#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d7l s LYS 2 N 0.00 0.19 -0.10 0.00 2.20 -1.26 -4.92 119.74 115.85 3d7l s LYS 2 Ca 0.00 0.38 0.03 0.00 -0.36 0.00 0.00 55.97 56.02 3d7l s LYS 2 Cb 0.00 0.12 0.01 0.00 -1.51 0.00 0.00 37.83 36.44 3d7l s LYS 2 CO 0.00 -0.05 -0.19 0.42 -0.36 0.00 0.00 175.35 175.17 3d7l s ILE 3 N 1.57 1.72 -0.33 5.43 1.01 0.33 -0.17 121.20 130.75 3d7l s ILE 3 Ca -0.06 -0.81 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 3d7l s ILE 3 Cb -0.03 -1.52 -0.01 0.00 0.01 0.00 0.00 42.46 40.91 3d7l s ILE 3 CO -0.14 0.48 0.40 -0.22 0.00 0.00 0.00 174.94 175.46 3d7l s LEU 4 N 0.59 4.35 -0.29 2.97 2.96 0.49 -0.25 118.68 129.51 3d7l s LEU 4 Ca -0.14 -0.10 -0.04 0.00 -0.22 0.00 0.00 54.13 53.62 3d7l s LEU 4 Cb -0.17 -2.41 0.03 0.00 0.50 0.00 0.00 46.19 44.14 3d7l s LEU 4 CO 0.05 -0.35 0.02 -0.22 -1.32 0.00 0.00 176.35 174.53 3d7l s LEU 5 N 2.11 3.70 -0.22 -0.68 2.96 0.01 0.06 118.68 126.62 3d7l s LEU 5 Ca 0.14 -0.92 -0.09 0.00 -0.22 0.00 0.00 54.13 53.04 3d7l s LEU 5 Cb -0.16 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 3d7l s LEU 5 CO 0.12 -0.20 0.12 -0.63 -1.32 0.00 0.00 176.35 174.44 3d7l s ILE 6 N 1.39 5.17 0.00 6.68 1.01 0.22 -0.78 121.20 134.88 3d7l s ILE 6 Ca -0.00 0.11 0.00 0.00 0.00 0.00 0.00 60.65 60.76 3d7l s ILE 6 Cb -0.18 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 38.91 3d7l s ILE 6 CO -0.00 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.94 3d7l n GLY 7 N 3.98 0.90 0.20 6.18 0.00 0.11 -0.99 105.19 115.57 3d7l n GLY 7 Ca -0.16 -0.59 0.14 0.00 0.00 0.00 0.00 46.02 45.42 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 1.00 0.00 4.61 0.00 -1.72 -2.56 119.26 120.60 3d7l h ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3d7l h ALA 8 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3d7l h ALA 8 CO 0.00 0.00 -0.02 -1.13 0.00 0.00 0.00 179.25 178.10 3d7l n SER 9 N -2.56 0.08 -4.24 0.00 3.41 -1.26 -2.43 113.62 106.62 3d7l n SER 9 Ca 0.00 0.47 -0.30 0.00 -0.26 0.00 0.00 58.87 58.79 3d7l n SER 9 Cb 0.19 -0.49 0.19 0.00 -0.26 0.00 0.00 64.21 63.84 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 -3.04 1.65 0.07 5.00 0.00 -0.96 -4.74 107.32 105.30 3d7l s GLY 10 Ca 0.14 -0.90 -0.26 0.00 0.00 0.00 0.00 44.72 43.71 3d7l s GLY 10 CO 0.54 -0.16 1.65 -0.84 0.00 0.00 0.00 173.10 174.30 3d7l h THR 11 N -1.90 0.86 0.05 0.90 2.02 -1.91 -0.88 112.91 112.05 3d7l h THR 11 Ca -0.47 -0.12 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 3d7l h THR 11 Cb 1.29 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 3d7l h THR 11 CO 0.45 0.03 -0.02 0.25 0.37 0.00 0.00 175.52 176.59 3d7l h LEU 12 N -0.28 -0.06 -0.97 2.58 5.85 -1.92 -2.94 115.31 117.57 3d7l h LEU 12 Ca -0.02 -0.35 0.22 0.00 0.84 0.00 0.00 57.88 58.57 3d7l h LEU 12 Cb 0.22 0.02 -0.12 0.00 0.37 0.00 0.00 40.66 41.15 3d7l h LEU 12 CO 0.04 0.32 0.55 1.23 -0.34 0.00 0.00 178.44 180.24 3d7l h GLY 13 N -0.45 1.78 1.94 3.75 0.00 -1.67 -0.46 103.07 107.95 3d7l h GLY 13 Ca -0.01 -0.29 -0.21 0.00 0.00 0.00 0.00 47.33 46.82 3d7l h GLY 13 CO 0.01 -0.20 -0.99 1.48 0.00 0.00 0.00 176.54 176.84 3d7l h SER 14 N 0.59 0.08 -0.26 0.19 4.64 -0.80 -0.17 113.55 117.82 3d7l h SER 14 Ca 0.60 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3d7l h SER 14 Cb 1.09 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.14 3d7l h SER 14 CO -0.46 1.01 0.17 0.00 -0.87 0.00 0.00 176.83 176.68 3d7l h ALA 15 N 0.98 0.32 -0.51 5.18 0.00 -1.21 -0.59 119.26 123.43 3d7l h ALA 15 Ca -0.03 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3d7l h ALA 15 Cb 1.72 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.36 3d7l h ALA 15 CO 0.14 -0.20 0.26 0.28 0.00 0.00 0.00 179.25 179.72 3d7l h VAL 16 N 0.35 0.97 -0.49 0.00 2.07 -0.99 -2.30 116.25 115.84 3d7l h VAL 16 Ca 0.09 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 3d7l h VAL 16 Cb -0.04 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 3d7l h VAL 16 CO -0.02 0.09 0.28 0.50 0.02 0.00 0.00 177.57 178.44 3d7l h LYS 17 N 0.51 0.68 -0.96 1.57 3.64 -0.84 -1.04 116.57 120.13 3d7l h LYS 17 Ca 0.22 -0.08 0.13 0.00 -1.27 0.00 0.00 60.65 59.66 3d7l h LYS 17 Cb 0.12 -0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 31.71 3d7l h LYS 17 CO -0.15 0.53 0.58 1.49 -2.27 0.00 0.00 179.45 179.63 3d7l h GLU 18 N 0.66 0.86 0.07 1.90 4.81 -0.66 -1.28 114.58 120.93 3d7l h GLU 18 Ca 0.17 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 3d7l h GLU 18 Cb 0.04 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 29.24 3d7l h GLU 18 CO -0.03 0.57 -0.51 -0.09 -0.73 0.00 0.00 179.01 178.22 3d7l h ARG 19 N 0.88 0.22 -0.05 1.92 2.43 -1.22 -3.38 114.38 115.18 3d7l h ARG 19 Ca 0.49 -0.33 -0.13 0.00 -0.81 0.00 0.00 59.98 59.20 3d7l h ARG 19 Cb 0.56 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 3d7l h ARG 19 CO -0.30 1.12 -0.57 -0.07 -1.51 0.00 0.00 179.97 178.64 3d7l h LEU 20 N -0.52 0.19 -2.03 3.80 3.38 -0.80 -3.14 115.31 116.18 3d7l h LEU 20 Ca -0.08 -0.10 0.12 0.00 0.09 0.00 0.00 57.88 57.90 3d7l h LEU 20 Cb 1.36 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 3d7l h LEU 20 CO 0.10 0.72 0.32 -0.08 0.09 0.00 0.00 178.44 179.58 3d7l h GLU 21 N 0.13 0.00 0.00 1.13 4.81 -1.42 -0.48 114.58 118.75 3d7l h GLU 21 Ca -0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 3d7l h GLU 21 Cb 1.05 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 3d7l h GLU 21 CO 0.08 0.00 -0.29 0.87 -0.73 0.00 0.00 179.01 178.95 3d7l h LYS 22 N 0.00 0.00 0.00 1.92 6.56 -1.73 -3.34 116.57 119.99 3d7l h LYS 22 Ca 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 3d7l h LYS 22 Cb 0.82 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.48 3d7l h LYS 22 CO -0.00 0.29 -0.72 1.63 -2.06 0.00 0.00 179.45 178.58 3d7l n LYS 23 N -3.72 2.87 -3.95 3.15 5.02 -0.32 -5.07 118.16 116.16 3d7l n LYS 23 Ca -0.01 -0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.16 3d7l n LYS 23 Cb 0.39 -0.94 -0.06 0.00 -0.02 0.00 0.00 35.03 34.40 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 -1.94 -0.18 -0.15 7.82 0.00 -0.43 -5.01 121.76 121.87 3d7l s ALA 24 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 51.96 50.86 3d7l s ALA 24 Cb 0.04 0.95 -0.01 0.00 0.00 0.00 0.00 23.12 24.11 3d7l s ALA 24 CO 0.25 -0.74 1.11 -2.00 0.00 0.00 0.00 175.76 174.38 3d7l s GLU 25 N -3.98 4.31 -0.24 0.00 2.12 -1.26 -4.35 118.70 115.30 3d7l s GLU 25 Ca 0.18 1.49 -0.06 0.00 0.36 0.00 0.00 54.97 56.94 3d7l s GLU 25 Cb 0.01 -3.63 -0.02 0.00 0.26 0.00 0.00 34.13 30.75 3d7l s GLU 25 CO 0.03 -0.54 0.04 0.08 -0.54 0.00 0.00 175.26 174.33 3d7l s VAL 26 N 2.80 4.07 -0.21 3.70 1.01 -1.26 -0.52 120.40 129.99 3d7l s VAL 26 Ca 0.49 -0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.11 3d7l s VAL 26 Cb -0.19 -2.89 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 3d7l s VAL 26 CO 0.14 0.36 0.17 -0.63 0.00 0.00 0.00 175.10 175.14 3d7l s ILE 27 N 1.55 5.38 0.01 2.22 1.01 0.66 -4.98 121.20 127.05 3d7l s ILE 27 Ca 0.06 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.94 3d7l s ILE 27 Cb -0.15 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 3d7l s ILE 27 CO 0.02 0.40 0.15 0.42 0.00 0.00 0.00 174.94 175.93 3d7l s THR 28 N 0.61 5.17 0.03 2.92 -4.23 -1.26 -0.81 115.64 118.06 3d7l s THR 28 Ca 0.09 -0.30 0.03 0.00 -1.18 0.00 0.00 61.69 60.33 3d7l s THR 28 Cb -0.12 -3.42 -0.02 0.00 1.34 0.00 0.00 72.50 70.28 3d7l s THR 28 CO 0.01 0.30 -0.09 0.00 -0.54 0.00 0.00 174.62 174.30 3d7l s ALA 29 N -1.31 0.69 0.14 3.99 0.00 0.04 -1.61 121.76 123.69 3d7l s ALA 29 Ca 0.27 -0.62 -0.25 0.00 0.00 0.00 0.00 51.96 51.36 3d7l s ALA 29 Cb -0.12 -0.06 0.07 0.00 0.00 0.00 0.00 23.12 23.00 3d7l s ALA 29 CO 0.19 0.08 0.98 0.20 0.00 0.00 0.00 175.76 177.21 3d7l s GLY 30 N -1.02 -0.24 0.11 0.00 0.00 -1.05 0.06 107.32 105.19 3d7l s GLY 30 Ca -0.03 0.15 -0.21 0.00 0.00 0.00 0.00 44.72 44.63 3d7l s GLY 30 CO 0.00 0.04 1.75 3.21 0.00 0.00 0.00 173.10 178.11 3d7l h ARG 31 N 2.00 0.15 0.00 2.90 2.47 -1.89 0.45 114.38 120.46 3d7l h ARG 31 Ca -0.24 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 3d7l h ARG 31 Cb 1.23 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 3d7l h ARG 31 CO 0.26 0.10 -0.11 0.72 0.56 0.00 0.00 179.97 181.49 3d7l n HIS 32 N -5.03 0.00 -4.19 3.04 8.25 -1.26 -4.52 115.22 111.51 3d7l n HIS 32 Ca -0.04 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.31 3d7l n HIS 32 Cb 0.05 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.06 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 -0.98 1.01 0.00 0.41 1.04 -1.26 -5.06 113.70 108.87 3d7l s SER 33 Ca 0.00 -1.09 0.00 0.00 0.48 0.00 0.00 55.95 55.34 3d7l s SER 33 Cb 0.00 0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.26 3d7l s SER 33 CO 0.00 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.28 3d7l n GLY 34 N -0.11 2.76 0.33 7.32 0.00 -1.26 -2.52 105.19 111.70 3d7l n GLY 34 Ca -0.09 -2.06 0.10 0.00 0.00 0.00 0.00 46.02 43.97 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 0.30 -4.50 1.61 3.32 -1.68 -3.42 116.42 112.04 3d7l h ASP 35 Ca 0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 3d7l h ASP 35 Cb 0.00 -0.06 -0.24 0.00 0.22 0.00 0.00 39.33 39.25 3d7l h ASP 35 CO 0.00 0.19 -0.73 0.68 -1.72 0.00 0.00 179.24 177.66 3d7l s VAL 36 N -5.33 0.37 -0.03 -1.35 -7.23 -0.79 -5.00 120.40 101.05 3d7l s VAL 36 Ca -0.07 -0.74 -0.02 0.00 -1.81 0.00 0.00 61.98 59.34 3d7l s VAL 36 Cb 0.19 -0.42 -0.04 0.00 0.56 0.00 0.00 36.38 36.67 3d7l s VAL 36 CO 0.73 -0.25 0.12 0.42 -0.31 0.00 0.00 175.10 175.81 3d7l s THR 37 N -0.96 5.06 -0.02 5.32 -4.23 -1.26 -2.61 115.64 116.94 3d7l s THR 37 Ca -0.07 -0.21 -0.02 0.00 -1.18 0.00 0.00 61.69 60.21 3d7l s THR 37 Cb -0.07 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.48 3d7l s THR 37 CO -0.00 0.41 0.05 0.54 -0.54 0.00 0.00 174.62 175.08 3d7l s VAL 38 N -1.18 0.00 -0.40 2.29 0.11 0.15 -4.85 120.40 116.52 3d7l s VAL 38 Ca 0.22 -0.01 -0.09 0.00 -2.93 0.00 0.00 61.98 59.18 3d7l s VAL 38 Cb -0.12 -0.08 0.07 0.00 -1.53 0.00 0.00 36.38 34.72 3d7l s VAL 38 CO 0.13 -0.00 0.22 -0.62 -3.33 0.00 0.00 175.10 171.49 3d7l s ASP 39 N 0.01 5.57 0.28 3.54 2.15 -1.26 -3.15 116.67 123.81 3d7l s ASP 39 Ca -0.00 -1.41 0.25 0.00 0.43 0.00 0.00 52.55 51.83 3d7l s ASP 39 Cb -0.00 -1.96 0.94 0.00 -0.30 0.00 0.00 42.92 41.60 3d7l s ASP 39 CO 0.00 -0.48 1.75 0.16 -0.17 0.00 0.00 175.17 176.43 3d7l h ILE 40 N 6.09 0.00 0.00 4.11 3.07 -1.94 -1.68 117.51 127.16 3d7l h ILE 40 Ca -0.23 -0.37 0.00 0.00 1.55 0.00 0.00 64.86 65.82 3d7l h ILE 40 Cb 1.08 1.22 0.00 0.00 -0.27 0.00 0.00 36.82 38.85 3d7l h ILE 40 CO 0.72 0.00 0.00 0.35 -1.05 0.00 0.00 178.15 178.17 3d7l n THR 41 N -2.37 0.11 -4.04 0.16 -2.24 -1.26 -4.31 114.28 100.32 3d7l n THR 41 Ca 0.03 0.03 -0.32 0.00 -2.27 0.00 0.00 64.05 61.51 3d7l n THR 41 Cb 0.31 -0.56 -0.15 0.00 -2.10 0.00 0.00 70.33 67.83 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 -2.70 4.54 0.45 3.42 3.84 -0.63 -5.00 114.94 118.85 3d7l s ASN 42 Ca 0.22 -1.41 0.12 0.00 0.21 0.00 0.00 52.86 52.00 3d7l s ASN 42 Cb 0.18 -1.58 1.00 0.00 -0.55 0.00 0.00 41.25 40.31 3d7l s ASN 42 CO 0.44 -0.21 2.05 0.16 -2.79 0.00 0.00 177.10 176.75 3d7l h ILE 43 N 6.71 1.09 -0.66 -5.21 3.07 -1.83 -1.96 117.51 118.73 3d7l h ILE 43 Ca -0.19 -0.31 -0.08 0.00 1.55 0.00 0.00 64.86 65.84 3d7l h ILE 43 Cb 1.04 0.93 -0.03 0.00 -0.27 0.00 0.00 36.82 38.50 3d7l h ILE 43 CO 0.47 0.11 0.09 0.44 -1.05 0.00 0.00 178.15 178.22 3d7l h ASP 44 N 0.22 1.05 -0.70 2.16 3.45 -1.94 0.28 116.42 120.94 3d7l h ASP 44 Ca 0.06 -0.25 0.01 0.00 0.43 0.00 0.00 57.03 57.27 3d7l h ASP 44 Cb 0.10 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.56 3d7l h ASP 44 CO -0.00 1.04 0.46 -1.28 -1.57 0.00 0.00 179.24 177.89 3d7l h SER 45 N 1.02 0.80 -0.31 6.45 0.87 -1.63 -0.73 113.55 120.02 3d7l h SER 45 Ca 0.20 -0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 3d7l h SER 45 Cb 0.45 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 3d7l h SER 45 CO 0.01 0.59 0.01 0.40 -0.53 0.00 0.00 176.83 177.31 3d7l h ILE 46 N 0.94 1.25 -0.63 2.23 2.04 -0.98 -2.99 117.51 119.38 3d7l h ILE 46 Ca 0.25 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 65.21 3d7l h ILE 46 Cb -0.10 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 3d7l h ILE 46 CO -0.05 0.30 0.39 0.11 0.00 0.00 0.00 178.15 178.90 3d7l h LYS 47 N 0.35 0.76 -1.33 2.37 1.57 -0.84 -2.24 116.57 117.20 3d7l h LYS 47 Ca 0.09 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3d7l h LYS 47 Cb 0.43 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3d7l h LYS 47 CO 0.01 0.50 0.00 1.17 -0.57 0.00 0.00 179.45 180.57 3d7l n LYS 48 N -4.70 0.00 0.00 3.15 0.00 -0.29 -1.39 118.16 114.93 3d7l n LYS 48 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.37 3d7l n LYS 48 Cb 0.07 -1.32 0.00 0.00 0.00 0.00 0.00 35.03 33.78 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 0.83 0.00 -0.27 5.64 4.01 -0.84 -1.61 117.16 124.92 3d7l n TYR 50 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 3d7l n TYR 50 Cb 0.00 0.00 0.16 0.00 -0.31 0.00 0.00 39.34 39.19 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 0.66 -0.02 -0.72 4.81 -1.50 -1.77 114.58 116.05 3d7l h GLU 51 Ca 0.00 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 3d7l h GLU 51 Cb 0.00 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.23 3d7l h GLU 51 CO 0.00 0.44 -0.05 1.96 -0.73 0.00 0.00 179.01 180.63 3d7l h GLN 52 N 0.68 0.06 0.00 1.92 4.20 -1.57 -3.32 115.11 117.08 3d7l h GLN 52 Ca 0.38 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.91 3d7l h GLN 52 Cb 0.40 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 3d7l h GLN 52 CO -0.27 0.68 -0.65 -0.39 -0.67 0.00 0.00 178.83 177.53 3d7l h VAL 53 N -0.54 1.41 -0.42 -0.54 -1.51 -1.82 -3.49 116.25 109.33 3d7l h VAL 53 Ca -0.00 -2.26 0.00 0.00 -1.23 0.00 0.00 66.70 63.21 3d7l h VAL 53 Cb 0.69 2.23 0.00 0.00 -2.13 0.00 0.00 31.29 32.08 3d7l h VAL 53 CO 0.01 0.63 0.00 0.61 -1.23 0.00 0.00 177.57 177.60 3d7l n GLY 54 N 0.43 -0.72 3.74 5.19 0.00 -0.67 -4.87 105.19 108.29 3d7l n GLY 54 Ca -0.01 -1.15 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 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 4.48 0.30 1.61 1.02 -1.26 -4.91 119.74 120.98 3d7l s LYS 55 Ca 0.00 1.91 0.03 0.00 0.02 0.00 0.00 55.97 57.93 3d7l s LYS 55 Cb 0.00 -3.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.04 3d7l s LYS 55 CO 0.00 -0.10 0.10 0.14 -0.92 0.00 0.00 175.35 174.57 3d7l s VAL 56 N -0.12 0.71 -0.08 3.17 -7.23 -0.08 -4.93 120.40 111.84 3d7l s VAL 56 Ca 0.53 -2.00 0.14 0.00 -1.81 0.00 0.00 61.98 58.84 3d7l s VAL 56 Cb -0.33 -2.63 -0.22 0.00 0.56 0.00 0.00 36.38 33.76 3d7l s VAL 56 CO 0.38 0.00 0.61 0.47 -0.31 0.00 0.00 175.10 176.25 3d7l n ASP 57 N -0.69 0.74 -3.82 4.85 9.92 0.77 -1.06 116.55 127.25 3d7l n ASP 57 Ca -0.01 0.35 -0.12 0.00 -0.53 0.00 0.00 54.79 54.48 3d7l n ASP 57 Cb 0.66 0.14 -0.11 0.00 -0.64 0.00 0.00 41.12 41.17 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 -2.65 -0.44 -0.18 2.24 0.00 -1.04 -1.74 121.76 117.94 3d7l s ALA 58 Ca -0.05 0.33 -0.01 0.00 0.00 0.00 0.00 51.96 52.23 3d7l s ALA 58 Cb 0.08 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.03 3d7l s ALA 58 CO 0.82 -0.13 -0.13 0.42 0.00 0.00 0.00 175.76 176.74 3d7l s ILE 59 N -0.38 2.70 -0.15 0.00 1.01 0.19 -0.38 121.20 124.18 3d7l s ILE 59 Ca -0.05 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.88 3d7l s ILE 59 Cb -0.03 -2.17 0.02 0.00 0.01 0.00 0.00 42.46 40.29 3d7l s ILE 59 CO 0.01 0.49 -0.18 -0.69 0.00 0.00 0.00 174.94 174.58 3d7l s VAL 60 N 1.16 1.80 -0.34 2.92 1.01 0.11 -1.22 120.40 125.84 3d7l s VAL 60 Ca 0.01 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.09 3d7l s VAL 60 Cb -0.14 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.60 3d7l s VAL 60 CO -0.05 0.50 0.20 -0.55 0.00 0.00 0.00 175.10 175.20 3d7l s SER 61 N 1.22 5.76 -0.39 3.32 0.15 0.50 -0.61 113.70 123.65 3d7l s SER 61 Ca 0.01 -0.65 0.05 0.00 0.70 0.00 0.00 55.95 56.06 3d7l s SER 61 Cb -0.14 -2.05 0.47 0.00 -1.71 0.00 0.00 66.02 62.59 3d7l s SER 61 CO -0.08 -0.27 1.50 0.00 1.20 0.00 0.00 173.24 175.58 3d7l n ALA 62 N 5.03 5.18 -4.69 5.45 0.00 -0.16 -3.02 120.51 128.30 3d7l n ALA 62 Ca -0.13 -3.52 -0.32 0.00 0.00 0.00 0.00 53.44 49.48 3d7l n ALA 62 Cb 0.48 -0.84 -0.07 0.00 0.00 0.00 0.00 19.45 19.03 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 -0.89 0.00 0.00 0.00 -2.24 -1.24 -4.55 114.28 105.36 3d7l n THR 63 Ca 0.46 -2.44 0.00 0.00 -2.27 0.00 0.00 64.05 59.80 3d7l n THR 63 Cb 0.92 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 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 -1.08 3.85 3.83 3.38 0.00 -1.26 -4.82 105.19 109.09 3d7l n GLY 64 Ca -0.17 -1.12 -0.35 0.00 0.00 0.00 0.00 46.02 44.38 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 6.02 0.06 1.61 0.01 -1.26 -4.65 113.70 115.49 3d7l s SER 65 Ca 0.00 0.32 0.05 0.00 1.31 0.00 0.00 55.95 57.63 3d7l s SER 65 Cb 0.00 -1.86 -0.03 0.00 0.21 0.00 0.00 66.02 64.35 3d7l s SER 65 CO 0.00 0.35 -0.14 0.00 0.41 0.00 0.00 173.24 173.87 3d7l s ALA 66 N -1.08 1.12 0.19 1.44 0.00 -1.26 -2.00 121.76 120.17 3d7l s ALA 66 Ca 0.18 -0.90 -0.30 0.00 0.00 0.00 0.00 51.96 50.94 3d7l s ALA 66 Cb -0.12 -0.12 -0.08 0.00 0.00 0.00 0.00 23.12 22.80 3d7l s ALA 66 CO 0.08 0.18 1.05 0.99 0.00 0.00 0.00 175.76 178.06 3d7l s THR 67 N -1.09 3.96 -0.26 0.00 2.01 -1.26 -4.91 115.64 114.10 3d7l s THR 67 Ca -0.01 1.75 -0.02 0.00 0.31 0.00 0.00 61.69 63.72 3d7l s THR 67 Cb -0.09 -4.12 0.03 0.00 0.01 0.00 0.00 72.50 68.33 3d7l s THR 67 CO 0.02 0.33 -0.05 -0.36 -0.69 0.00 0.00 174.62 173.87 3d7l s PHE 68 N -0.45 3.09 -0.13 4.92 0.40 -1.26 -4.20 117.98 120.35 3d7l s PHE 68 Ca 0.47 -1.57 -0.22 0.00 -0.60 0.00 0.00 56.93 55.01 3d7l s PHE 68 Cb -0.28 -2.07 0.05 0.00 0.51 0.00 0.00 43.02 41.23 3d7l s PHE 68 CO 0.34 -0.73 0.56 0.45 0.70 0.00 0.00 175.22 176.54 3d7l s SER 69 N 1.32 -0.55 0.52 1.36 0.15 -1.15 -5.07 113.70 110.29 3d7l s SER 69 Ca -0.00 0.85 -0.21 0.00 0.70 0.00 0.00 55.95 57.29 3d7l s SER 69 Cb -0.17 0.85 -0.07 0.00 -1.71 0.00 0.00 66.02 64.92 3d7l s SER 69 CO -0.04 -0.36 0.98 -2.65 1.20 0.00 0.00 173.24 172.38 3d7l n PRO 70 N 1.99 1.12 -0.14 5.44 -0.02 -1.26 -4.21 135.00 137.93 3d7l n PRO 70 Ca -0.16 0.42 -0.04 0.00 -2.02 0.00 0.00 63.50 61.70 3d7l n PRO 70 Cb 0.56 -2.12 0.05 0.00 -0.02 0.00 0.00 33.50 31.97 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 0.97 0.05 -0.36 2.45 5.85 -1.95 0.62 115.31 122.93 3d7l h LEU 71 Ca -0.47 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.32 3d7l h LEU 71 Cb 1.35 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.47 3d7l h LEU 71 CO 0.53 0.06 0.00 0.35 -0.34 0.00 0.00 178.44 179.04 3d7l n THR 72 N -5.08 1.19 0.68 1.05 -2.24 -1.26 -1.57 114.28 107.05 3d7l n THR 72 Ca 0.04 0.37 0.09 0.00 -2.27 0.00 0.00 64.05 62.27 3d7l n THR 72 Cb 0.20 -1.25 0.08 0.00 -2.10 0.00 0.00 70.33 67.26 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 -1.78 1.46 -2.77 -0.78 -0.58 0.14 -4.91 120.64 111.41 3d7l n GLU 73 Ca 0.02 -1.56 -0.43 0.00 -0.42 0.00 0.00 57.16 54.77 3d7l n GLU 73 Cb 0.13 -1.34 -0.04 0.00 -0.57 0.00 0.00 31.44 29.62 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 -1.43 3.93 0.41 -4.62 2.96 -0.61 -4.91 118.68 114.41 3d7l s LEU 74 Ca 0.21 -0.10 -0.03 0.00 -0.22 0.00 0.00 54.13 53.98 3d7l s LEU 74 Cb 0.15 -3.02 -0.04 0.00 0.50 0.00 0.00 46.19 43.77 3d7l s LEU 74 CO 0.22 -1.23 0.68 0.42 -1.32 0.00 0.00 176.35 175.11 3d7l s THR 75 N 4.12 4.99 0.33 3.68 -4.23 -1.26 -4.92 115.64 118.34 3d7l s THR 75 Ca 0.35 -0.04 0.08 0.00 -1.18 0.00 0.00 61.69 60.90 3d7l s THR 75 Cb -0.11 -3.85 0.32 0.00 1.34 0.00 0.00 72.50 70.20 3d7l s THR 75 CO 0.23 -0.68 1.82 -0.65 -0.54 0.00 0.00 174.62 174.80 3d7l h PRO 76 N 0.61 0.72 -0.53 3.99 0.11 -1.98 0.98 132.00 135.90 3d7l h PRO 76 Ca -0.48 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.49 3d7l h PRO 76 Cb 1.21 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3d7l h PRO 76 CO 0.62 0.48 -0.04 1.05 -0.21 0.00 0.00 178.00 179.89 3d7l h GLU 77 N 0.74 0.95 -0.50 1.05 9.09 -1.99 0.80 114.58 124.71 3d7l h GLU 77 Ca 0.52 -0.30 -0.12 0.00 0.05 0.00 0.00 59.36 59.51 3d7l h GLU 77 Cb 0.82 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 27.83 3d7l h GLU 77 CO -0.29 0.96 -0.16 0.87 0.05 0.00 0.00 179.01 180.45 3d7l h LYS 78 N 0.86 0.99 0.00 1.06 1.57 -1.77 -3.01 116.57 116.28 3d7l h LYS 78 Ca 0.15 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 3d7l h LYS 78 Cb 0.57 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 3d7l h LYS 78 CO 0.03 1.07 -0.23 -0.97 -0.57 0.00 0.00 179.45 178.79 3d7l h ASN 79 N 0.86 0.00 0.04 0.86 -0.00 -0.51 -2.75 115.58 114.08 3d7l h ASN 79 Ca 0.12 0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.42 3d7l h ASN 79 Cb 0.73 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.05 3d7l h ASN 79 CO 0.06 0.23 -0.03 0.00 -0.00 0.00 0.00 177.43 177.68 3d7l h ALA 80 N 1.77 1.81 -0.14 1.57 0.00 -0.70 -2.36 119.26 121.21 3d7l h ALA 80 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3d7l h ALA 80 Cb 0.44 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3d7l h ALA 80 CO 0.03 0.04 0.05 -0.39 0.00 0.00 0.00 179.25 178.98 3d7l h VAL 81 N 0.00 1.17 -0.22 0.00 -1.51 -1.56 -0.88 116.25 113.25 3d7l h VAL 81 Ca -0.00 -0.51 0.04 0.00 -1.23 0.00 0.00 66.70 65.00 3d7l h VAL 81 Cb 0.07 1.25 -0.04 0.00 -2.13 0.00 0.00 31.29 30.44 3d7l h VAL 81 CO 0.00 0.16 -0.04 0.74 -1.23 0.00 0.00 177.57 177.20 3d7l h THR 82 N 0.05 0.80 -0.73 7.19 2.02 -1.65 -2.07 112.91 118.53 3d7l h THR 82 Ca 0.05 -0.01 0.12 0.00 0.77 0.00 0.00 66.41 67.34 3d7l h THR 82 Cb 0.20 0.78 -0.08 0.00 -1.74 0.00 0.00 68.15 67.30 3d7l h THR 82 CO -0.00 0.00 0.32 0.40 0.37 0.00 0.00 175.52 176.61 3d7l h ILE 83 N 0.02 0.74 0.00 3.11 2.04 -1.28 -1.85 117.51 120.30 3d7l h ILE 83 Ca 0.10 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.79 3d7l h ILE 83 Cb 0.15 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.42 3d7l h ILE 83 CO -0.21 0.09 -0.09 -1.54 0.00 0.00 0.00 178.15 176.40 3d7l n SER 84 N -4.95 0.59 0.00 1.72 3.41 -0.35 0.33 113.62 114.38 3d7l n SER 84 Ca 0.13 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 3d7l n SER 84 Cb 0.35 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3d7l n SER 84 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3d7l n SER 85 N -2.03 0.00 -0.33 4.04 2.88 -0.78 -2.39 113.62 115.00 3d7l n SER 85 Ca 0.06 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.78 3d7l n SER 85 Cb 0.41 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 64.26 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 0.40 0.00 -1.46 1.63 -1.22 0.14 116.57 116.06 3d7l h LYS 86 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3d7l h LYS 86 Cb 0.00 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.54 3d7l h LYS 86 CO 0.00 0.27 0.00 -0.11 -3.45 0.00 0.00 179.45 176.16 3d7l n LEU 87 N -5.01 0.52 -0.01 5.20 0.00 -0.77 -4.18 117.00 112.75 3d7l n LEU 87 Ca 0.27 0.21 -0.06 0.00 0.00 0.00 0.00 56.01 56.44 3d7l n LEU 87 Cb 0.82 -0.36 0.15 0.00 0.00 0.00 0.00 43.42 44.03 3d7l n LEU 87 CO 0.12 -0.36 0.68 1.23 0.00 0.00 0.00 177.39 179.06 3d7l h GLY 88 N 0.00 0.61 0.83 -3.96 0.00 -0.19 -2.66 103.07 97.70 3d7l h GLY 88 Ca 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 3d7l h GLY 88 CO 0.00 0.49 -0.15 -1.33 0.00 0.00 0.00 176.54 175.55 3d7l h GLY 89 N 1.03 -0.43 1.04 4.60 0.00 -0.60 0.16 103.07 108.87 3d7l h GLY 89 Ca 0.06 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.55 3d7l h GLY 89 CO 0.06 -0.16 0.60 1.46 0.00 0.00 0.00 176.54 178.50 3d7l h GLN 90 N -0.59 1.28 -0.46 4.80 4.20 -1.55 -1.63 115.11 121.15 3d7l h GLN 90 Ca -0.04 -0.10 -0.13 0.00 0.06 0.00 0.00 58.65 58.44 3d7l h GLN 90 Cb 0.43 -0.28 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3d7l h GLN 90 CO 0.07 0.87 -0.21 0.82 -0.67 0.00 0.00 178.83 179.71 3d7l h ILE 91 N 1.30 1.27 0.00 2.54 2.04 -1.40 -2.94 117.51 120.33 3d7l h ILE 91 Ca 0.35 -1.36 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 3d7l h ILE 91 Cb -0.10 1.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.11 3d7l h ILE 91 CO -0.07 0.47 -0.14 0.78 0.00 0.00 0.00 178.15 179.19 3d7l h ASN 92 N 0.82 0.00 0.01 1.72 2.35 -0.24 -1.50 115.58 118.74 3d7l h ASN 92 Ca 0.11 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 3d7l h ASN 92 Cb 0.77 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 3d7l h ASN 92 CO 0.06 0.14 -0.05 -0.07 -1.65 0.00 0.00 177.43 175.86 3d7l h LEU 93 N 0.00 0.11 0.00 1.61 3.38 -1.12 -1.37 115.31 117.92 3d7l h LEU 93 Ca -0.00 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3d7l h LEU 93 Cb 0.38 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 3d7l h LEU 93 CO 0.02 0.18 -0.16 0.58 0.09 0.00 0.00 178.44 179.15 3d7l h VAL 94 N 0.12 1.42 -0.12 1.22 2.07 -1.34 -2.54 116.25 117.08 3d7l h VAL 94 Ca 0.03 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.42 3d7l h VAL 94 Cb 0.18 2.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 3d7l h VAL 94 CO 0.01 0.48 0.07 -0.07 0.02 0.00 0.00 177.57 178.08 3d7l h LEU 95 N -1.00 0.13 -0.37 2.57 3.38 -1.31 -1.82 115.31 116.89 3d7l h LEU 95 Ca -0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3d7l h LEU 95 Cb 0.89 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.61 3d7l h LEU 95 CO -0.03 0.10 -0.75 0.18 0.09 0.00 0.00 178.44 178.04 3d7l n LEU 96 N -4.52 1.32 -0.18 1.67 4.77 -0.52 -4.55 117.00 114.98 3d7l n LEU 96 Ca -0.01 -0.54 0.07 0.00 -0.03 0.00 0.00 56.01 55.50 3d7l n LEU 96 Cb 0.08 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 3d7l n LEU 96 CO 0.34 0.28 0.11 0.61 -1.33 0.00 0.00 177.39 177.41 3d7l n GLY 97 N 1.47 -0.24 0.26 -0.72 0.00 -0.70 -4.64 105.19 100.62 3d7l n GLY 97 Ca 0.06 -0.44 -0.02 0.00 0.00 0.00 0.00 46.02 45.62 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 0.89 1.03 0.00 -0.61 2.04 -1.75 -0.76 117.51 118.34 3d7l h ILE 98 Ca 0.00 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.60 3d7l h ILE 98 Cb 0.45 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3d7l h ILE 98 CO 0.00 0.14 0.00 0.47 0.00 0.00 0.00 178.15 178.76 3d7l n ASP 99 N -4.73 0.00 -0.68 1.72 8.00 -1.26 -2.23 116.55 117.36 3d7l n ASP 99 Ca 0.08 -0.20 0.13 0.00 0.71 0.00 0.00 54.79 55.50 3d7l n ASP 99 Cb 0.13 -0.22 0.31 0.00 -0.02 0.00 0.00 41.12 41.32 3d7l n ASP 99 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3d7l n SER 100 N -1.22 2.17 -4.70 -2.24 7.64 -0.30 -4.92 113.62 110.06 3d7l n SER 100 Ca 0.13 -1.70 -0.35 0.00 1.01 0.00 0.00 58.87 57.96 3d7l n SER 100 Cb 0.17 0.03 -0.09 0.00 -1.01 0.00 0.00 64.21 63.31 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 -2.04 4.06 0.85 -3.43 1.43 -0.95 -0.90 118.68 117.70 3d7l s LEU 101 Ca 0.32 0.18 -0.12 0.00 -1.03 0.00 0.00 54.13 53.48 3d7l s LEU 101 Cb 0.20 -2.04 0.11 0.00 0.03 0.00 0.00 46.19 44.49 3d7l s LEU 101 CO 0.34 0.18 1.18 0.20 0.23 0.00 0.00 176.35 178.48 3d7l s ASN 102 N 0.34 3.36 0.32 2.29 0.01 -0.23 -4.88 114.94 116.15 3d7l s ASN 102 Ca 0.06 2.27 -0.27 0.00 -0.71 0.00 0.00 52.86 54.22 3d7l s ASN 102 Cb -0.12 -2.58 -0.13 0.00 0.41 0.00 0.00 41.25 38.83 3d7l s ASN 102 CO -0.01 -2.81 0.95 0.47 -1.51 0.00 0.00 177.10 174.18 3d7l n ASP 103 N -3.68 1.00 -1.37 -1.22 10.43 -1.26 -1.12 116.55 119.33 3d7l n ASP 103 Ca 0.13 1.13 -0.16 0.00 2.57 0.00 0.00 54.79 58.45 3d7l n ASP 103 Cb 0.51 -1.27 -0.06 0.00 1.84 0.00 0.00 41.12 42.14 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 0.61 -1.17 -1.36 -1.24 5.02 0.10 -4.96 118.16 115.16 3d7l n LYS 104 Ca 0.10 1.03 -0.30 0.00 -2.02 0.00 0.00 58.31 57.11 3d7l n LYS 104 Cb 0.34 -5.26 0.23 0.00 -0.02 0.00 0.00 35.03 30.32 3d7l n LYS 104 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3d7l s GLY 105 N -2.72 1.66 0.00 0.72 0.00 -0.27 -4.75 107.32 101.96 3d7l s GLY 105 Ca 0.00 -1.13 -0.06 0.00 0.00 0.00 0.00 44.72 43.54 3d7l s GLY 105 CO 0.00 -0.23 0.11 -1.35 0.00 0.00 0.00 173.10 171.62 3d7l s SER 106 N -4.29 0.05 -0.10 1.64 1.04 -0.71 -0.43 113.70 110.88 3d7l s SER 106 Ca 0.73 -0.21 -0.04 0.00 0.48 0.00 0.00 55.95 56.91 3d7l s SER 106 Cb -0.06 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 3d7l s SER 106 CO 0.55 -0.33 0.04 -0.36 0.98 0.00 0.00 173.24 174.12 3d7l s PHE 107 N -1.27 3.27 -0.07 5.02 0.08 0.25 -0.64 117.98 124.62 3d7l s PHE 107 Ca -0.14 0.26 0.01 0.00 0.12 0.00 0.00 56.93 57.19 3d7l s PHE 107 Cb -0.07 -1.85 0.02 0.00 -0.57 0.00 0.00 43.02 40.54 3d7l s PHE 107 CO 0.01 0.50 -0.10 0.99 -0.10 0.00 0.00 175.22 176.52 3d7l s THR 108 N -0.80 1.00 0.26 0.64 2.01 -0.35 -1.90 115.64 116.50 3d7l s THR 108 Ca 0.12 -0.37 0.11 0.00 0.31 0.00 0.00 61.69 61.86 3d7l s THR 108 Cb -0.12 -0.95 -0.05 0.00 0.01 0.00 0.00 72.50 71.39 3d7l s THR 108 CO 0.03 0.33 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.34 3d7l s LEU 109 N 0.94 2.56 -0.16 4.42 1.02 -0.66 -0.37 118.68 126.44 3d7l s LEU 109 Ca -0.10 -1.01 -0.06 0.00 0.02 0.00 0.00 54.13 52.99 3d7l s LEU 109 Cb -0.15 -1.03 -0.04 0.00 0.02 0.00 0.00 46.19 45.00 3d7l s LEU 109 CO 0.01 0.01 0.04 -0.89 0.02 0.00 0.00 176.35 175.53 3d7l s THR 110 N -2.49 4.57 0.00 5.49 2.01 -1.17 -1.30 115.64 122.75 3d7l s THR 110 Ca 0.27 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.15 3d7l s THR 110 Cb -0.05 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.44 3d7l s THR 110 CO 0.13 0.50 0.00 0.35 -0.69 0.00 0.00 174.62 174.91 3d7l n THR 111 N 3.23 0.00 0.00 -0.82 -2.24 -0.10 -4.93 114.28 109.42 3d7l n THR 111 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 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 3.29 3.65 3.38 0.00 -1.26 -4.49 105.19 114.75 3d7l n GLY 112 Ca 0.00 -0.94 -0.45 0.00 0.00 0.00 0.00 46.02 44.64 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 -1.09 0.62 0.00 -0.61 3.06 -0.36 -4.82 119.36 116.15 3d7l n ILE 113 Ca 0.00 -0.19 0.00 0.00 -2.50 0.00 0.00 62.75 60.06 3d7l n ILE 113 Cb 0.00 -2.20 0.00 0.00 0.54 0.00 0.00 39.64 37.98 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 7.52 0.00 -3.53 9.51 1.02 -1.26 -4.60 120.64 129.30 3d7l n GLU 116 Ca 0.23 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 57.10 3d7l n GLU 116 Cb 0.37 -1.34 -0.11 0.00 -0.02 0.00 0.00 31.44 30.34 3d7l n GLU 116 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3d7l s ASP 117 N 0.00 2.37 0.48 1.62 -1.08 -1.26 -5.13 116.67 113.68 3d7l s ASP 117 Ca 0.00 -3.26 -0.21 0.00 -0.52 0.00 0.00 52.55 48.56 3d7l s ASP 117 Cb 0.00 -0.76 -0.09 0.00 -1.46 0.00 0.00 42.92 40.61 3d7l s ASP 117 CO 0.00 -0.15 1.04 -2.16 0.52 0.00 0.00 175.17 174.42 3d7l s PRO 118 N -0.33 3.83 0.20 4.34 0.04 -1.26 -5.09 135.00 136.73 3d7l s PRO 118 Ca 0.30 1.37 0.08 0.00 0.04 0.00 0.00 61.00 62.80 3d7l s PRO 118 Cb 0.01 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 3d7l s PRO 118 CO -0.18 -0.41 -0.15 0.96 0.04 0.00 0.00 177.00 177.25 3d7l s ILE 119 N -1.95 1.78 0.37 0.56 -4.36 -1.26 -5.08 121.20 111.25 3d7l s ILE 119 Ca 0.67 -2.14 -0.28 0.00 -0.26 0.00 0.00 60.65 58.64 3d7l s ILE 119 Cb -0.17 -1.99 -0.11 0.00 1.25 0.00 0.00 42.46 41.44 3d7l s ILE 119 CO 0.20 -0.52 1.48 -0.69 0.24 0.00 0.00 174.94 175.66 3d7l s VAL 120 N -2.71 2.09 0.00 8.37 1.01 -1.26 -1.56 120.40 126.33 3d7l s VAL 120 Ca 0.21 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.27 3d7l s VAL 120 Cb -0.02 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.30 3d7l s VAL 120 CO 0.07 0.02 0.00 0.00 0.00 0.00 0.00 175.10 175.19 3d7l n GLN 121 N 0.55 0.00 -0.05 2.72 6.02 -1.26 -4.93 117.38 120.44 3d7l n GLN 121 Ca 0.01 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.13 3d7l n GLN 121 Cb 0.39 -2.56 0.29 0.00 1.02 0.00 0.00 30.24 29.38 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 0.73 0.22 1.08 0.00 -0.60 -2.95 105.19 101.66 3d7l n GLY 122 Ca 0.00 -0.58 0.04 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 4.47 1.59 -0.11 4.61 0.00 -1.86 0.74 119.26 128.70 3d7l h ALA 123 Ca 0.00 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 3d7l h ALA 123 Cb 0.77 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.52 3d7l h ALA 123 CO 0.00 0.30 -0.45 1.03 0.00 0.00 0.00 179.25 180.13 3d7l h SER 124 N 0.05 0.59 -0.31 0.00 0.87 -1.80 -3.25 113.55 109.70 3d7l h SER 124 Ca 0.01 -0.63 -0.01 0.00 -1.23 0.00 0.00 61.79 59.94 3d7l h SER 124 Cb 0.40 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 3d7l h SER 124 CO 0.03 1.12 0.17 0.00 -0.53 0.00 0.00 176.83 177.62 3d7l h ALA 125 N 0.48 0.40 0.00 6.23 0.00 -1.62 -2.22 119.26 122.53 3d7l h ALA 125 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3d7l h ALA 125 Cb 1.09 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3d7l h ALA 125 CO 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.26 3d7l n ALA 126 N -2.22 1.00 0.00 0.00 0.00 0.21 -1.31 120.51 118.19 3d7l n ALA 126 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3d7l n ALA 126 Cb 0.07 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 0.70 0.00 -0.16 0.00 0.00 -0.84 -1.57 120.51 118.64 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 0.01 0.00 0.00 0.00 0.00 19.45 19.46 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 0.58 -0.82 0.00 2.35 -1.48 -1.19 115.58 115.03 3d7l h ASN 129 Ca 0.00 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 3d7l h ASN 129 Cb 0.00 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.18 3d7l h ASN 129 CO 0.00 0.49 0.45 1.23 -1.65 0.00 0.00 177.43 177.95 3d7l h GLY 130 N 0.63 1.22 0.86 2.83 0.00 -1.55 -1.56 103.07 105.50 3d7l h GLY 130 Ca 0.17 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 3d7l h GLY 130 CO -0.03 0.53 0.01 0.00 0.00 0.00 0.00 176.54 177.05 3d7l h ALA 131 N 1.24 0.04 -0.22 3.60 0.00 -1.68 -2.12 119.26 120.12 3d7l h ALA 131 Ca 0.29 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 3d7l h ALA 131 Cb 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3d7l h ALA 131 CO -0.05 -0.39 -0.49 0.28 0.00 0.00 0.00 179.25 178.60 3d7l h VAL 132 N -0.10 1.31 0.07 0.00 2.07 -1.23 -1.05 116.25 117.32 3d7l h VAL 132 Ca 0.01 -1.71 0.01 0.00 0.82 0.00 0.00 66.70 65.83 3d7l h VAL 132 Cb 0.15 1.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 3d7l h VAL 132 CO -0.00 0.54 -0.13 0.74 0.02 0.00 0.00 177.57 178.74 3d7l h THR 133 N 0.47 0.70 -0.27 2.57 2.02 -1.19 -1.85 112.91 115.36 3d7l h THR 133 Ca 0.02 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.05 3d7l h THR 133 Cb 1.03 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 3d7l h THR 133 CO 0.10 0.00 -0.45 0.00 0.37 0.00 0.00 175.52 175.54 3d7l h ALA 134 N 0.64 0.69 -0.05 6.16 0.00 -1.30 -1.68 119.26 123.72 3d7l h ALA 134 Ca 0.02 -0.47 0.01 0.00 0.00 0.00 0.00 54.91 54.47 3d7l h ALA 134 Cb 0.27 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3d7l h ALA 134 CO -0.07 0.67 -0.00 0.35 0.00 0.00 0.00 179.25 180.19 3d7l h PHE 135 N 0.56 -0.01 -0.39 0.00 3.57 -1.17 -1.94 116.94 117.56 3d7l h PHE 135 Ca 0.04 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 3d7l h PHE 135 Cb 1.00 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.74 3d7l h PHE 135 CO 0.05 -0.01 -0.11 0.00 -2.23 0.00 0.00 178.31 176.01 3d7l h ALA 136 N 1.05 1.06 -0.62 2.41 0.00 -1.19 0.58 119.26 122.54 3d7l h ALA 136 Ca 0.03 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3d7l h ALA 136 Cb 0.03 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3d7l h ALA 136 CO -0.05 0.57 0.21 -0.22 0.00 0.00 0.00 179.25 179.77 3d7l h LYS 137 N 0.64 0.96 -0.05 0.00 3.64 -1.15 -2.50 116.57 118.11 3d7l h LYS 137 Ca 0.11 -0.20 -0.08 0.00 -1.27 0.00 0.00 60.65 59.21 3d7l h LYS 137 Cb 0.56 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 3d7l h LYS 137 CO 0.04 0.84 -0.29 1.03 -2.27 0.00 0.00 179.45 178.80 3d7l h SER 138 N 0.89 0.34 -0.44 4.20 0.87 -1.06 -3.25 113.55 115.09 3d7l h SER 138 Ca 0.20 -0.67 0.06 0.00 -1.23 0.00 0.00 61.79 60.16 3d7l h SER 138 Cb 0.27 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 3d7l h SER 138 CO -0.01 0.95 0.30 0.00 -0.53 0.00 0.00 176.83 177.54 3d7l h ALA 139 N 0.39 1.99 -0.87 6.23 0.00 0.18 -2.70 119.26 124.48 3d7l h ALA 139 Ca -0.02 -0.01 0.18 0.00 0.00 0.00 0.00 54.91 55.06 3d7l h ALA 139 Cb 0.95 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 3d7l h ALA 139 CO 0.06 -0.07 0.58 0.00 0.00 0.00 0.00 179.25 179.81 3d7l h ALA 140 N 1.76 2.11 -0.00 0.00 0.00 -1.48 -1.23 119.26 120.43 3d7l h ALA 140 Ca 0.20 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3d7l h ALA 140 Cb 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3d7l h ALA 140 CO -0.04 -0.38 -0.00 0.44 0.00 0.00 0.00 179.25 179.26 3d7l n ILE 141 N -4.52 0.00 -3.98 0.00 -5.35 -1.02 -4.93 119.36 99.57 3d7l n ILE 141 Ca 0.18 -0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.35 3d7l n ILE 141 Cb 0.63 -0.49 -0.15 0.00 -1.74 0.00 0.00 39.64 37.88 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 -2.49 1.53 0.11 6.28 2.02 -0.47 -5.19 118.70 120.50 3d7l s GLU 142 Ca 0.31 -2.00 0.00 0.00 0.02 0.00 0.00 54.97 53.31 3d7l s GLU 142 Cb 0.21 -3.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.27 3d7l s GLU 142 CO 0.45 -0.99 -0.01 -1.25 0.02 0.00 0.00 175.26 173.48 3d7l s PRO 144 N 0.66 0.85 -1.46 0.39 0.04 -1.26 -5.13 135.00 129.10 3d7l s PRO 144 Ca 0.12 -1.37 -0.09 0.00 0.04 0.00 0.00 61.00 59.70 3d7l s PRO 144 Cb -0.21 0.02 0.03 0.00 0.04 0.00 0.00 34.50 34.39 3d7l s PRO 144 CO -0.07 -0.13 0.88 0.54 0.04 0.00 0.00 177.00 178.26 3d7l n ARG 145 N -0.05 -5.94 -0.93 4.56 1.74 -1.26 -1.54 116.66 113.25 3d7l n ARG 145 Ca -0.10 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 3d7l n ARG 145 Cb 0.62 -5.68 0.00 0.00 -1.02 0.00 0.00 32.46 26.38 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 -1.69 0.32 3.78 -0.13 0.00 -1.26 0.02 105.19 106.22 3d7l n GLY 146 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.77 2.09 0.24 -0.61 1.01 -0.59 -4.25 121.20 117.31 3d7l s ILE 147 Ca 0.00 0.09 0.09 0.00 0.00 0.00 0.00 60.65 60.83 3d7l s ILE 147 Cb 0.00 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.37 3d7l s ILE 147 CO 0.00 0.02 -0.05 -0.13 0.00 0.00 0.00 174.94 174.78 3d7l s ARG 148 N -1.94 2.18 -0.18 2.79 0.52 0.42 -4.78 118.95 117.96 3d7l s ARG 148 Ca 0.53 -1.38 -0.07 0.00 -0.52 0.00 0.00 55.73 54.29 3d7l s ARG 148 Cb -0.46 -2.14 0.08 0.00 0.52 0.00 0.00 34.95 32.95 3d7l s ARG 148 CO 0.61 0.39 0.40 -1.50 0.02 0.00 0.00 175.30 175.22 3d7l s ILE 149 N -2.12 -0.49 0.25 1.52 2.07 -1.26 -0.59 121.20 120.59 3d7l s ILE 149 Ca 0.29 0.17 0.02 0.00 -1.41 0.00 0.00 60.65 59.71 3d7l s ILE 149 Cb -0.07 -0.63 -0.05 0.00 0.13 0.00 0.00 42.46 41.84 3d7l s ILE 149 CO 0.18 0.07 0.08 0.20 -1.91 0.00 0.00 174.94 173.56 3d7l s ASN 150 N 2.32 1.34 0.06 4.50 0.01 -0.80 -0.06 114.94 122.32 3d7l s ASN 150 Ca -0.03 -1.35 0.06 0.00 -0.71 0.00 0.00 52.86 50.83 3d7l s ASN 150 Cb -0.11 0.13 -0.03 0.00 0.41 0.00 0.00 41.25 41.65 3d7l s ASN 150 CO -0.12 -0.69 -0.18 0.42 -1.51 0.00 0.00 177.10 175.02 3d7l s THR 151 N -3.68 1.42 -0.16 1.60 -4.23 0.00 -1.65 115.64 108.95 3d7l s THR 151 Ca 0.36 -1.26 -0.01 0.00 -1.18 0.00 0.00 61.69 59.60 3d7l s THR 151 Cb 0.08 -1.29 -0.01 0.00 1.34 0.00 0.00 72.50 72.62 3d7l s THR 151 CO 0.13 -0.00 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.41 3d7l s VAL 152 N -1.00 3.20 -0.41 2.29 1.01 -0.42 0.36 120.40 125.44 3d7l s VAL 152 Ca 0.04 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.39 3d7l s VAL 152 Cb -0.09 -2.38 0.11 0.00 0.00 0.00 0.00 36.38 34.02 3d7l s VAL 152 CO 0.02 0.50 0.20 -0.55 0.00 0.00 0.00 175.10 175.27 3d7l s SER 153 N 0.66 5.28 0.27 3.32 0.15 0.76 -0.93 113.70 123.21 3d7l s SER 153 Ca -0.05 -1.97 -0.17 0.00 0.70 0.00 0.00 55.95 54.46 3d7l s SER 153 Cb -0.15 -1.84 -0.09 0.00 -1.71 0.00 0.00 66.02 62.23 3d7l s SER 153 CO 0.02 -0.54 0.73 -2.16 1.20 0.00 0.00 173.24 172.49 3d7l s PRO 154 N 1.17 4.12 1.33 5.44 0.04 -1.26 -0.95 135.00 144.89 3d7l s PRO 154 Ca 0.07 0.76 -0.21 0.00 0.04 0.00 0.00 61.00 61.66 3d7l s PRO 154 Cb -0.23 -2.65 0.33 0.00 0.04 0.00 0.00 34.50 32.00 3d7l s PRO 154 CO -0.04 0.27 1.01 1.21 0.04 0.00 0.00 177.00 179.50 3d7l s ASN 155 N -1.97 -0.27 0.26 6.66 3.84 -0.42 -1.23 114.94 121.81 3d7l s ASN 155 Ca 0.49 0.75 -0.30 0.00 0.21 0.00 0.00 52.86 54.01 3d7l s ASN 155 Cb -0.13 -1.05 -0.13 0.00 -0.55 0.00 0.00 41.25 39.38 3d7l s ASN 155 CO 0.19 -4.87 1.33 0.55 -2.79 0.00 0.00 177.10 171.51 3d7l n VAL 156 N -5.28 1.29 -3.07 -5.21 3.14 -1.26 -4.79 118.33 103.15 3d7l n VAL 156 Ca 0.13 -0.32 -0.36 0.00 -2.96 0.00 0.00 64.34 60.83 3d7l n VAL 156 Cb 0.60 -1.41 -0.06 0.00 -1.06 0.00 0.00 33.84 31.91 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 -0.10 4.31 0.35 6.55 1.43 -1.26 -1.24 118.68 128.71 3d7l s LEU 157 Ca 0.65 1.45 0.09 0.00 -1.03 0.00 0.00 54.13 55.28 3d7l s LEU 157 Cb -0.65 -3.70 0.82 0.00 0.03 0.00 0.00 46.19 42.69 3d7l s LEU 157 CO 0.54 -0.01 1.86 -0.33 0.23 0.00 0.00 176.35 178.63 3d7l h GLU 158 N 3.24 0.67 0.00 1.70 5.08 -0.51 -2.12 114.58 122.65 3d7l h GLU 158 Ca -0.48 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.83 3d7l h GLU 158 Cb 1.19 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 3d7l h GLU 158 CO 0.65 0.44 -0.05 0.93 -1.00 0.00 0.00 179.01 179.98 3d7l h GLU 159 N 0.69 0.00 -0.02 2.33 3.07 -1.92 -2.76 114.58 115.97 3d7l h GLU 159 Ca 0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.33 3d7l h GLU 159 Cb 0.77 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 3d7l h GLU 159 CO -0.22 0.05 -0.11 0.43 -1.40 0.00 0.00 179.01 177.76 3d7l n SER 160 N -3.20 2.08 -0.04 1.42 7.64 -0.83 -4.70 113.62 115.98 3d7l n SER 160 Ca -0.00 -1.54 -0.03 0.00 1.01 0.00 0.00 58.87 58.31 3d7l n SER 160 Cb 0.30 0.16 0.21 0.00 -1.01 0.00 0.00 64.21 63.87 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 2.66 0.68 0.00 1.43 2.91 -1.15 -0.75 115.95 121.72 3d7l h TRP 161 Ca 0.00 -0.10 -0.00 0.00 1.13 0.00 0.00 58.89 59.92 3d7l h TRP 161 Cb 0.62 -0.18 -0.00 0.00 -0.51 0.00 0.00 29.16 29.08 3d7l h TRP 161 CO 0.00 0.68 -0.01 0.38 -1.03 0.00 0.00 178.44 178.46 3d7l h ASP 162 N 0.59 0.00 0.12 2.65 2.03 -1.84 0.20 116.42 120.17 3d7l h ASP 162 Ca 0.11 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 56.05 3d7l h ASP 162 Cb 0.46 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.92 3d7l h ASP 162 CO 0.02 0.01 -2.16 0.29 -1.03 0.00 0.00 179.24 176.37 3d7l n LYS 163 N -4.31 0.70 0.03 4.15 5.02 -0.95 -4.73 118.16 118.07 3d7l n LYS 163 Ca -0.03 0.20 0.11 0.00 -2.02 0.00 0.00 58.31 56.57 3d7l n LYS 163 Cb 0.09 -1.64 -0.07 0.00 -0.02 0.00 0.00 35.03 33.40 3d7l n LYS 163 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3d7l n LEU 164 N -3.27 0.47 -0.31 -0.35 4.32 -0.33 -4.46 117.00 113.07 3d7l n LEU 164 Ca -0.35 0.02 0.06 0.00 -0.02 0.00 0.00 56.01 55.73 3d7l n LEU 164 Cb 1.04 -0.05 0.15 0.00 -1.62 0.00 0.00 43.42 42.95 3d7l n LEU 164 CO 0.38 -0.01 0.72 -0.08 -1.22 0.00 0.00 177.39 177.18 3d7l h GLU 165 N 0.00 0.01 -0.04 3.23 4.81 -0.87 0.23 114.58 121.96 3d7l h GLU 165 Ca 0.00 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3d7l h GLU 165 Cb 0.87 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.24 3d7l h GLU 165 CO 0.00 0.01 0.29 -1.35 -0.73 0.00 0.00 179.01 177.23 3d7l h PRO 166 N 0.01 0.00 0.00 0.92 0.11 -1.85 0.11 132.00 131.30 3d7l h PRO 166 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 3d7l h PRO 166 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 3d7l h PRO 166 CO -0.89 0.00 -1.04 1.19 -0.21 0.00 0.00 178.00 177.06 3d7l n PHE 167 N -3.02 0.24 -2.58 0.65 3.72 0.79 -4.50 117.46 112.77 3d7l n PHE 167 Ca -0.01 0.07 -0.13 0.00 -0.05 0.00 0.00 57.45 57.33 3d7l n PHE 167 Cb 0.35 -0.41 0.03 0.00 -0.94 0.00 0.00 39.48 38.50 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 -1.94 1.88 -1.84 1.38 3.01 0.33 -4.78 117.46 115.51 3d7l n PHE 168 Ca 0.02 -2.61 -0.42 0.00 1.01 0.00 0.00 57.45 55.45 3d7l n PHE 168 Cb 0.43 -0.27 -0.03 0.00 -0.01 0.00 0.00 39.48 39.60 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 -3.46 4.17 0.00 -1.08 2.02 -0.98 -1.34 118.70 118.03 3d7l s GLU 169 Ca 0.35 2.44 0.00 0.00 0.02 0.00 0.00 54.97 57.78 3d7l s GLU 169 Cb 0.40 -3.57 0.00 0.00 0.10 0.00 0.00 34.13 31.07 3d7l s GLU 169 CO -0.03 -0.77 0.00 0.41 0.02 0.00 0.00 175.26 174.89 3d7l n GLY 170 N 4.08 0.90 3.80 -1.39 0.00 -1.26 -5.04 105.19 106.27 3d7l n GLY 170 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.58 2.91 -0.32 1.61 0.08 -0.45 -5.05 117.98 113.18 3d7l s PHE 171 Ca 0.00 1.52 -0.05 0.00 0.12 0.00 0.00 56.93 58.52 3d7l s PHE 171 Cb 0.00 -3.05 0.04 0.00 -0.57 0.00 0.00 43.02 39.45 3d7l s PHE 171 CO 0.00 -1.22 0.07 -1.17 -0.10 0.00 0.00 175.22 172.80 3d7l s LEU 172 N -4.52 4.17 0.71 -0.37 2.96 -1.26 -5.10 118.68 115.26 3d7l s LEU 172 Ca 0.65 -1.17 -0.12 0.00 -0.22 0.00 0.00 54.13 53.26 3d7l s LEU 172 Cb -0.17 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.72 3d7l s LEU 172 CO 0.37 -0.30 1.09 -2.16 -1.32 0.00 0.00 176.35 174.02 3d7l s PRO 173 N 1.36 2.66 0.05 0.98 0.04 -1.26 -4.88 135.00 133.95 3d7l s PRO 173 Ca -0.03 1.19 0.03 0.00 0.04 0.00 0.00 61.00 62.24 3d7l s PRO 173 Cb -0.20 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 3d7l s PRO 173 CO 0.02 -1.33 0.00 0.14 0.04 0.00 0.00 177.00 175.86 3d7l s VAL 174 N -2.72 4.09 0.34 -0.36 -7.23 -0.38 -4.69 120.40 109.45 3d7l s VAL 174 Ca 0.62 -0.81 -0.28 0.00 -1.81 0.00 0.00 61.98 59.71 3d7l s VAL 174 Cb -0.17 -2.89 -0.09 0.00 0.56 0.00 0.00 36.38 33.78 3d7l s VAL 174 CO 0.50 0.24 1.21 -2.84 -0.31 0.00 0.00 175.10 173.90 3d7l s PRO 175 N -1.97 4.31 0.45 4.82 0.02 -1.26 0.22 135.00 141.59 3d7l s PRO 175 Ca 0.23 1.99 0.17 0.00 0.02 0.00 0.00 61.00 63.41 3d7l s PRO 175 Cb -0.12 -2.96 1.06 0.00 0.02 0.00 0.00 34.50 32.51 3d7l s PRO 175 CO 0.15 -0.15 1.99 0.00 -0.33 0.00 0.00 177.00 178.66 3d7l h ALA 176 N 3.21 1.58 -0.01 -1.55 0.00 -1.95 -0.83 119.26 119.70 3d7l h ALA 176 Ca -0.48 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 3d7l h ALA 176 Cb 1.23 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 3d7l h ALA 176 CO 0.65 0.24 -0.16 0.00 0.00 0.00 0.00 179.25 179.98 3d7l h ALA 177 N 1.81 1.73 -0.13 0.00 0.00 -1.92 -0.45 119.26 120.30 3d7l h ALA 177 Ca -0.00 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 3d7l h ALA 177 Cb 0.37 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3d7l h ALA 177 CO 0.03 0.20 -0.56 -0.22 0.00 0.00 0.00 179.25 178.70 3d7l h LYS 178 N 0.01 0.60 -0.66 0.00 3.64 -1.53 -3.13 116.57 115.50 3d7l h LYS 178 Ca 0.00 -0.48 -0.04 0.00 -1.27 0.00 0.00 60.65 58.86 3d7l h LYS 178 Cb 0.28 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.17 3d7l h LYS 178 CO 0.02 1.10 0.24 0.28 -2.27 0.00 0.00 179.45 178.83 3d7l h VAL 179 N 0.24 1.23 -0.17 2.00 2.07 -1.25 -2.45 116.25 117.93 3d7l h VAL 179 Ca -0.03 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 3d7l h VAL 179 Cb 1.20 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3d7l h VAL 179 CO 0.12 0.30 0.07 0.00 0.02 0.00 0.00 177.57 178.08 3d7l h ALA 180 N 1.31 1.82 -0.49 1.67 0.00 -1.07 -0.89 119.26 121.60 3d7l h ALA 180 Ca 0.22 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3d7l h ALA 180 Cb 0.22 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3d7l h ALA 180 CO -0.02 0.15 0.32 0.00 0.00 0.00 0.00 179.25 179.71 3d7l h ARG 181 N 0.23 0.62 -0.00 0.00 3.08 -1.39 -1.06 114.38 115.87 3d7l h ARG 181 Ca 0.06 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.95 3d7l h ARG 181 Cb 0.04 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 3d7l h ARG 181 CO -0.01 0.41 -0.60 0.00 -1.07 0.00 0.00 179.97 178.71 3d7l h ALA 182 N 1.70 1.02 -0.32 0.04 0.00 -1.22 0.13 119.26 120.60 3d7l h ALA 182 Ca 0.18 -0.54 -0.15 0.00 0.00 0.00 0.00 54.91 54.41 3d7l h ALA 182 Cb -0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3d7l h ALA 182 CO -0.04 0.74 -0.37 0.74 0.00 0.00 0.00 179.25 180.32 3d7l h PHE 183 N 0.00 0.99 -0.48 0.00 0.04 -1.11 -1.33 116.94 115.06 3d7l h PHE 183 Ca -0.01 -0.31 -0.00 0.00 2.80 0.00 0.00 57.97 60.45 3d7l h PHE 183 Cb 1.05 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.98 3d7l h PHE 183 CO 0.00 1.10 0.30 1.49 -0.60 0.00 0.00 178.31 180.60 3d7l h GLU 184 N 0.60 0.65 -0.20 1.51 4.81 -1.09 -0.64 114.58 120.22 3d7l h GLU 184 Ca 0.04 -0.06 0.06 0.00 -0.13 0.00 0.00 59.36 59.27 3d7l h GLU 184 Cb 0.96 -0.14 -0.07 0.00 0.63 0.00 0.00 28.75 30.14 3d7l h GLU 184 CO 0.09 0.47 -0.25 -0.22 -0.73 0.00 0.00 179.01 178.37 3d7l h LYS 185 N 0.65 -0.27 0.26 1.92 3.64 -0.53 0.52 116.57 122.76 3d7l h LYS 185 Ca 0.17 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3d7l h LYS 185 Cb -0.02 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 3d7l h LYS 185 CO -0.03 -0.18 -0.28 1.03 -2.27 0.00 0.00 179.45 177.71 3d7l h SER 186 N -0.28 -0.77 -0.16 4.20 0.87 -1.04 0.17 113.55 116.54 3d7l h SER 186 Ca 0.12 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 3d7l h SER 186 Cb 0.47 0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.69 3d7l h SER 186 CO -0.36 -0.40 0.10 0.58 -0.53 0.00 0.00 176.83 176.21 3d7l h VAL 187 N -0.58 1.03 0.00 2.23 2.07 -0.86 -3.32 116.25 116.82 3d7l h VAL 187 Ca -0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3d7l h VAL 187 Cb 0.55 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3d7l h VAL 187 CO -0.08 0.04 -1.13 0.49 0.02 0.00 0.00 177.57 176.91 3d7l n PHE 188 N -4.99 0.05 -0.44 1.57 3.72 0.18 -4.92 117.46 112.63 3d7l n PHE 188 Ca -0.04 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 3d7l n PHE 188 Cb 0.03 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.39 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 1.44 -0.70 0.37 1.37 0.00 0.59 -5.04 105.19 103.22 3d7l n GLY 189 Ca 0.02 -1.67 0.02 0.00 0.00 0.00 0.00 46.02 44.39 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 1.95 -2.39 4.61 0.00 -1.26 -4.97 120.51 115.45 3d7l n ALA 190 Ca 0.00 -1.23 -0.27 0.00 0.00 0.00 0.00 53.44 51.95 3d7l n ALA 190 Cb 0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 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 -0.51 3.56 0.04 0.00 -0.21 -1.26 -5.10 119.66 116.18 3d7l s GLN 191 Ca 0.05 0.07 -0.11 0.00 0.02 0.00 0.00 55.36 55.39 3d7l s GLN 191 Cb 0.05 -2.48 0.01 0.00 1.00 0.00 0.00 33.01 31.59 3d7l s GLN 191 CO 0.01 -0.06 0.23 -0.08 -2.12 0.00 0.00 175.29 173.27 3d7l s THR 192 N -2.54 0.10 -1.21 -0.19 -1.32 -1.26 -4.61 115.64 104.61 3d7l s THR 192 Ca 0.45 -0.83 0.00 0.00 -1.21 0.00 0.00 61.69 60.10 3d7l s THR 192 Cb -0.10 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.94 3d7l s THR 192 CO 0.40 -0.46 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 3d7l n GLY 193 N 0.59 0.82 3.91 6.08 0.00 0.92 -4.96 105.19 112.55 3d7l n GLY 193 Ca -0.18 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.15 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 -3.58 3.29 -0.29 1.61 0.41 -1.25 -4.61 118.70 114.27 3d7l s GLU 194 Ca 0.00 -0.70 -0.01 0.00 -0.41 0.00 0.00 54.97 53.85 3d7l s GLU 194 Cb 0.00 -2.86 0.05 0.00 -1.78 0.00 0.00 34.13 29.54 3d7l s GLU 194 CO 0.00 0.50 -0.02 0.45 -0.49 0.00 0.00 175.26 175.70 3d7l s SER 195 N -3.31 4.81 -0.60 -0.19 0.15 -1.26 -0.82 113.70 112.49 3d7l s SER 195 Ca 0.34 -1.32 -0.21 0.00 0.70 0.00 0.00 55.95 55.45 3d7l s SER 195 Cb -0.10 -1.68 0.07 0.00 -1.71 0.00 0.00 66.02 62.60 3d7l s SER 195 CO 0.27 -0.25 0.82 -0.31 1.20 0.00 0.00 173.24 174.97 3d7l s TYR 196 N 1.22 2.85 0.09 3.44 2.02 0.16 -4.92 117.35 122.20 3d7l s TYR 196 Ca -0.06 -0.61 -0.30 0.00 -0.37 0.00 0.00 57.07 55.74 3d7l s TYR 196 Cb -0.20 -4.05 -0.05 0.00 -0.40 0.00 0.00 41.96 37.26 3d7l s TYR 196 CO -0.02 -1.40 1.02 -0.65 -1.57 0.00 0.00 175.55 172.93 3d7l s GLN 197 N 3.38 4.62 -0.59 -0.62 -0.21 -1.26 -0.17 119.66 124.81 3d7l s GLN 197 Ca 0.19 1.53 0.04 0.00 0.02 0.00 0.00 55.36 57.14 3d7l s GLN 197 Cb -0.19 -3.37 0.17 0.00 1.00 0.00 0.00 33.01 30.61 3d7l s GLN 197 CO 0.10 0.07 0.42 0.08 -2.12 0.00 0.00 175.29 173.85 3d7l s VAL 198 N 0.31 1.98 -1.70 1.09 1.01 -0.12 -4.92 120.40 118.06 3d7l s VAL 198 Ca 0.50 -3.61 0.14 0.00 0.00 0.00 0.00 61.98 59.00 3d7l s VAL 198 Cb -0.25 -2.32 0.11 0.00 0.00 0.00 0.00 36.38 33.92 3d7l s VAL 198 CO 0.30 -1.06 0.93 -1.22 0.00 0.00 0.00 175.10 174.05