.24 -1.26 -4.40 114.28 99.51 3d7l n THR 41 Ca -0.01 -0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.41 3d7l n THR 41 Cb 0.20 -0.44 -0.14 0.00 -2.10 0.00 0.00 70.33 67.85 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 -2.47 4.51 0.19 3.42 3.84 0.41 -5.02 114.94 119.81 3d7l s ASN 42 Ca 0.32 -0.81 -0.13 0.00 0.21 0.00 0.00 52.86 52.45 3d7l s ASN 42 Cb 0.21 -1.72 0.10 0.00 -0.55 0.00 0.00 41.25 39.29 3d7l s ASN 42 CO 0.45 -0.14 1.85 -0.29 -2.79 0.00 0.00 177.10 176.18 3d7l h ILE 43 N 6.05 1.14 0.00 -5.21 2.10 -1.84 -1.42 117.51 118.34 3d7l h ILE 43 Ca -0.33 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.34 3d7l h ILE 43 Cb 1.11 0.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.11 3d7l h ILE 43 CO 0.58 0.15 -0.38 -2.24 -1.08 0.00 0.00 178.15 175.18 3d7l h ASP 44 N 0.80 0.00 -0.03 2.19 3.04 -1.95 -1.50 116.42 118.98 3d7l h ASP 44 Ca 0.23 -0.12 -0.00 0.00 -3.24 0.00 0.00 57.03 53.90 3d7l h ASP 44 Cb -0.07 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.21 3d7l h ASP 44 CO -0.06 0.06 0.01 -1.28 -2.04 0.00 0.00 179.24 175.94 3d7l h SER 45 N 0.00 0.03 -0.41 4.15 0.87 -1.73 0.12 113.55 116.58 3d7l h SER 45 Ca 0.00 -0.08 0.05 0.00 -1.23 0.00 0.00 61.79 60.53 3d7l h SER 45 Cb 0.76 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.67 3d7l h SER 45 CO 0.00 0.11 0.15 0.40 -0.53 0.00 0.00 176.83 176.96 3d7l h ILE 46 N -0.04 0.89 -0.25 2.23 2.04 -1.17 -2.77 117.51 118.44 3d7l h ILE 46 Ca 0.01 -0.11 0.04 0.00 1.00 0.00 0.00 64.86 65.79 3d7l h ILE 46 Cb 0.08 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 3d7l h ILE 46 CO -0.00 0.06 0.04 0.11 0.00 0.00 0.00 178.15 178.35 3d7l h LYS 47 N 0.32 0.12 -2.13 2.37 1.57 -1.17 -2.04 116.57 115.62 3d7l h LYS 47 Ca 0.19 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3d7l h LYS 47 Cb 0.16 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 3d7l h LYS 47 CO -0.18 0.08 -0.09 0.36 -0.57 0.00 0.00 179.45 179.04 3d7l n LYS 48 N -5.10 1.16 0.00 3.15 2.85 0.41 -1.50 118.16 119.13 3d7l n LYS 48 Ca -0.01 -0.40 0.00 0.00 -1.05 0.00 0.00 58.31 56.84 3d7l n LYS 48 Cb 0.11 -1.52 0.00 0.00 -0.65 0.00 0.00 35.03 32.97 3d7l n LYS 48 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3d7l n TYR 50 N 2.15 0.00 -0.13 5.58 4.01 -0.77 -2.17 117.16 125.83 3d7l n TYR 50 Ca 0.17 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.03 3d7l n TYR 50 Cb 0.55 0.00 0.46 0.00 -0.31 0.00 0.00 39.34 40.04 3d7l n TYR 50 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3d7l h GLU 51 N 0.00 0.49 0.04 -0.72 4.57 -1.54 -2.08 114.58 115.33 3d7l h GLU 51 Ca 0.00 -0.03 -0.24 0.00 -1.18 0.00 0.00 59.36 57.91 3d7l h GLU 51 Cb 0.00 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 3d7l h GLU 51 CO 0.00 0.32 -1.20 0.37 -1.18 0.00 0.00 179.01 177.32 3d7l h GLN 52 N 0.50 0.08 0.20 1.92 4.15 -1.70 -3.36 115.11 116.90 3d7l h GLN 52 Ca 0.32 -0.13 -0.32 0.00 0.77 0.00 0.00 58.65 59.29 3d7l h GLN 52 Cb 0.57 0.05 0.04 0.00 0.21 0.00 0.00 27.48 28.34 3d7l h GLN 52 CO -0.10 0.98 -1.38 0.28 -1.93 0.00 0.00 178.83 176.68 3d7l h VAL 53 N 0.02 1.28 0.00 2.39 2.07 -1.73 -3.50 116.25 116.78 3d7l h VAL 53 Ca -0.10 -2.59 0.00 0.00 0.82 0.00 0.00 66.70 64.83 3d7l h VAL 53 Cb 1.87 2.90 0.00 0.00 -1.52 0.00 0.00 31.29 34.54 3d7l h VAL 53 CO 0.14 0.78 0.00 0.61 0.02 0.00 0.00 177.57 179.12 3d7l n GLY 54 N 1.57 -1.82 3.75 2.17 0.00 -0.82 -4.92 105.19 105.13 3d7l n GLY 54 Ca -0.16 -1.57 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 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 4.51 0.15 1.61 -0.14 -1.26 -4.89 119.74 119.72 3d7l s LYS 55 Ca 0.00 1.94 0.00 0.00 -1.36 0.00 0.00 55.97 56.55 3d7l s LYS 55 Cb 0.00 -3.18 -0.04 0.00 -1.68 0.00 0.00 37.83 32.92 3d7l s LYS 55 CO 0.00 -0.02 0.03 0.14 -0.76 0.00 0.00 175.35 174.73 3d7l s VAL 56 N -0.64 0.42 -0.15 3.17 -7.23 -0.09 -4.96 120.40 110.92 3d7l s VAL 56 Ca 0.50 -1.94 0.21 0.00 -1.81 0.00 0.00 61.98 58.93 3d7l s VAL 56 Cb -0.34 -2.07 -0.15 0.00 0.56 0.00 0.00 36.38 34.37 3d7l s VAL 56 CO 0.42 -0.48 0.75 0.47 -0.31 0.00 0.00 175.10 175.94 3d7l n ASP 57 N -0.17 0.54 -3.79 4.85 9.92 0.22 -1.34 116.55 126.78 3d7l n ASP 57 Ca -0.06 0.22 -0.13 0.00 -0.53 0.00 0.00 54.79 54.29 3d7l n ASP 57 Cb 0.63 0.87 -0.10 0.00 -0.64 0.00 0.00 41.12 41.89 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 -3.24 -0.66 -0.20 2.24 0.00 -1.09 -1.79 121.76 117.02 3d7l s ALA 58 Ca -0.04 0.50 0.01 0.00 0.00 0.00 0.00 51.96 52.43 3d7l s ALA 58 Cb 0.10 -0.21 0.04 0.00 0.00 0.00 0.00 23.12 23.06 3d7l s ALA 58 CO 0.83 -0.18 -0.10 0.42 0.00 0.00 0.00 175.76 176.73 3d7l s ILE 59 N -0.54 1.67 -0.15 0.00 1.01 -0.21 -0.28 121.20 122.71 3d7l s ILE 59 Ca -0.06 -1.04 0.00 0.00 0.00 0.00 0.00 60.65 59.55 3d7l s ILE 59 Cb -0.04 -1.75 -0.00 0.00 0.01 0.00 0.00 42.46 40.68 3d7l s ILE 59 CO 0.02 0.16 -0.16 -0.69 0.00 0.00 0.00 174.94 174.27 3d7l s VAL 60 N 1.38 2.68 -0.33 2.92 1.01 0.11 -1.36 120.40 126.81 3d7l s VAL 60 Ca -0.02 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 3d7l s VAL 60 Cb -0.16 -2.12 0.04 0.00 0.00 0.00 0.00 36.38 34.13 3d7l s VAL 60 CO -0.08 0.52 0.09 -0.55 0.00 0.00 0.00 175.10 175.08 3d7l s SER 61 N 0.71 5.25 -0.50 3.32 0.15 0.80 -0.65 113.70 122.78 3d7l s SER 61 Ca -0.07 -1.17 0.03 0.00 0.70 0.00 0.00 55.95 55.44 3d7l s SER 61 Cb -0.16 -1.85 0.44 0.00 -1.71 0.00 0.00 66.02 62.74 3d7l s SER 61 CO 0.01 -0.32 1.52 0.00 1.20 0.00 0.00 173.24 175.66 3d7l n ALA 62 N 4.78 5.60 -4.30 5.45 0.00 0.03 -3.11 120.51 128.97 3d7l n ALA 62 Ca -0.12 -3.85 -0.20 0.00 0.00 0.00 0.00 53.44 49.27 3d7l n ALA 62 Cb 0.44 -0.99 -0.05 0.00 0.00 0.00 0.00 19.45 18.86 3d7l n ALA 62 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3d7l n THR 63 N -0.70 0.00 0.00 0.00 -2.24 -1.23 -4.56 114.28 105.55 3d7l n THR 63 Ca 0.50 -1.65 0.00 0.00 -2.27 0.00 0.00 64.05 60.63 3d7l n THR 63 Cb 0.73 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.45 3d7l n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d7l n GLY 64 N 0.41 3.35 3.88 3.38 0.00 -1.26 -4.82 105.19 110.13 3d7l n GLY 64 Ca -0.08 -1.07 -0.37 0.00 0.00 0.00 0.00 46.02 44.50 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 6.42 -0.05 1.61 0.01 -1.26 -4.62 113.70 115.80 3d7l s SER 65 Ca 0.00 0.50 0.03 0.00 1.31 0.00 0.00 55.95 57.79 3d7l s SER 65 Cb 0.00 -2.08 0.01 0.00 0.21 0.00 0.00 66.02 64.16 3d7l s SER 65 CO 0.00 0.39 -0.13 0.00 0.41 0.00 0.00 173.24 173.91 3d7l s ALA 66 N -1.06 1.27 0.14 1.44 0.00 -1.26 -2.10 121.76 120.20 3d7l s ALA 66 Ca 0.17 -0.48 -0.31 0.00 0.00 0.00 0.00 51.96 51.34 3d7l s ALA 66 Cb -0.12 -0.51 -0.11 0.00 0.00 0.00 0.00 23.12 22.38 3d7l s ALA 66 CO 0.06 0.16 1.83 0.99 0.00 0.00 0.00 175.76 178.80 3d7l s THR 67 N 0.42 2.41 -0.30 0.00 2.01 -1.26 -4.94 115.64 113.98 3d7l s THR 67 Ca -0.10 0.01 -0.11 0.00 0.31 0.00 0.00 61.69 61.80 3d7l s THR 67 Cb -0.13 -3.00 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 3d7l s THR 67 CO 0.03 0.00 0.18 -0.36 -0.69 0.00 0.00 174.62 173.78 3d7l s PHE 68 N 2.50 3.20 -0.23 4.92 0.40 -1.26 -4.26 117.98 123.25 3d7l s PHE 68 Ca 0.81 -0.14 -0.23 0.00 -0.60 0.00 0.00 56.93 56.77 3d7l s PHE 68 Cb -0.47 -2.38 0.06 0.00 0.51 0.00 0.00 43.02 40.74 3d7l s PHE 68 CO 0.36 -0.28 0.65 0.45 0.70 0.00 0.00 175.22 177.10 3d7l s SER 69 N 1.71 -0.67 0.58 1.36 0.15 -1.17 -5.08 113.70 110.58 3d7l s SER 69 Ca 0.06 1.27 -0.20 0.00 0.70 0.00 0.00 55.95 57.78 3d7l s SER 69 Cb -0.16 1.27 -0.04 0.00 -1.71 0.00 0.00 66.02 65.38 3d7l s SER 69 CO 0.09 -0.25 1.29 -2.65 1.20 0.00 0.00 173.24 172.92 3d7l n PRO 70 N 2.60 1.43 -0.16 5.44 -0.02 -1.26 -4.24 135.00 138.79 3d7l n PRO 70 Ca -0.14 0.53 -0.06 0.00 -2.02 0.00 0.00 63.50 61.81 3d7l n PRO 70 Cb 0.56 -2.50 0.03 0.00 -0.02 0.00 0.00 33.50 31.56 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 1.07 0.48 -0.63 2.45 5.85 -1.95 -0.16 115.31 122.42 3d7l h LEU 71 Ca -0.50 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.22 3d7l h LEU 71 Cb 1.32 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3d7l h LEU 71 CO 0.55 0.34 0.00 0.35 -0.34 0.00 0.00 178.44 179.34 3d7l n THR 72 N -4.80 1.16 0.41 1.05 -2.24 -1.26 -1.57 114.28 107.02 3d7l n THR 72 Ca 0.03 0.44 0.05 0.00 -2.27 0.00 0.00 64.05 62.29 3d7l n THR 72 Cb 0.06 -1.37 0.04 0.00 -2.10 0.00 0.00 70.33 66.96 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 -1.95 0.39 -2.41 -0.78 -0.58 -0.21 -4.92 120.64 110.18 3d7l n GLU 73 Ca 0.01 -1.10 -0.43 0.00 -0.42 0.00 0.00 57.16 55.23 3d7l n GLU 73 Cb 0.11 -1.19 -0.02 0.00 -0.57 0.00 0.00 31.44 29.77 3d7l n GLU 73 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 3d7l s LEU 74 N -0.83 3.55 0.28 -4.62 2.96 -0.42 -4.90 118.68 114.71 3d7l s LEU 74 Ca 0.12 0.62 0.01 0.00 -0.22 0.00 0.00 54.13 54.66 3d7l s LEU 74 Cb 0.08 -3.44 -0.04 0.00 0.50 0.00 0.00 46.19 43.30 3d7l s LEU 74 CO 0.12 -1.46 0.46 0.42 -1.32 0.00 0.00 176.35 174.58 3d7l s THR 75 N 5.36 5.16 0.43 3.68 -4.23 -1.26 -4.96 115.64 119.83 3d7l s THR 75 Ca 0.56 -0.52 0.24 0.00 -1.18 0.00 0.00 61.69 60.79 3d7l s THR 75 Cb -0.11 -3.82 0.44 0.00 1.34 0.00 0.00 72.50 70.35 3d7l s THR 75 CO 0.31 -0.38 1.75 -0.65 -0.54 0.00 0.00 174.62 175.10 3d7l h PRO 76 N 1.26 0.26 -0.10 3.99 0.11 -1.98 -0.84 132.00 134.70 3d7l h PRO 76 Ca -0.50 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 65.37 3d7l h PRO 76 Cb 1.21 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 32.27 3d7l h PRO 76 CO 0.63 0.17 -0.84 1.05 -0.21 0.00 0.00 178.00 178.81 3d7l h GLU 77 N 0.27 0.71 -0.75 1.05 9.09 -2.00 -1.78 114.58 121.17 3d7l h GLU 77 Ca 0.64 -0.62 -0.06 0.00 0.05 0.00 0.00 59.36 59.36 3d7l h GLU 77 Cb 1.84 0.14 -0.03 0.00 -1.65 0.00 0.00 28.75 29.06 3d7l h GLU 77 CO -0.27 1.23 0.23 0.87 0.05 0.00 0.00 179.01 181.11 3d7l h LYS 78 N 0.46 1.16 0.00 1.06 1.57 -1.70 -3.11 116.57 116.02 3d7l h LYS 78 Ca -0.07 -0.25 -0.10 0.00 -1.87 0.00 0.00 60.65 58.36 3d7l h LYS 78 Cb 1.47 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 3d7l h LYS 78 CO 0.17 0.99 -0.47 -0.97 -0.57 0.00 0.00 179.45 178.60 3d7l h ASN 79 N 1.11 0.00 0.54 0.86 -0.00 -1.11 -2.73 115.58 114.26 3d7l h ASN 79 Ca 0.24 0.00 -0.02 0.00 -0.00 0.00 0.00 56.30 56.52 3d7l h ASN 79 Cb 0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.64 3d7l h ASN 79 CO -0.01 0.47 -0.07 0.00 -0.00 0.00 0.00 177.43 177.82 3d7l h ALA 80 N 1.53 1.12 -0.06 1.57 0.00 -1.25 -2.38 119.26 119.79 3d7l h ALA 80 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d7l h ALA 80 Cb 0.93 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3d7l h ALA 80 CO 0.06 0.09 0.04 0.28 0.00 0.00 0.00 179.25 179.72 3d7l h VAL 81 N 0.00 1.03 -0.54 0.00 2.07 -1.55 -1.03 116.25 116.24 3d7l h VAL 81 Ca -0.00 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 3d7l h VAL 81 Cb 0.37 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 3d7l h VAL 81 CO 0.01 0.03 0.26 0.74 0.02 0.00 0.00 177.57 178.63 3d7l h THR 82 N 0.06 1.20 -0.95 2.57 2.02 -1.61 -2.58 112.91 113.62 3d7l h THR 82 Ca 0.02 -0.56 0.09 0.00 0.77 0.00 0.00 66.41 66.74 3d7l h THR 82 Cb 0.01 0.58 -0.07 0.00 -1.74 0.00 0.00 68.15 66.93 3d7l h THR 82 CO -0.00 0.22 0.61 0.40 0.37 0.00 0.00 175.52 177.12 3d7l h ILE 83 N 0.72 0.99 -0.30 3.11 2.04 -1.31 -2.06 117.51 120.70 3d7l h ILE 83 Ca 0.18 -0.34 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 3d7l h ILE 83 Cb 0.12 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.09 3d7l h ILE 83 CO -0.02 0.18 -0.25 0.28 0.00 0.00 0.00 178.15 178.34 3d7l h SER 84 N 1.00 0.60 0.00 1.72 0.02 -0.97 0.36 113.55 116.27 3d7l h SER 84 Ca 0.44 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3d7l h SER 84 Cb 0.37 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.74 3d7l h SER 84 CO -0.20 0.84 0.00 -0.24 -1.14 0.00 0.00 176.83 176.09 3d7l n SER 85 N -4.11 0.00 -0.28 3.07 2.88 -0.82 -2.24 113.62 112.12 3d7l n SER 85 Ca -0.00 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.60 3d7l n SER 85 Cb 0.42 0.00 0.29 0.00 -0.75 0.00 0.00 64.21 64.18 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 0.87 0.00 -1.46 1.63 -1.10 -0.99 116.57 115.51 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 -0.20 0.00 0.00 -0.60 0.00 0.00 32.23 31.43 3d7l h LYS 86 CO 0.00 0.57 0.00 -0.11 -3.45 0.00 0.00 179.45 176.46 3d7l n LEU 87 N -4.52 0.96 0.14 5.20 0.00 -0.90 -4.17 117.00 113.71 3d7l n LEU 87 Ca 0.14 0.12 0.01 0.00 0.00 0.00 0.00 56.01 56.28 3d7l n LEU 87 Cb 0.28 -0.22 0.31 0.00 0.00 0.00 0.00 43.42 43.79 3d7l n LEU 87 CO 0.32 -0.22 0.72 1.23 0.00 0.00 0.00 177.39 179.44 3d7l h GLY 88 N 0.00 0.15 0.80 -3.96 0.00 -0.39 -2.33 103.07 97.34 3d7l h GLY 88 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 3d7l h GLY 88 CO 0.00 0.11 -0.20 -1.33 0.00 0.00 0.00 176.54 175.13 3d7l h GLY 89 N 1.10 -0.57 1.00 4.60 0.00 -0.72 0.31 103.07 108.79 3d7l h GLY 89 Ca 0.01 0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 3d7l h GLY 89 CO 0.05 -0.21 0.43 1.46 0.00 0.00 0.00 176.54 178.27 3d7l h GLN 90 N -0.75 0.93 -0.41 4.80 4.20 -1.39 -2.17 115.11 120.31 3d7l h GLN 90 Ca -0.06 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.55 3d7l h GLN 90 Cb 0.52 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 3d7l h GLN 90 CO 0.09 0.65 0.14 0.82 -0.67 0.00 0.00 178.83 179.86 3d7l h ILE 91 N 0.94 1.21 0.00 2.54 2.04 -1.38 -2.49 117.51 120.38 3d7l h ILE 91 Ca 0.25 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 3d7l h ILE 91 Cb -0.05 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 36.92 3d7l h ILE 91 CO -0.05 0.25 -0.02 0.78 0.00 0.00 0.00 178.15 179.11 3d7l h ASN 92 N 0.53 0.00 -0.88 1.72 2.35 -0.72 -0.79 115.58 117.79 3d7l h ASN 92 Ca 0.13 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.96 3d7l h ASN 92 Cb 0.25 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.55 3d7l h ASN 92 CO -0.01 0.02 0.54 -0.07 -1.65 0.00 0.00 177.43 176.27 3d7l h LEU 93 N 0.00 0.83 0.23 1.61 3.38 -0.92 0.10 115.31 120.55 3d7l h LEU 93 Ca -0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3d7l h LEU 93 Cb 0.05 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3d7l h LEU 93 CO 0.00 0.51 -0.11 0.58 0.09 0.00 0.00 178.44 179.52 3d7l h VAL 94 N 0.96 0.73 -0.89 1.22 2.07 -1.16 -0.50 116.25 118.68 3d7l h VAL 94 Ca 0.40 -0.92 0.10 0.00 0.82 0.00 0.00 66.70 67.09 3d7l h VAL 94 Cb 0.24 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 3d7l h VAL 94 CO -0.20 0.17 0.58 -0.07 0.02 0.00 0.00 177.57 178.07 3d7l h LEU 95 N -0.85 0.81 -0.39 2.57 3.38 -1.17 -1.61 115.31 118.04 3d7l h LEU 95 Ca -0.03 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3d7l h LEU 95 Cb 0.51 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3d7l h LEU 95 CO 0.05 0.48 -0.54 0.18 0.09 0.00 0.00 178.44 178.70 3d7l n LEU 96 N -4.53 1.14 -0.00 1.67 4.77 0.35 -4.41 117.00 115.99 3d7l n LEU 96 Ca 0.15 -0.37 0.06 0.00 -0.03 0.00 0.00 56.01 55.82 3d7l n LEU 96 Cb 0.30 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 3d7l n LEU 96 CO 0.31 0.23 -0.08 0.61 -1.33 0.00 0.00 177.39 177.13 3d7l n GLY 97 N 1.43 -0.30 0.25 -0.72 0.00 -0.20 -4.66 105.19 100.99 3d7l n GLY 97 Ca 0.08 -0.38 0.02 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 0.57 0.00 -0.61 2.04 -1.64 0.57 117.51 118.43 3d7l h ILE 98 Ca 0.00 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3d7l h ILE 98 Cb 0.34 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3d7l h ILE 98 CO 0.00 0.04 0.00 0.47 0.00 0.00 0.00 178.15 178.66 3d7l n ASP 99 N -5.17 0.37 0.01 1.72 9.92 -1.26 -1.81 116.55 120.33 3d7l n ASP 99 Ca 0.11 0.62 0.12 0.00 -0.53 0.00 0.00 54.79 55.11 3d7l n ASP 99 Cb 0.38 -0.69 0.22 0.00 -0.64 0.00 0.00 41.12 40.38 3d7l n ASP 99 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 3d7l n SER 100 N -1.94 0.55 -4.76 -2.24 7.64 0.19 -4.89 113.62 108.16 3d7l n SER 100 Ca 0.01 -0.20 -0.38 0.00 1.01 0.00 0.00 58.87 59.31 3d7l n SER 100 Cb 0.13 0.29 -0.06 0.00 -1.01 0.00 0.00 64.21 63.56 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 -3.25 4.38 0.79 -3.43 1.43 -0.75 -0.91 118.68 116.93 3d7l s LEU 101 Ca 0.10 1.04 -0.11 0.00 -1.03 0.00 0.00 54.13 54.13 3d7l s LEU 101 Cb 0.17 -2.83 0.07 0.00 0.03 0.00 0.00 46.19 43.63 3d7l s LEU 101 CO 0.71 0.09 1.11 0.20 0.23 0.00 0.00 176.35 178.69 3d7l s ASN 102 N -0.01 4.20 0.29 2.29 0.01 -0.45 -4.91 114.94 116.37 3d7l s ASN 102 Ca 0.29 1.93 -0.28 0.00 -0.71 0.00 0.00 52.86 54.09 3d7l s ASN 102 Cb -0.17 -2.54 -0.14 0.00 0.41 0.00 0.00 41.25 38.81 3d7l s ASN 102 CO 0.15 -2.24 1.04 0.47 -1.51 0.00 0.00 177.10 175.01 3d7l n ASP 103 N -3.56 1.45 0.00 -1.22 10.43 -1.26 -1.36 116.55 121.04 3d7l n ASP 103 Ca 0.10 1.18 0.00 0.00 2.57 0.00 0.00 54.79 58.64 3d7l n ASP 103 Cb 0.53 -1.31 0.00 0.00 1.84 0.00 0.00 41.12 42.18 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 0.71 -0.79 -0.39 -1.24 4.01 0.08 -4.97 118.16 115.57 3d7l n LYS 104 Ca 0.09 0.20 -0.29 0.00 -0.51 0.00 0.00 58.31 57.80 3d7l n LYS 104 Cb 0.32 -3.96 0.27 0.00 -0.51 0.00 0.00 35.03 31.16 3d7l n LYS 104 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3d7l n GLY 105 N -1.13 -3.70 3.15 0.72 0.00 -0.46 -4.66 105.19 99.09 3d7l n GLY 105 Ca 0.00 -1.33 -0.08 0.00 0.00 0.00 0.00 46.02 44.60 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 -3.35 0.26 0.03 1.61 1.04 -0.74 -1.10 113.70 111.45 3d7l s SER 106 Ca 0.65 -0.74 0.05 0.00 0.48 0.00 0.00 55.95 56.39 3d7l s SER 106 Cb -0.10 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.25 3d7l s SER 106 CO 0.54 -0.63 -0.11 -0.36 0.98 0.00 0.00 173.24 173.65 3d7l s PHE 107 N -3.59 2.75 -0.04 5.02 0.08 -0.40 -1.04 117.98 120.76 3d7l s PHE 107 Ca 0.03 -0.14 -0.02 0.00 0.12 0.00 0.00 56.93 56.93 3d7l s PHE 107 Cb 0.05 -1.54 0.03 0.00 -0.57 0.00 0.00 43.02 40.99 3d7l s PHE 107 CO -0.09 0.33 0.05 0.99 -0.10 0.00 0.00 175.22 176.40 3d7l s THR 108 N -0.99 -0.07 0.33 0.64 2.01 -0.47 -1.88 115.64 115.22 3d7l s THR 108 Ca 0.16 0.37 0.09 0.00 0.31 0.00 0.00 61.69 62.63 3d7l s THR 108 Cb -0.11 -0.17 -0.05 0.00 0.01 0.00 0.00 72.50 72.19 3d7l s THR 108 CO 0.07 0.17 0.03 -0.76 -0.69 0.00 0.00 174.62 173.44 3d7l s LEU 109 N 1.97 3.03 -0.12 4.42 1.43 -0.73 -0.14 118.68 128.55 3d7l s LEU 109 Ca 0.03 -0.93 -0.02 0.00 -1.03 0.00 0.00 54.13 52.17 3d7l s LEU 109 Cb -0.12 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 3d7l s LEU 109 CO -0.03 -0.22 -0.03 -0.89 0.23 0.00 0.00 176.35 175.40 3d7l s THR 110 N -2.49 3.98 0.00 5.49 2.01 -1.18 -0.97 115.64 122.48 3d7l s THR 110 Ca 0.35 -0.35 0.00 0.00 0.31 0.00 0.00 61.69 62.00 3d7l s THR 110 Cb -0.01 -2.70 0.00 0.00 0.01 0.00 0.00 72.50 69.80 3d7l s THR 110 CO 0.20 0.55 0.00 0.35 -0.69 0.00 0.00 174.62 175.03 3d7l n THR 111 N 2.84 0.00 0.00 -0.82 -2.24 -0.18 -4.92 114.28 108.96 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 3.99 3.65 3.38 0.00 -1.26 -4.62 105.19 115.33 3d7l n GLY 112 Ca 0.00 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.52 3d7l n GLY 112 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3d7l s ILE 113 N -2.00 3.30 0.00 -0.61 2.07 -0.50 -4.83 121.20 118.63 3d7l s ILE 113 Ca 0.00 0.36 0.00 0.00 -1.41 0.00 0.00 60.65 59.60 3d7l s ILE 113 Cb 0.00 -3.25 0.00 0.00 0.13 0.00 0.00 42.46 39.34 3d7l s ILE 113 CO 0.00 -0.05 0.00 -0.62 -1.91 0.00 0.00 174.94 172.36 3d7l n GLU 116 N 7.50 0.00 -3.30 3.50 1.02 -1.26 -4.53 120.64 123.57 3d7l n GLU 116 Ca 0.20 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 57.08 3d7l n GLU 116 Cb 0.42 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.07 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 0.25 0.53 -4.79 1.62 -0.08 -1.26 -5.13 116.55 107.70 3d7l n ASP 117 Ca 0.00 -2.72 -0.34 0.00 -1.51 0.00 0.00 54.79 50.22 3d7l n ASP 117 Cb 0.00 -0.63 -0.00 0.00 2.34 0.00 0.00 41.12 42.83 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 -1.01 3.41 0.13 -0.67 0.04 -1.26 -5.08 135.00 130.56 3d7l s PRO 118 Ca 0.35 1.44 0.07 0.00 0.04 0.00 0.00 61.00 62.90 3d7l s PRO 118 Cb 0.12 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.60 3d7l s PRO 118 CO -0.13 -0.77 -0.18 0.96 0.04 0.00 0.00 177.00 176.93 3d7l s ILE 119 N -2.03 1.60 0.15 0.56 -4.36 -1.26 -5.07 121.20 110.78 3d7l s ILE 119 Ca 0.69 -1.70 -0.34 0.00 -0.26 0.00 0.00 60.65 59.03 3d7l s ILE 119 Cb -0.20 -1.61 -0.16 0.00 1.25 0.00 0.00 42.46 41.74 3d7l s ILE 119 CO 0.28 -0.26 1.23 0.52 0.24 0.00 0.00 174.94 176.95 3d7l n VAL 120 N 0.67 0.60 0.00 8.37 0.31 -1.26 -1.03 118.33 125.99 3d7l n VAL 120 Ca -0.16 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 3d7l n VAL 120 Cb 0.56 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.63 3d7l n VAL 120 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3d7l n GLN 121 N 2.02 0.00 -0.23 5.55 6.02 -1.26 -4.92 117.38 124.56 3d7l n GLN 121 Ca 0.16 0.00 0.06 0.00 -0.01 0.00 0.00 57.00 57.21 3d7l n GLN 121 Cb 0.23 -1.13 0.18 0.00 1.02 0.00 0.00 30.24 30.54 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 0.97 0.30 1.08 0.00 -0.20 -3.02 105.19 102.32 3d7l n GLY 122 Ca 0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 46.02 45.52 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 3.65 0.98 -0.15 4.61 0.00 -1.86 0.27 119.26 126.75 3d7l h ALA 123 Ca 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 3d7l h ALA 123 Cb 0.60 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3d7l h ALA 123 CO 0.03 0.63 -0.05 1.03 0.00 0.00 0.00 179.25 180.88 3d7l h SER 124 N 0.88 0.31 -0.66 0.00 0.87 -1.80 -3.07 113.55 110.07 3d7l h SER 124 Ca 0.17 -0.38 -0.07 0.00 -1.23 0.00 0.00 61.79 60.27 3d7l h SER 124 Cb 0.49 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 3d7l h SER 124 CO 0.02 0.62 0.14 0.00 -0.53 0.00 0.00 176.83 177.08 3d7l h ALA 125 N 0.70 0.97 0.00 6.23 0.00 -1.69 -1.96 119.26 123.51 3d7l h ALA 125 Ca 0.04 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3d7l h ALA 125 Cb 0.49 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3d7l h ALA 125 CO 0.02 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.92 3d7l n ALA 126 N -2.46 1.51 0.00 0.00 0.00 0.91 -1.48 120.51 118.99 3d7l n ALA 126 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3d7l n ALA 126 Cb 0.27 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 0.88 0.00 -0.07 0.00 0.00 -0.74 -1.38 120.51 119.20 3d7l n ALA 128 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 3d7l n ALA 128 Cb 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.44 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 0.37 -0.38 0.00 2.35 -1.55 -0.82 115.58 115.56 3d7l h ASN 129 Ca 0.00 -0.30 0.01 0.00 -0.55 0.00 0.00 56.30 55.46 3d7l h ASN 129 Cb 0.00 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 3d7l h ASN 129 CO 0.00 0.58 0.24 1.23 -1.65 0.00 0.00 177.43 177.82 3d7l h GLY 130 N 0.15 0.53 0.76 2.83 0.00 -1.50 -1.04 103.07 104.80 3d7l h GLY 130 Ca 0.06 -0.18 0.03 0.00 0.00 0.00 0.00 47.33 47.24 3d7l h GLY 130 CO 0.01 0.17 0.13 0.00 0.00 0.00 0.00 176.54 176.85 3d7l h ALA 131 N 1.15 0.39 -0.23 3.60 0.00 -1.76 -1.90 119.26 120.50 3d7l h ALA 131 Ca 0.14 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 3d7l h ALA 131 Cb -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3d7l h ALA 131 CO -0.05 -0.26 -0.42 0.28 0.00 0.00 0.00 179.25 178.81 3d7l h VAL 132 N 0.28 1.30 0.27 0.00 2.07 -1.05 0.14 116.25 119.26 3d7l h VAL 132 Ca 0.15 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.06 3d7l h VAL 132 Cb 0.10 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3d7l h VAL 132 CO -0.13 0.50 -0.13 0.74 0.02 0.00 0.00 177.57 178.57 3d7l h THR 133 N 0.46 0.75 -0.29 2.57 2.02 -1.09 -1.88 112.91 115.44 3d7l h THR 133 Ca 0.04 -0.07 -0.16 0.00 0.77 0.00 0.00 66.41 66.98 3d7l h THR 133 Cb 0.92 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 3d7l h THR 133 CO 0.08 0.02 -0.46 0.00 0.37 0.00 0.00 175.52 175.52 3d7l h ALA 134 N 0.33 0.62 -0.45 6.16 0.00 -1.29 -2.15 119.26 122.49 3d7l h ALA 134 Ca -0.04 -0.48 0.06 0.00 0.00 0.00 0.00 54.91 54.45 3d7l h ALA 134 Cb 0.30 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 3d7l h ALA 134 CO 0.06 0.68 0.15 0.35 0.00 0.00 0.00 179.25 180.48 3d7l h PHE 135 N 0.62 0.25 -0.17 0.00 3.57 -0.92 -2.30 116.94 117.99 3d7l h PHE 135 Ca 0.04 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 3d7l h PHE 135 Cb 1.03 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.72 3d7l h PHE 135 CO 0.06 0.08 -0.23 0.00 -2.23 0.00 0.00 178.31 175.99 3d7l h ALA 136 N 1.30 0.26 -0.67 2.41 0.00 -1.17 0.38 119.26 121.78 3d7l h ALA 136 Ca 0.21 -0.37 0.14 0.00 0.00 0.00 0.00 54.91 54.89 3d7l h ALA 136 Cb 0.22 -0.05 -0.12 0.00 0.00 0.00 0.00 17.79 17.84 3d7l h ALA 136 CO -0.23 0.21 -0.08 -0.22 0.00 0.00 0.00 179.25 178.94 3d7l h LYS 137 N 0.10 0.05 0.03 0.00 3.64 -1.34 -0.93 116.57 118.12 3d7l h LYS 137 Ca 0.02 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3d7l h LYS 137 Cb 0.79 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3d7l h LYS 137 CO 0.05 0.04 -0.02 1.03 -2.27 0.00 0.00 179.45 178.28 3d7l h SER 138 N 0.06 -0.04 -0.61 4.20 0.87 -1.19 -3.23 113.55 113.61 3d7l h SER 138 Ca 0.34 -0.53 0.13 0.00 -1.23 0.00 0.00 61.79 60.50 3d7l h SER 138 Cb 0.56 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 3d7l h SER 138 CO -0.63 0.52 0.41 0.00 -0.53 0.00 0.00 176.83 176.61 3d7l h ALA 139 N 0.30 2.20 -0.77 6.23 0.00 -0.08 -2.43 119.26 124.71 3d7l h ALA 139 Ca -0.00 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.03 3d7l h ALA 139 Cb 0.56 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3d7l h ALA 139 CO 0.01 -0.36 0.51 0.00 0.00 0.00 0.00 179.25 179.41 3d7l h ALA 140 N 1.70 1.98 0.00 0.00 0.00 -1.18 -1.66 119.26 120.10 3d7l h ALA 140 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3d7l h ALA 140 Cb 0.77 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3d7l h ALA 140 CO -0.06 -0.18 0.00 0.44 0.00 0.00 0.00 179.25 179.45 3d7l n ILE 141 N -4.50 0.05 -4.04 0.00 -5.35 -0.92 -4.93 119.36 99.68 3d7l n ILE 141 Ca 0.14 0.01 -0.32 0.00 -0.27 0.00 0.00 62.75 62.32 3d7l n ILE 141 Cb 0.46 -0.53 -0.15 0.00 -1.74 0.00 0.00 39.64 37.68 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 -2.69 1.90 0.20 6.28 2.02 -0.63 -5.18 118.70 120.60 3d7l s GLU 142 Ca 0.24 -1.59 0.00 0.00 0.02 0.00 0.00 54.97 53.64 3d7l s GLU 142 Cb 0.19 -3.04 -0.04 0.00 0.10 0.00 0.00 34.13 31.33 3d7l s GLU 142 CO 0.46 -0.74 0.08 -1.25 0.02 0.00 0.00 175.26 173.83 3d7l s PRO 144 N 1.01 1.20 -1.16 0.39 0.04 -1.26 -5.12 135.00 130.10 3d7l s PRO 144 Ca 0.00 -1.62 -0.05 0.00 0.04 0.00 0.00 61.00 59.38 3d7l s PRO 144 Cb -0.20 -0.01 0.03 0.00 0.04 0.00 0.00 34.50 34.37 3d7l s PRO 144 CO -0.06 -0.29 0.27 0.54 0.04 0.00 0.00 177.00 177.50 3d7l n ARG 145 N -0.30 -2.99 -1.01 4.56 1.74 -1.26 -1.81 116.66 115.59 3d7l n ARG 145 Ca -0.02 0.54 -0.00 0.00 -0.77 0.00 0.00 57.85 57.60 3d7l n ARG 145 Cb 0.65 -5.21 -0.00 0.00 -1.02 0.00 0.00 32.46 26.88 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 -1.02 0.43 3.75 -0.13 0.00 -1.26 -0.74 105.19 106.22 3d7l n GLY 146 Ca -0.08 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.85 2.64 0.31 -0.61 1.01 -0.75 -4.12 121.20 117.83 3d7l s ILE 147 Ca 0.00 0.56 0.08 0.00 0.00 0.00 0.00 60.65 61.28 3d7l s ILE 147 Cb 0.00 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 3d7l s ILE 147 CO 0.00 0.10 0.20 -0.13 0.00 0.00 0.00 174.94 175.11 3d7l s ARG 148 N -0.67 2.62 -0.22 2.79 0.52 -0.26 -4.79 118.95 118.95 3d7l s ARG 148 Ca 0.57 -1.33 -0.10 0.00 -0.52 0.00 0.00 55.73 54.35 3d7l s ARG 148 Cb -0.42 -2.38 0.09 0.00 0.52 0.00 0.00 34.95 32.76 3d7l s ARG 148 CO 0.46 0.18 0.51 -1.50 0.02 0.00 0.00 175.30 174.97 3d7l s ILE 149 N -2.31 -0.42 0.25 1.52 2.07 -1.26 -1.28 121.20 119.77 3d7l s ILE 149 Ca 0.38 0.09 0.02 0.00 -1.41 0.00 0.00 60.65 59.72 3d7l s ILE 149 Cb -0.05 -0.77 -0.05 0.00 0.13 0.00 0.00 42.46 41.71 3d7l s ILE 149 CO 0.24 0.04 0.05 0.20 -1.91 0.00 0.00 174.94 173.56 3d7l s ASN 150 N 2.15 1.53 0.09 4.50 0.01 -0.79 0.24 114.94 122.68 3d7l s ASN 150 Ca -0.06 -1.31 0.08 0.00 -0.71 0.00 0.00 52.86 50.85 3d7l s ASN 150 Cb -0.10 0.08 -0.03 0.00 0.41 0.00 0.00 41.25 41.61 3d7l s ASN 150 CO -0.15 -0.64 -0.19 0.42 -1.51 0.00 0.00 177.10 175.03 3d7l s THR 151 N -3.59 1.59 -0.12 1.60 -4.23 -0.43 -1.77 115.64 108.68 3d7l s THR 151 Ca 0.33 -1.49 0.03 0.00 -1.18 0.00 0.00 61.69 59.39 3d7l s THR 151 Cb 0.07 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.46 3d7l s THR 151 CO 0.11 -0.09 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.20 3d7l s VAL 152 N -1.18 2.17 -0.38 2.29 1.01 -0.14 -0.29 120.40 123.88 3d7l s VAL 152 Ca 0.05 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.06 3d7l s VAL 152 Cb -0.10 -1.85 0.10 0.00 0.00 0.00 0.00 36.38 34.53 3d7l s VAL 152 CO 0.04 0.55 0.14 -0.55 0.00 0.00 0.00 175.10 175.28 3d7l s SER 153 N 0.58 5.07 0.32 3.32 0.15 0.30 -1.01 113.70 122.43 3d7l s SER 153 Ca -0.12 -2.05 -0.17 0.00 0.70 0.00 0.00 55.95 54.31 3d7l s SER 153 Cb -0.17 -1.75 -0.09 0.00 -1.71 0.00 0.00 66.02 62.30 3d7l s SER 153 CO 0.03 -0.48 0.76 -2.16 1.20 0.00 0.00 173.24 172.60 3d7l s PRO 154 N 1.06 4.09 1.13 5.44 0.05 -1.26 -0.19 135.00 145.31 3d7l s PRO 154 Ca 0.09 0.77 -0.17 0.00 0.05 0.00 0.00 61.00 61.74 3d7l s PRO 154 Cb -0.21 -2.50 0.25 0.00 0.05 0.00 0.00 34.50 32.09 3d7l s PRO 154 CO -0.05 0.18 1.12 1.21 0.05 0.00 0.00 177.00 179.51 3d7l s ASN 155 N -2.13 1.56 0.23 6.66 3.84 -0.10 -1.41 114.94 123.60 3d7l s ASN 155 Ca 0.53 0.75 -0.32 0.00 0.21 0.00 0.00 52.86 54.03 3d7l s ASN 155 Cb -0.12 -1.10 -0.13 0.00 -0.55 0.00 0.00 41.25 39.35 3d7l s ASN 155 CO 0.18 -3.74 1.49 0.55 -2.79 0.00 0.00 177.10 172.78 3d7l n VAL 156 N -4.52 0.71 -2.81 -5.21 3.14 -1.26 -4.77 118.33 103.61 3d7l n VAL 156 Ca 0.11 -0.18 -0.40 0.00 -2.96 0.00 0.00 64.34 60.91 3d7l n VAL 156 Cb 0.59 -1.59 -0.06 0.00 -1.06 0.00 0.00 33.84 31.72 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 0.23 4.63 0.39 6.55 1.43 -1.26 -0.70 118.68 129.95 3d7l s LEU 157 Ca 0.70 1.86 0.11 0.00 -1.03 0.00 0.00 54.13 55.78 3d7l s LEU 157 Cb -0.63 -3.52 0.92 0.00 0.03 0.00 0.00 46.19 42.99 3d7l s LEU 157 CO 0.46 0.17 1.92 -0.33 0.23 0.00 0.00 176.35 178.80 3d7l h GLU 158 N 4.22 0.55 0.00 1.70 5.08 -0.78 -0.96 114.58 124.39 3d7l h GLU 158 Ca -0.46 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 57.85 3d7l h GLU 158 Cb 1.20 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 3d7l h GLU 158 CO 0.67 0.36 -0.12 0.93 -1.00 0.00 0.00 179.01 179.86 3d7l h GLU 159 N 0.57 0.00 -0.36 2.33 3.07 -1.93 -2.52 114.58 115.75 3d7l h GLU 159 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 3d7l h GLU 159 Cb 0.67 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.58 3d7l h GLU 159 CO -0.14 0.12 0.00 0.43 -1.40 0.00 0.00 179.01 178.02 3d7l n SER 160 N -3.98 3.01 -0.13 1.42 7.64 -0.43 -4.77 113.62 116.39 3d7l n SER 160 Ca -0.02 -1.90 -0.08 0.00 1.01 0.00 0.00 58.87 57.87 3d7l n SER 160 Cb 0.21 -0.23 -0.00 0.00 -1.01 0.00 0.00 64.21 63.17 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 2.83 0.53 -0.24 1.43 -0.00 -0.92 -1.01 115.95 118.56 3d7l h TRP 161 Ca 0.00 -0.01 0.07 0.00 -0.00 0.00 0.00 58.89 58.95 3d7l h TRP 161 Cb 0.77 -0.17 -0.01 0.00 -0.00 0.00 0.00 29.16 29.75 3d7l h TRP 161 CO 0.23 0.39 0.25 0.38 -0.00 0.00 0.00 178.44 179.69 3d7l h ASP 162 N 0.51 0.00 0.00 2.65 3.04 -1.86 0.20 116.42 120.95 3d7l h ASP 162 Ca 0.14 0.00 -0.08 0.00 -3.24 0.00 0.00 57.03 53.85 3d7l h ASP 162 Cb 0.03 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.30 3d7l h ASP 162 CO -0.02 0.00 -1.87 1.17 -2.04 0.00 0.00 179.24 176.48 3d7l n LYS 163 N -3.84 0.75 -0.00 4.15 4.81 -0.92 -4.58 118.16 118.52 3d7l n LYS 163 Ca 0.03 -0.12 0.07 0.00 -0.87 0.00 0.00 58.31 57.43 3d7l n LYS 163 Cb 0.39 -1.41 -0.10 0.00 0.02 0.00 0.00 35.03 33.93 3d7l n LYS 163 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3d7l n LEU 164 N -2.23 0.47 -0.30 3.14 4.77 -0.43 -4.62 117.00 117.80 3d7l n LEU 164 Ca -0.09 -0.32 0.13 0.00 -0.03 0.00 0.00 56.01 55.69 3d7l n LEU 164 Cb 0.60 0.00 0.30 0.00 -2.33 0.00 0.00 43.42 41.99 3d7l n LEU 164 CO 0.36 0.12 1.04 -0.08 -1.33 0.00 0.00 177.39 177.49 3d7l h GLU 165 N 0.00 0.38 -0.64 3.23 4.81 -0.86 0.09 114.58 121.60 3d7l h GLU 165 Ca 0.00 -0.02 0.17 0.00 -0.13 0.00 0.00 59.36 59.38 3d7l h GLU 165 Cb 0.49 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 3d7l h GLU 165 CO 0.00 0.25 0.45 -1.35 -0.73 0.00 0.00 179.01 177.63 3d7l h PRO 166 N 0.40 0.08 0.00 0.92 0.11 -1.85 -0.34 132.00 131.32 3d7l h PRO 166 Ca 0.55 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.57 3d7l h PRO 166 Cb 1.05 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3d7l h PRO 166 CO -0.53 0.06 -0.45 0.74 -0.21 0.00 0.00 178.00 177.61 3d7l h PHE 167 N 0.09 0.00 -1.50 0.65 -1.00 -1.31 -3.39 116.94 110.47 3d7l h PHE 167 Ca 0.31 0.00 -0.51 0.00 2.81 0.00 0.00 57.97 60.58 3d7l h PHE 167 Cb 1.09 0.00 -0.41 0.00 3.61 0.00 0.00 35.95 40.24 3d7l h PHE 167 CO -0.00 0.41 -0.91 1.19 -1.61 0.00 0.00 178.31 177.39 3d7l n PHE 168 N -3.19 2.47 -2.12 -0.55 3.01 -0.17 -4.82 117.46 112.10 3d7l n PHE 168 Ca 0.02 -3.20 -0.42 0.00 1.01 0.00 0.00 57.45 54.86 3d7l n PHE 168 Cb 0.70 -0.26 -0.03 0.00 -0.01 0.00 0.00 39.48 39.88 3d7l n PHE 168 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3d7l s GLU 169 N -3.29 4.31 0.00 -1.08 2.02 -0.98 -2.00 118.70 117.67 3d7l s GLU 169 Ca 0.41 2.15 0.00 0.00 0.02 0.00 0.00 54.97 57.55 3d7l s GLU 169 Cb 0.40 -3.20 0.00 0.00 0.10 0.00 0.00 34.13 31.43 3d7l s GLU 169 CO -0.10 -0.43 0.00 0.41 0.02 0.00 0.00 175.26 175.16 3d7l n GLY 170 N 3.17 2.32 3.71 -1.39 0.00 -1.26 -5.04 105.19 106.70 3d7l n GLY 170 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.27 2.26 -0.30 1.61 2.99 -0.85 -5.04 117.98 116.39 3d7l s PHE 171 Ca 0.00 1.39 0.01 0.00 0.00 0.00 0.00 56.93 58.33 3d7l s PHE 171 Cb 0.00 -3.14 0.06 0.00 0.00 0.00 0.00 43.02 39.94 3d7l s PHE 171 CO 0.00 -2.36 -0.03 -1.17 -0.00 0.00 0.00 175.22 171.67 3d7l s LEU 172 N -6.24 3.91 0.78 -0.37 2.96 -1.26 -5.11 118.68 113.35 3d7l s LEU 172 Ca 0.63 -1.49 -0.11 0.00 -0.22 0.00 0.00 54.13 52.95 3d7l s LEU 172 Cb -0.19 -1.64 0.06 0.00 0.50 0.00 0.00 46.19 44.92 3d7l s LEU 172 CO 0.57 -0.26 1.08 -2.16 -1.32 0.00 0.00 176.35 174.26 3d7l s PRO 173 N 1.14 2.21 0.12 0.98 0.04 -1.26 -4.86 135.00 133.36 3d7l s PRO 173 Ca -0.04 0.88 0.07 0.00 0.04 0.00 0.00 61.00 61.95 3d7l s PRO 173 Cb -0.20 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 3d7l s PRO 173 CO -0.04 -1.60 -0.06 0.14 0.04 0.00 0.00 177.00 175.48 3d7l s VAL 174 N -3.03 3.53 0.34 -0.36 -7.23 0.12 -4.68 120.40 109.09 3d7l s VAL 174 Ca 0.61 -1.29 -0.28 0.00 -1.81 0.00 0.00 61.98 59.21 3d7l s VAL 174 Cb -0.16 -2.69 -0.09 0.00 0.56 0.00 0.00 36.38 34.00 3d7l s VAL 174 CO 0.55 0.05 1.20 -2.84 -0.31 0.00 0.00 175.10 173.75 3d7l s PRO 175 N -2.42 4.34 0.44 4.82 0.02 -1.26 -0.10 135.00 140.84 3d7l s PRO 175 Ca 0.24 1.97 0.14 0.00 0.02 0.00 0.00 61.00 63.36 3d7l s PRO 175 Cb -0.11 -2.98 1.04 0.00 0.02 0.00 0.00 34.50 32.48 3d7l s PRO 175 CO 0.16 -0.11 2.00 0.00 -0.33 0.00 0.00 177.00 178.72 3d7l h ALA 176 N 3.27 2.01 -0.05 -1.55 0.00 -1.95 -1.96 119.26 119.02 3d7l h ALA 176 Ca -0.48 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.33 3d7l h ALA 176 Cb 1.22 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3d7l h ALA 176 CO 0.65 -0.12 -0.36 0.00 0.00 0.00 0.00 179.25 179.42 3d7l h ALA 177 N 1.72 1.31 -0.24 0.00 0.00 -1.92 -1.05 119.26 119.08 3d7l h ALA 177 Ca 0.25 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 3d7l h ALA 177 Cb 0.47 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3d7l h ALA 177 CO -0.06 0.50 -0.43 -0.22 0.00 0.00 0.00 179.25 179.03 3d7l h LYS 178 N 0.08 0.71 -0.81 0.00 3.64 -1.74 -3.09 116.57 115.36 3d7l h LYS 178 Ca 0.01 -0.45 -0.02 0.00 -1.27 0.00 0.00 60.65 58.92 3d7l h LYS 178 Cb 0.68 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.52 3d7l h LYS 178 CO 0.05 1.07 0.42 0.28 -2.27 0.00 0.00 179.45 179.00 3d7l h VAL 179 N 0.43 1.25 -0.21 2.00 2.07 -1.35 -2.48 116.25 117.95 3d7l h VAL 179 Ca 0.01 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 66.93 3d7l h VAL 179 Cb 1.03 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 3d7l h VAL 179 CO 0.10 0.29 0.18 0.00 0.02 0.00 0.00 177.57 178.16 3d7l h ALA 180 N 1.22 2.02 -0.28 1.67 0.00 -1.14 -1.30 119.26 121.45 3d7l h ALA 180 Ca 0.28 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 3d7l h ALA 180 Cb 0.08 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3d7l h ALA 180 CO -0.04 -0.29 -0.15 0.00 0.00 0.00 0.00 179.25 178.77 3d7l h ARG 181 N 0.00 0.49 -0.11 0.00 3.08 -1.36 -2.10 114.38 114.37 3d7l h ARG 181 Ca 0.10 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 59.88 3d7l h ARG 181 Cb 0.46 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 3d7l h ARG 181 CO -0.00 0.63 -0.47 0.00 -1.07 0.00 0.00 179.97 179.05 3d7l h ALA 182 N 1.40 0.99 -0.51 0.04 0.00 -1.32 0.87 119.26 120.73 3d7l h ALA 182 Ca 0.08 -0.46 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 3d7l h ALA 182 Cb 0.52 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3d7l h ALA 182 CO 0.03 0.64 0.08 0.74 0.00 0.00 0.00 179.25 180.75 3d7l h PHE 183 N 0.23 0.91 -0.47 0.00 0.04 -1.41 -0.48 116.94 115.75 3d7l h PHE 183 Ca 0.01 -0.13 -0.00 0.00 2.80 0.00 0.00 57.97 60.65 3d7l h PHE 183 Cb 0.92 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.80 3d7l h PHE 183 CO 0.02 0.82 0.28 1.49 -0.60 0.00 0.00 178.31 180.32 3d7l h GLU 184 N 0.73 0.64 -0.61 1.51 4.81 -0.92 -1.70 114.58 119.04 3d7l h GLU 184 Ca 0.16 -0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.43 3d7l h GLU 184 Cb 0.40 -0.13 -0.08 0.00 0.63 0.00 0.00 28.75 29.57 3d7l h GLU 184 CO 0.01 0.47 0.19 -0.22 -0.73 0.00 0.00 179.01 178.73 3d7l h LYS 185 N 0.62 0.33 -0.23 1.92 3.64 -0.68 0.81 116.57 122.98 3d7l h LYS 185 Ca 0.17 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 3d7l h LYS 185 Cb 0.00 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 3d7l h LYS 185 CO -0.03 0.22 0.07 1.03 -2.27 0.00 0.00 179.45 178.47 3d7l h SER 186 N 0.34 0.34 -0.27 4.20 0.87 -0.71 0.71 113.55 119.04 3d7l h SER 186 Ca 0.31 -0.21 -0.16 0.00 -1.23 0.00 0.00 61.79 60.50 3d7l h SER 186 Cb 0.43 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3d7l h SER 186 CO -0.35 0.46 -0.45 0.58 -0.53 0.00 0.00 176.83 176.55 3d7l h VAL 187 N 0.21 1.29 0.00 2.23 2.07 -1.01 -3.36 116.25 117.69 3d7l h VAL 187 Ca 0.07 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.96 3d7l h VAL 187 Cb 0.25 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 3d7l h VAL 187 CO -0.00 0.53 -1.77 0.49 0.02 0.00 0.00 177.57 176.84 3d7l n PHE 188 N -4.13 0.00 -0.23 1.57 3.72 0.25 -4.93 117.46 113.71 3d7l n PHE 188 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 3d7l n PHE 188 Cb 0.57 -0.39 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 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 1.34 -0.83 0.19 1.37 0.00 0.24 -5.04 105.19 102.46 3d7l n GLY 189 Ca -0.02 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.36 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 1.49 -2.17 4.61 0.00 -1.26 -4.96 120.51 115.21 3d7l n ALA 190 Ca 0.00 -0.80 -0.28 0.00 0.00 0.00 0.00 53.44 52.35 3d7l n ALA 190 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.25 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 -0.17 3.52 0.07 0.00 -0.21 -1.26 -5.09 119.66 116.52 3d7l s GLN 191 Ca 0.01 0.32 -0.07 0.00 0.02 0.00 0.00 55.36 55.65 3d7l s GLN 191 Cb 0.01 -2.30 -0.01 0.00 1.00 0.00 0.00 33.01 31.71 3d7l s GLN 191 CO 0.00 -0.32 0.13 -0.08 -2.12 0.00 0.00 175.29 172.90 3d7l s THR 192 N -2.86 0.16 -2.08 -0.19 -1.32 -1.26 -4.64 115.64 103.46 3d7l s THR 192 Ca 0.49 -1.32 0.00 0.00 -1.21 0.00 0.00 61.69 59.65 3d7l s THR 192 Cb -0.10 -1.34 0.00 0.00 -1.51 0.00 0.00 72.50 69.54 3d7l s THR 192 CO 0.47 -0.73 0.00 0.61 -2.21 0.00 0.00 174.62 172.76 3d7l n GLY 193 N 0.06 1.88 3.91 6.08 0.00 0.14 -4.93 105.19 112.33 3d7l n GLY 193 Ca -0.15 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.66 3.61 -0.31 1.61 0.41 -1.26 -4.55 118.70 114.55 3d7l s GLU 194 Ca 0.00 -0.07 0.01 0.00 -0.41 0.00 0.00 54.97 54.50 3d7l s GLU 194 Cb 0.00 -2.68 0.07 0.00 -1.78 0.00 0.00 34.13 29.74 3d7l s GLU 194 CO 0.00 0.24 0.01 0.45 -0.49 0.00 0.00 175.26 175.47 3d7l s SER 195 N -3.19 4.78 -0.63 -0.19 0.15 -1.26 -1.32 113.70 112.04 3d7l s SER 195 Ca 0.43 -1.64 -0.24 0.00 0.70 0.00 0.00 55.95 55.19 3d7l s SER 195 Cb -0.11 -1.66 0.05 0.00 -1.71 0.00 0.00 66.02 62.60 3d7l s SER 195 CO 0.30 -0.31 1.03 -0.31 1.20 0.00 0.00 173.24 175.14 3d7l s TYR 196 N 1.10 2.64 -0.11 3.44 2.02 0.60 -4.91 117.35 122.13 3d7l s TYR 196 Ca -0.00 -0.23 -0.28 0.00 -0.37 0.00 0.00 57.07 56.19 3d7l s TYR 196 Cb -0.20 -4.29 -0.02 0.00 -0.40 0.00 0.00 41.96 37.05 3d7l s TYR 196 CO -0.04 -1.62 0.92 -0.65 -1.57 0.00 0.00 175.55 172.59 3d7l s GLN 197 N 4.38 4.40 -0.76 -0.62 -0.21 -1.26 -0.54 119.66 125.04 3d7l s GLN 197 Ca 0.28 1.24 0.03 0.00 0.02 0.00 0.00 55.36 56.93 3d7l s GLN 197 Cb -0.13 -3.53 0.18 0.00 1.00 0.00 0.00 33.01 30.53 3d7l s GLN 197 CO 0.15 -0.26 0.58 0.08 -2.12 0.00 0.00 175.29 173.72 3d7l s VAL 198 N 1.84 3.36 -2.25 1.09 1.01 0.73 -4.94 120.40 121.25 3d7l s VAL 198 Ca 0.45 -4.13 0.18 0.00 0.00 0.00 0.00 61.98 58.47 3d7l s VAL 198 Cb -0.18 -3.16 0.14 0.00 0.00 0.00 0.00 36.38 33.18 3d7l s VAL 198 CO 0.17 -1.03 1.07 -1.22 0.00 0.00 0.00 175.10 174.10