#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d2c s ASN 4 N 0.00 4.79 0.62 0.41 0.01 -1.26 -4.97 114.94 114.54 3d2c s ASN 4 Ca 0.00 1.69 -0.19 0.00 -0.71 0.00 0.00 52.86 53.66 3d2c s ASN 4 Cb 0.00 -2.46 -0.02 0.00 0.41 0.00 0.00 41.25 39.17 3d2c s ASN 4 CO 0.00 -1.83 1.27 -2.84 -1.51 0.00 0.00 177.10 172.18 3d2c s PRO 5 N -4.98 2.77 -0.14 -0.60 0.02 -1.26 -4.66 135.00 126.15 3d2c s PRO 5 Ca 0.60 1.99 -0.01 0.00 0.02 0.00 0.00 61.00 63.60 3d2c s PRO 5 Cb -0.16 -1.92 -0.02 0.00 0.02 0.00 0.00 34.50 32.43 3d2c s PRO 5 CO 0.56 -1.41 -0.10 0.08 -0.33 0.00 0.00 177.00 175.80 3d2c s VAL 6 N -1.46 3.29 -0.20 3.83 1.01 -0.37 -0.87 120.40 125.64 3d2c s VAL 6 Ca 0.80 -0.57 -0.04 0.00 0.00 0.00 0.00 61.98 62.17 3d2c s VAL 6 Cb -0.35 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 3d2c s VAL 6 CO 0.38 0.51 -0.05 -0.69 0.00 0.00 0.00 175.10 175.25 3d2c s VAL 7 N 0.44 3.50 -0.20 2.92 1.01 0.21 0.38 120.40 128.66 3d2c s VAL 7 Ca -0.08 -0.47 -0.06 0.00 0.00 0.00 0.00 61.98 61.37 3d2c s VAL 7 Cb -0.15 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 3d2c s VAL 7 CO 0.04 0.45 0.04 -0.04 0.00 0.00 0.00 175.10 175.59 3d2c s MET 8 N 1.09 3.79 -0.25 2.72 -1.94 0.16 -1.76 119.30 123.10 3d2c s MET 8 Ca 0.01 -0.44 -0.04 0.00 -1.71 0.00 0.00 55.69 53.52 3d2c s MET 8 Cb -0.15 -3.17 0.01 0.00 2.01 0.00 0.00 34.83 33.53 3d2c s MET 8 CO -0.00 0.11 -0.01 0.08 -0.01 0.00 0.00 175.02 175.18 3d2c s VAL 9 N 0.79 3.35 0.90 -6.03 1.01 -0.50 -1.72 120.40 118.21 3d2c s VAL 9 Ca 0.02 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.10 3d2c s VAL 9 Cb -0.14 -2.66 0.16 0.00 0.00 0.00 0.00 36.38 33.74 3d2c s VAL 9 CO 0.02 0.23 1.26 -1.38 0.00 0.00 0.00 175.10 175.24 3d2c s HIS 10 N 1.42 2.08 0.00 5.22 -3.43 -1.26 -1.05 115.29 118.27 3d2c s HIS 10 Ca 0.03 0.46 0.00 0.00 -0.80 0.00 0.00 55.06 54.74 3d2c s HIS 10 Cb -0.16 -3.88 0.00 0.00 -1.43 0.00 0.00 32.58 27.11 3d2c s HIS 10 CO -0.02 -2.32 0.00 0.41 -2.00 0.00 0.00 174.74 170.81 3d2c n GLY 11 N -3.59 4.12 3.72 -1.38 0.00 -1.20 -3.15 105.19 103.72 3d2c n GLY 11 Ca 0.13 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 3d2c n GLY 11 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3d2c n ILE 12 N -0.07 0.14 -1.02 -0.61 5.41 -1.26 -1.65 119.36 120.30 3d2c n ILE 12 Ca 0.00 -0.04 -0.01 0.00 1.00 0.00 0.00 62.75 63.71 3d2c n ILE 12 Cb 0.00 -1.99 -0.00 0.00 -0.71 0.00 0.00 39.64 36.94 3d2c n ILE 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3d2c n GLY 13 N 3.72 0.24 0.00 7.39 0.00 -0.22 -4.98 105.19 111.34 3d2c n GLY 13 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3d2c n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2c n GLY 14 N -0.48 1.33 3.75 -0.02 0.00 -0.66 -5.11 105.19 103.99 3d2c n GLY 14 Ca -0.01 -2.01 -0.02 0.00 0.00 0.00 0.00 46.02 43.98 3d2c n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d2c s SER 15 N -1.00 -0.13 0.55 1.61 1.04 -1.26 -4.89 113.70 109.62 3d2c s SER 15 Ca 0.00 -0.39 0.28 0.00 0.48 0.00 0.00 55.95 56.32 3d2c s SER 15 Cb 0.00 0.43 1.46 0.00 0.10 0.00 0.00 66.02 68.01 3d2c s SER 15 CO 0.00 -0.80 1.96 0.77 0.98 0.00 0.00 173.24 176.15 3d2c h SER 16 N 2.00 0.00 -0.08 7.02 4.64 -1.88 -0.33 113.55 124.93 3d2c h SER 16 Ca -0.26 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.09 3d2c h SER 16 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3d2c h SER 16 CO 0.27 0.00 0.10 0.28 -0.87 0.00 0.00 176.83 176.61 3d2c h SER 17 N 0.00 0.00 0.34 4.97 0.02 -1.95 -1.57 113.55 115.36 3d2c h SER 17 Ca 0.26 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3d2c h SER 17 Cb 1.13 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.67 3d2c h SER 17 CO -0.00 0.00 -0.02 0.78 -1.14 0.00 0.00 176.83 176.45 3d2c h ASN 18 N 0.00 0.00 -0.65 3.07 2.35 -1.46 -2.94 115.58 115.95 3d2c h ASN 18 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3d2c h ASN 18 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 3d2c h ASN 18 CO -0.00 0.02 0.00 0.49 -1.65 0.00 0.00 177.43 176.29 3d2c n PHE 19 N -3.22 1.01 -0.30 1.19 3.72 -0.59 -4.49 117.46 114.77 3d2c n PHE 19 Ca -0.02 -0.47 -0.01 0.00 -0.05 0.00 0.00 57.45 56.90 3d2c n PHE 19 Cb 0.16 -0.06 0.16 0.00 -0.94 0.00 0.00 39.48 38.80 3d2c n PHE 19 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3d2c h GLU 20 N 3.85 1.17 -0.30 -1.08 4.39 -1.68 0.11 114.58 121.03 3d2c h GLU 20 Ca 0.00 -0.09 -0.12 0.00 0.34 0.00 0.00 59.36 59.49 3d2c h GLU 20 Cb 1.00 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.39 3d2c h GLU 20 CO 0.05 0.80 -0.29 0.78 -1.16 0.00 0.00 179.01 179.19 3d2c h GLY 21 N 1.20 0.80 1.15 -3.84 0.00 -1.83 -1.97 103.07 98.58 3d2c h GLY 21 Ca 0.32 -0.81 -0.07 0.00 0.00 0.00 0.00 47.33 46.77 3d2c h GLY 21 CO -0.06 0.73 0.13 -2.22 0.00 0.00 0.00 176.54 175.12 3d2c h ILE 22 N 0.49 1.26 0.04 2.60 2.04 -1.65 -1.34 117.51 120.94 3d2c h ILE 22 Ca 0.05 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.94 3d2c h ILE 22 Cb 0.86 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 3d2c h ILE 22 CO 0.07 0.37 -0.02 0.11 0.00 0.00 0.00 178.15 178.68 3d2c h LYS 23 N 0.99 -0.05 -0.39 2.37 1.57 -0.91 -1.23 116.57 118.92 3d2c h LYS 23 Ca 0.20 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 59.06 3d2c h LYS 23 Cb 0.38 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.64 3d2c h LYS 23 CO 0.01 0.09 -0.02 0.77 -0.57 0.00 0.00 179.45 179.72 3d2c h SER 24 N -0.17 -0.20 -0.26 0.86 0.02 -1.16 -0.71 113.55 111.93 3d2c h SER 24 Ca -0.00 0.10 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 3d2c h SER 24 Cb 0.15 0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 3d2c h SER 24 CO 0.01 -0.06 0.12 0.22 -1.14 0.00 0.00 176.83 175.98 3d2c h TYR 25 N 0.08 0.22 -0.57 3.45 3.20 -1.07 -1.57 116.97 120.73 3d2c h TYR 25 Ca 0.19 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 3d2c h TYR 25 Cb 0.28 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 3d2c h TYR 25 CO -0.28 0.12 0.34 -0.07 -1.64 0.00 0.00 178.16 176.64 3d2c h LEU 26 N 0.26 0.68 -0.65 2.82 3.38 -0.63 -1.88 115.31 119.29 3d2c h LEU 26 Ca 0.11 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.05 3d2c h LEU 26 Cb 0.04 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 3d2c h LEU 26 CO -0.08 0.53 0.40 0.58 0.09 0.00 0.00 178.44 179.96 3d2c h VAL 27 N 0.76 1.09 0.00 1.22 2.07 -0.94 0.17 116.25 120.61 3d2c h VAL 27 Ca 0.20 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3d2c h VAL 27 Cb -0.02 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 29.97 3d2c h VAL 27 CO -0.04 0.14 -0.02 0.77 0.02 0.00 0.00 177.57 178.45 3d2c h SER 28 N 0.79 0.00 -0.31 0.57 4.64 -0.67 -1.67 113.55 116.89 3d2c h SER 28 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3d2c h SER 28 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3d2c h SER 28 CO -0.10 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.88 3d2c n GLN 29 N -3.41 2.28 0.00 4.77 1.13 -0.05 -4.94 117.38 117.16 3d2c n GLN 29 Ca -0.03 -1.93 0.00 0.00 -1.94 0.00 0.00 57.00 53.10 3d2c n GLN 29 Cb 0.12 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 28.99 3d2c n GLN 29 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d2c n GLY 30 N 1.39 0.84 3.80 1.08 0.00 -0.63 -5.07 105.19 106.61 3d2c n GLY 30 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 3d2c n GLY 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3d2c s TRP 31 N -2.00 3.37 -0.18 1.61 0.51 -0.59 -4.99 118.94 116.66 3d2c s TRP 31 Ca 0.00 1.66 -0.26 0.00 -2.12 0.00 0.00 56.10 55.38 3d2c s TRP 31 Cb 0.00 -2.96 -0.01 0.00 -0.81 0.00 0.00 33.47 29.70 3d2c s TRP 31 CO 0.00 -0.22 0.89 0.45 -0.51 0.00 0.00 176.95 177.56 3d2c s SER 32 N -1.87 6.99 0.25 2.95 0.15 -1.26 -4.13 113.70 116.79 3d2c s SER 32 Ca 0.58 1.23 -0.04 0.00 0.70 0.00 0.00 55.95 58.42 3d2c s SER 32 Cb -0.15 -2.48 0.51 0.00 -1.71 0.00 0.00 66.02 62.19 3d2c s SER 32 CO 0.20 -0.46 1.65 -0.09 1.20 0.00 0.00 173.24 175.74 3d2c h ARG 33 N 7.37 0.17 0.00 5.44 2.43 -1.94 0.42 114.38 128.27 3d2c h ARG 33 Ca -0.27 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 3d2c h ARG 33 Cb 1.12 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 3d2c h ARG 33 CO 0.87 0.12 0.00 -0.40 -1.51 0.00 0.00 179.97 179.04 3d2c n ASP 34 N -5.26 0.00 -0.70 -3.80 5.75 -1.26 -2.42 116.55 108.86 3d2c n ASP 34 Ca 0.16 -1.22 0.06 0.00 -0.01 0.00 0.00 54.79 53.78 3d2c n ASP 34 Cb 0.52 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.79 3d2c n ASP 34 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3d2c n LYS 35 N -0.76 2.89 -4.24 0.11 4.76 0.15 -4.91 118.16 116.14 3d2c n LYS 35 Ca 0.10 -2.31 -0.34 0.00 -2.87 0.00 0.00 58.31 52.89 3d2c n LYS 35 Cb 0.05 -1.46 -0.15 0.00 -1.84 0.00 0.00 35.03 31.63 3d2c n LYS 35 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3d2c s LEU 36 N -1.65 2.57 0.11 -0.35 1.43 -1.02 -1.23 118.68 118.54 3d2c s LEU 36 Ca 0.29 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 53.00 3d2c s LEU 36 Cb 0.19 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 3d2c s LEU 36 CO 0.13 0.04 -0.20 -0.31 0.23 0.00 0.00 176.35 176.23 3d2c s TYR 37 N 1.11 1.77 -0.06 0.29 1.51 0.16 -4.96 117.35 117.16 3d2c s TYR 37 Ca 0.00 -0.43 -0.00 0.00 -1.01 0.00 0.00 57.07 55.63 3d2c s TYR 37 Cb -0.14 -0.95 0.02 0.00 -0.11 0.00 0.00 41.96 40.78 3d2c s TYR 37 CO -0.04 0.22 -0.03 0.00 -1.11 0.00 0.00 175.55 174.60 3d2c s ALA 38 N -1.37 0.75 0.52 3.71 0.00 -1.26 0.36 121.76 124.48 3d2c s ALA 38 Ca 0.08 -0.13 -0.11 0.00 0.00 0.00 0.00 51.96 51.79 3d2c s ALA 38 Cb -0.09 -0.61 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 3d2c s ALA 38 CO 0.05 -0.25 0.92 0.54 0.00 0.00 0.00 175.76 177.02 3d2c s VAL 39 N 1.46 4.72 -0.26 0.00 0.11 -0.70 -4.81 120.40 120.91 3d2c s VAL 39 Ca -0.02 0.79 0.01 0.00 -2.93 0.00 0.00 61.98 59.82 3d2c s VAL 39 Cb -0.13 -3.80 0.07 0.00 -1.53 0.00 0.00 36.38 30.99 3d2c s VAL 39 CO -0.03 -0.85 0.00 -1.81 -3.33 0.00 0.00 175.10 169.08 3d2c s ASP 40 N -3.67 3.96 0.36 3.54 1.01 -1.26 -3.70 116.67 116.90 3d2c s ASP 40 Ca 0.54 -1.40 -0.24 0.00 0.71 0.00 0.00 52.55 52.15 3d2c s ASP 40 Cb -0.10 -1.14 -0.10 0.00 1.01 0.00 0.00 42.92 42.59 3d2c s ASP 40 CO 0.42 -0.30 0.95 -0.36 0.21 0.00 0.00 175.17 176.08 3d2c s PHE 41 N 1.40 3.57 0.01 4.23 0.08 -1.26 -4.97 117.98 121.04 3d2c s PHE 41 Ca 0.00 1.73 0.11 0.00 0.12 0.00 0.00 56.93 58.89 3d2c s PHE 41 Cb -0.18 -2.90 -0.17 0.00 -0.57 0.00 0.00 43.02 39.20 3d2c s PHE 41 CO -0.11 0.11 1.09 0.11 -0.10 0.00 0.00 175.22 176.32 3d2c h TRP 42 N 2.77 0.00 -2.27 0.36 5.08 -1.99 -3.42 115.95 116.48 3d2c h TRP 42 Ca -0.47 0.00 -0.57 0.00 1.08 0.00 0.00 58.89 58.93 3d2c h TRP 42 Cb 1.19 0.00 -0.10 0.00 -3.00 0.00 0.00 29.16 27.25 3d2c h TRP 42 CO 0.62 0.89 1.01 0.34 -1.28 0.00 0.00 178.44 180.01 3d2c s ASP 43 N -6.41 6.22 0.00 0.11 -1.08 -1.26 -4.84 116.67 109.40 3d2c s ASP 43 Ca -0.01 -0.71 0.11 0.00 -0.52 0.00 0.00 52.55 51.43 3d2c s ASP 43 Cb 0.09 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.59 3d2c s ASP 43 CO 0.81 -1.71 1.27 0.29 0.52 0.00 0.00 175.17 176.35 3d2c n LYS 44 N 8.93 0.15 0.00 4.34 4.76 -1.26 -1.47 118.16 133.61 3d2c n LYS 44 Ca 0.06 0.19 0.12 0.00 -2.87 0.00 0.00 58.31 55.80 3d2c n LYS 44 Cb 0.49 -1.50 0.18 0.00 -1.84 0.00 0.00 35.03 32.35 3d2c n LYS 44 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3d2c n THR 45 N -1.30 0.00 -3.79 -0.18 -2.24 -1.26 -1.06 114.28 104.45 3d2c n THR 45 Ca 0.05 -0.13 -0.28 0.00 -2.27 0.00 0.00 64.05 61.42 3d2c n THR 45 Cb 0.09 0.72 0.04 0.00 -2.10 0.00 0.00 70.33 69.08 3d2c n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d2c n GLY 46 N 1.41 -0.51 3.78 3.38 0.00 -0.55 -4.85 105.19 107.85 3d2c n GLY 46 Ca 0.09 0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.96 3d2c n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d2c s THR 47 N -3.29 3.48 0.18 2.61 -4.23 -1.26 -4.87 115.64 108.25 3d2c s THR 47 Ca 0.63 1.05 -0.12 0.00 -1.18 0.00 0.00 61.69 62.08 3d2c s THR 47 Cb -0.31 -3.50 0.09 0.00 1.34 0.00 0.00 72.50 70.12 3d2c s THR 47 CO 0.78 -0.07 1.77 0.78 -0.54 0.00 0.00 174.62 177.34 3d2c h ASN 48 N 2.01 0.81 -0.95 3.99 2.35 -1.93 -1.84 115.58 120.01 3d2c h ASN 48 Ca -0.49 -0.13 0.06 0.00 -0.55 0.00 0.00 56.30 55.19 3d2c h ASN 48 Cb 1.23 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 39.33 3d2c h ASN 48 CO 0.60 0.71 0.62 0.22 -1.65 0.00 0.00 177.43 177.93 3d2c h TYR 49 N 0.85 1.12 0.14 1.19 3.20 -2.00 0.24 116.97 121.72 3d2c h TYR 49 Ca 0.21 0.03 -0.32 0.00 3.14 0.00 0.00 58.73 61.79 3d2c h TYR 49 Cb 0.11 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.01 3d2c h TYR 49 CO -0.00 0.60 -1.59 -0.91 -1.64 0.00 0.00 178.16 174.62 3d2c h ASN 50 N 1.11 0.48 0.44 -2.11 2.35 -1.93 -3.40 115.58 112.53 3d2c h ASN 50 Ca 0.40 -0.66 -0.31 0.00 -0.55 0.00 0.00 56.30 55.18 3d2c h ASN 50 Cb 0.14 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 3d2c h ASN 50 CO -0.15 1.55 -1.53 0.78 -1.65 0.00 0.00 177.43 176.43 3d2c h ASN 51 N 0.08 0.40 -0.40 5.81 -0.26 -1.22 -3.34 115.58 116.66 3d2c h ASN 51 Ca -0.27 -0.56 0.08 0.00 -0.56 0.00 0.00 56.30 54.99 3d2c h ASN 51 Cb 2.05 -0.13 -0.09 0.00 -1.06 0.00 0.00 38.32 39.09 3d2c h ASN 51 CO 0.17 1.46 -0.33 1.23 -1.06 0.00 0.00 177.43 178.90 3d2c h GLY 52 N 1.62 -0.27 0.79 2.83 0.00 -0.71 0.40 103.07 107.73 3d2c h GLY 52 Ca -0.24 0.42 0.04 0.00 0.00 0.00 0.00 47.33 47.55 3d2c h GLY 52 CO 0.16 -0.21 0.34 -2.55 0.00 0.00 0.00 176.54 174.29 3d2c h PRO 53 N -0.26 0.64 -0.52 4.80 0.11 -1.76 -0.33 132.00 134.68 3d2c h PRO 53 Ca 0.17 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.24 3d2c h PRO 53 Cb 0.54 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.48 3d2c h PRO 53 CO -0.54 0.42 0.32 0.28 -0.21 0.00 0.00 178.00 178.27 3d2c h VAL 54 N 0.66 1.15 -0.59 3.15 2.07 -1.50 -1.60 116.25 119.59 3d2c h VAL 54 Ca 0.25 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.42 3d2c h VAL 54 Cb 0.09 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 3d2c h VAL 54 CO -0.13 0.15 0.24 0.25 0.02 0.00 0.00 177.57 178.09 3d2c h LEU 55 N 0.69 0.81 -0.21 2.57 5.85 -0.43 -0.90 115.31 123.70 3d2c h LEU 55 Ca 0.19 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.78 3d2c h LEU 55 Cb -0.03 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 3d2c h LEU 55 CO -0.04 0.76 -0.03 -1.28 -0.34 0.00 0.00 178.44 177.52 3d2c h SER 56 N 0.82 -0.14 -0.36 1.25 0.87 -0.66 -0.11 113.55 115.22 3d2c h SER 56 Ca 0.20 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 3d2c h SER 56 Cb 0.20 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 3d2c h SER 56 CO -0.02 -0.04 0.19 -0.09 -0.53 0.00 0.00 176.83 176.34 3d2c h ARG 57 N 0.03 0.52 -0.35 2.24 9.65 -1.13 -1.80 114.38 123.54 3d2c h ARG 57 Ca 0.10 -0.07 0.04 0.00 -1.10 0.00 0.00 59.98 58.95 3d2c h ARG 57 Cb 0.14 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.58 3d2c h ARG 57 CO -0.19 0.45 0.11 0.35 2.80 0.00 0.00 179.97 183.48 3d2c h PHE 58 N 0.45 0.19 -0.85 2.20 3.57 -0.68 0.13 116.94 121.95 3d2c h PHE 58 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3d2c h PHE 58 Cb 0.09 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 3d2c h PHE 58 CO -0.02 0.07 0.55 0.28 -2.23 0.00 0.00 178.31 176.96 3d2c h VAL 59 N 0.25 1.23 -0.37 1.41 2.07 -0.90 -1.11 116.25 118.82 3d2c h VAL 59 Ca 0.16 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3d2c h VAL 59 Cb 0.15 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 3d2c h VAL 59 CO -0.18 0.22 0.20 -0.61 0.02 0.00 0.00 177.57 177.23 3d2c h GLN 60 N 1.16 0.52 -0.63 1.57 5.75 -0.50 0.10 115.11 123.08 3d2c h GLN 60 Ca 0.31 -0.06 0.01 0.00 -0.15 0.00 0.00 58.65 58.76 3d2c h GLN 60 Cb -0.11 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.31 3d2c h GLN 60 CO -0.06 0.43 0.42 -0.22 -2.65 0.00 0.00 178.83 176.74 3d2c h LYS 61 N 0.47 0.82 -0.48 1.69 3.64 -0.63 0.12 116.57 122.21 3d2c h LYS 61 Ca 0.13 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3d2c h LYS 61 Cb 0.06 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3d2c h LYS 61 CO -0.02 0.54 0.30 0.28 -2.27 0.00 0.00 179.45 178.28 3d2c h VAL 62 N 0.85 1.14 -0.19 2.00 2.07 -0.76 -0.31 116.25 121.05 3d2c h VAL 62 Ca 0.24 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 3d2c h VAL 62 Cb -0.08 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 3d2c h VAL 62 CO -0.06 0.14 0.10 -0.07 0.02 0.00 0.00 177.57 177.70 3d2c h LEU 63 N 0.64 0.24 0.12 2.57 3.38 -0.48 -0.52 115.31 121.28 3d2c h LEU 63 Ca 0.17 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.07 3d2c h LEU 63 Cb -0.03 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3d2c h LEU 63 CO -0.03 0.27 -0.33 0.44 0.09 0.00 0.00 178.44 178.87 3d2c h ASP 64 N 0.20 -0.96 0.21 -0.43 3.32 -0.48 0.43 116.42 118.71 3d2c h ASP 64 Ca 0.07 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.23 3d2c h ASP 64 Cb 0.08 0.36 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 3d2c h ASP 64 CO -0.01 -0.42 -0.20 -0.08 -1.72 0.00 0.00 179.24 176.81 3d2c h GLU 65 N -0.56 -0.42 0.00 3.56 4.81 -0.94 -3.13 114.58 117.90 3d2c h GLU 65 Ca 0.03 0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3d2c h GLU 65 Cb 0.59 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 3d2c h GLU 65 CO -0.19 -0.28 -0.37 1.79 -0.73 0.00 0.00 179.01 179.22 3d2c h THR 66 N -0.43 0.72 0.00 0.32 1.35 -1.05 -3.47 112.91 110.34 3d2c h THR 66 Ca -0.00 -1.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.11 3d2c h THR 66 Cb 0.40 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 3d2c h THR 66 CO -0.04 0.37 0.00 0.61 -0.25 0.00 0.00 175.52 176.20 3d2c n GLY 67 N 0.81 0.74 3.77 5.82 0.00 0.15 -5.01 105.19 111.45 3d2c n GLY 67 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 3d2c n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d2c s ALA 68 N -2.96 2.23 -0.10 4.61 0.00 -1.22 -4.97 121.76 119.34 3d2c s ALA 68 Ca 0.00 0.25 0.15 0.00 0.00 0.00 0.00 51.96 52.37 3d2c s ALA 68 Cb 0.00 -3.27 -0.14 0.00 0.00 0.00 0.00 23.12 19.71 3d2c s ALA 68 CO 0.00 -1.79 0.84 0.87 0.00 0.00 0.00 175.76 175.69 3d2c h LYS 69 N -1.14 0.00 -3.47 0.00 1.57 -1.95 -3.45 116.57 108.13 3d2c h LYS 69 Ca -0.44 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.28 3d2c h LYS 69 Cb 1.23 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.40 3d2c h LYS 69 CO 0.51 0.37 -0.17 0.15 -0.57 0.00 0.00 179.45 179.74 3d2c s LYS 70 N -2.85 0.97 0.36 3.15 1.02 -1.26 -4.74 119.74 116.40 3d2c s LYS 70 Ca -0.03 -0.73 0.08 0.00 0.02 0.00 0.00 55.97 55.32 3d2c s LYS 70 Cb 0.08 0.42 -0.05 0.00 -0.52 0.00 0.00 37.83 37.76 3d2c s LYS 70 CO 0.81 -0.36 0.07 0.14 -0.92 0.00 0.00 175.35 175.10 3d2c s VAL 71 N -3.61 2.57 0.10 3.17 -7.23 0.09 -4.07 120.40 111.42 3d2c s VAL 71 Ca 0.02 -1.86 0.08 0.00 -1.81 0.00 0.00 61.98 58.41 3d2c s VAL 71 Cb 0.02 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 34.03 3d2c s VAL 71 CO -0.10 -0.14 -0.13 -1.81 -0.31 0.00 0.00 175.10 172.62 3d2c s ASP 72 N -3.78 4.23 -0.04 4.85 1.01 -0.04 -1.88 116.67 121.01 3d2c s ASP 72 Ca 0.37 -0.43 0.05 0.00 0.71 0.00 0.00 52.55 53.24 3d2c s ASP 72 Cb 0.01 -0.75 -0.01 0.00 1.01 0.00 0.00 42.92 43.19 3d2c s ASP 72 CO 0.21 0.18 -0.17 -0.63 0.21 0.00 0.00 175.17 174.97 3d2c s ILE 73 N -1.18 1.43 -0.21 0.77 1.01 0.25 -0.62 121.20 122.65 3d2c s ILE 73 Ca 0.20 -0.73 0.02 0.00 0.00 0.00 0.00 60.65 60.13 3d2c s ILE 73 Cb -0.11 -1.22 0.04 0.00 0.01 0.00 0.00 42.46 41.18 3d2c s ILE 73 CO 0.12 0.41 -0.15 -0.69 0.00 0.00 0.00 174.94 174.63 3d2c s VAL 74 N -0.08 2.00 0.05 2.92 1.01 -0.72 -0.40 120.40 125.18 3d2c s VAL 74 Ca -0.01 -1.18 0.08 0.00 0.00 0.00 0.00 61.98 60.87 3d2c s VAL 74 Cb -0.10 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 3d2c s VAL 74 CO 0.01 0.28 -0.22 0.00 0.00 0.00 0.00 175.10 175.17 3d2c s ALA 75 N 1.25 1.88 -0.11 5.51 0.00 0.32 -1.41 121.76 129.19 3d2c s ALA 75 Ca -0.01 -1.13 -0.00 0.00 0.00 0.00 0.00 51.96 50.82 3d2c s ALA 75 Cb -0.16 -0.36 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 3d2c s ALA 75 CO -0.09 0.42 -0.10 -1.58 0.00 0.00 0.00 175.76 174.41 3d2c s HIS 76 N -0.85 2.88 0.00 0.00 5.65 -0.21 0.66 115.29 123.42 3d2c s HIS 76 Ca 0.08 -0.37 0.00 0.00 0.25 0.00 0.00 55.06 55.03 3d2c s HIS 76 Cb -0.09 -1.82 0.00 0.00 -1.18 0.00 0.00 32.58 29.49 3d2c s HIS 76 CO 0.02 -0.01 0.00 0.45 -0.65 0.00 0.00 174.74 174.55 3d2c n SER 77 N 3.13 0.00 0.28 9.88 2.88 0.01 -0.50 113.62 129.30 3d2c n SER 77 Ca -0.18 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.54 3d2c n SER 77 Cb 0.53 0.00 0.97 0.00 -0.75 0.00 0.00 64.21 64.95 3d2c n SER 77 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 3d2c h MET 78 N 0.00 0.00 0.00 -1.46 1.85 -1.86 0.28 114.93 113.75 3d2c h MET 78 Ca 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.08 3d2c h MET 78 Cb 0.00 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.03 3d2c h MET 78 CO 0.00 0.00 -0.03 0.78 -0.40 0.00 0.00 176.91 177.26 3d2c h GLY 79 N 0.00 0.00 1.03 1.39 0.00 -0.74 -0.32 103.07 104.42 3d2c h GLY 79 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.26 3d2c h GLY 79 CO -0.00 0.00 -0.11 -1.33 0.00 0.00 0.00 176.54 175.10 3d2c h GLY 80 N 0.11 0.95 1.24 4.60 0.00 -0.59 0.03 103.07 109.42 3d2c h GLY 80 Ca -0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 47.33 46.43 3d2c h GLY 80 CO 0.00 0.72 -0.15 0.00 0.00 0.00 0.00 176.54 177.11 3d2c h ALA 81 N 0.87 0.86 -0.69 3.60 0.00 -1.20 -1.81 119.26 120.89 3d2c h ALA 81 Ca 0.12 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 3d2c h ALA 81 Cb 0.65 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 3d2c h ALA 81 CO 0.04 0.64 0.18 -0.91 0.00 0.00 0.00 179.25 179.20 3d2c h ASN 82 N 0.79 1.04 -0.48 0.00 2.35 -0.94 -1.52 115.58 116.82 3d2c h ASN 82 Ca 0.12 -0.21 -0.10 0.00 -0.55 0.00 0.00 56.30 55.56 3d2c h ASN 82 Cb 0.68 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 3d2c h ASN 82 CO 0.05 0.99 -0.08 0.74 -1.65 0.00 0.00 177.43 177.48 3d2c h THR 83 N 1.05 1.27 -0.15 2.81 2.02 -0.73 -0.90 112.91 118.28 3d2c h THR 83 Ca 0.22 -1.19 -0.12 0.00 0.77 0.00 0.00 66.41 66.09 3d2c h THR 83 Cb 0.35 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 3d2c h THR 83 CO 0.00 0.41 -0.41 -0.07 0.37 0.00 0.00 175.52 175.82 3d2c h LEU 84 N 0.74 0.36 -0.33 2.58 3.38 -1.20 -1.19 115.31 119.65 3d2c h LEU 84 Ca 0.13 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 3d2c h LEU 84 Cb 0.62 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3d2c h LEU 84 CO 0.04 0.74 -0.18 0.22 0.09 0.00 0.00 178.44 179.34 3d2c h TYR 85 N 0.28 0.81 -0.18 1.13 3.20 -1.10 0.17 116.97 121.29 3d2c h TYR 85 Ca 0.03 -0.21 0.00 0.00 3.14 0.00 0.00 58.73 61.69 3d2c h TYR 85 Cb 0.85 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.93 3d2c h TYR 85 CO 0.02 0.92 0.11 -0.92 -1.64 0.00 0.00 178.16 176.66 3d2c h TYR 86 N 0.47 0.22 -0.33 -3.82 3.20 -0.94 0.21 116.97 115.98 3d2c h TYR 86 Ca 0.07 0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.84 3d2c h TYR 86 Cb 0.72 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 3d2c h TYR 86 CO 0.06 0.15 -0.19 0.82 -1.64 0.00 0.00 178.16 177.36 3d2c h ILE 87 N 0.23 1.29 0.15 1.81 2.04 -1.13 -1.09 117.51 120.80 3d2c h ILE 87 Ca 0.06 -1.32 -0.29 0.00 1.00 0.00 0.00 64.86 64.31 3d2c h ILE 87 Cb -0.02 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3d2c h ILE 87 CO -0.01 0.43 -1.47 0.50 0.00 0.00 0.00 178.15 177.59 3d2c h LYS 88 N 0.48 0.31 0.00 2.37 3.64 -0.60 -2.88 116.57 119.90 3d2c h LYS 88 Ca 0.07 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 3d2c h LYS 88 Cb 0.73 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 3d2c h LYS 88 CO 0.05 1.25 -1.62 0.66 -2.27 0.00 0.00 179.45 177.53 3d2c n TYR 89 N -3.83 0.00 -0.18 1.91 4.02 0.72 -4.98 117.16 114.82 3d2c n TYR 89 Ca -0.24 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.65 3d2c n TYR 89 Cb 0.96 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 3d2c n TYR 89 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3d2c n LEU 90 N -1.98 0.00 -1.74 7.72 4.77 -1.03 -5.02 117.00 119.71 3d2c n LEU 90 Ca -0.02 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.04 3d2c n LEU 90 Cb 0.43 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.90 3d2c n LEU 90 CO 0.37 0.00 0.85 -0.90 -1.33 0.00 0.00 177.39 176.38 3d2c n ASP 91 N 0.00 5.34 0.00 -1.43 5.75 -1.21 -4.55 116.55 120.45 3d2c n ASP 91 Ca 0.00 -2.78 0.11 0.00 -0.01 0.00 0.00 54.79 52.11 3d2c n ASP 91 Cb 0.00 -0.64 0.50 0.00 -1.03 0.00 0.00 41.12 39.94 3d2c n ASP 91 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d2c n GLY 92 N 0.73 -1.25 0.42 6.12 0.00 -0.44 -4.19 105.19 106.58 3d2c n GLY 92 Ca 0.27 -0.08 0.32 0.00 0.00 0.00 0.00 46.02 46.53 3d2c n GLY 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d2c h GLY 93 N 3.88 1.54 -1.46 -0.02 0.00 -1.72 -2.32 103.07 102.97 3d2c h GLY 93 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.12 3d2c h GLY 93 CO 0.00 -0.42 -0.60 1.16 0.00 0.00 0.00 176.54 176.68 3d2c n ASN 94 N -4.81 1.47 0.00 0.19 0.23 -1.26 -0.20 115.26 110.88 3d2c n ASN 94 Ca 0.35 -3.13 0.00 0.00 -0.53 0.00 0.00 54.58 51.26 3d2c n ASN 94 Cb 1.25 -0.43 0.00 0.00 -2.08 0.00 0.00 39.78 38.52 3d2c n ASN 94 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3d2c n LYS 95 N -0.62 1.23 -4.56 -3.83 5.02 -0.87 -4.88 118.16 109.65 3d2c n LYS 95 Ca 0.14 -0.98 -0.22 0.00 -2.02 0.00 0.00 58.31 55.23 3d2c n LYS 95 Cb 0.82 -0.91 -0.15 0.00 -0.02 0.00 0.00 35.03 34.76 3d2c n LYS 95 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3d2c s VAL 96 N -0.51 1.01 -0.07 -0.18 1.01 -1.23 -0.73 120.40 119.69 3d2c s VAL 96 Ca 0.00 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 3d2c s VAL 96 Cb 0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 3d2c s VAL 96 CO 0.00 0.29 -0.15 0.00 0.00 0.00 0.00 175.10 175.24 3d2c n ALA 97 N 2.99 2.18 -2.77 5.51 0.00 -0.79 -4.72 120.51 122.91 3d2c n ALA 97 Ca -0.16 -0.41 -0.32 0.00 0.00 0.00 0.00 53.44 52.55 3d2c n ALA 97 Cb 0.55 0.26 -0.15 0.00 0.00 0.00 0.00 19.45 20.10 3d2c n ALA 97 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3d2c s ASN 98 N -6.01 3.44 -0.06 0.00 0.01 -1.26 -1.74 114.94 109.32 3d2c s ASN 98 Ca -0.14 -0.42 0.03 0.00 -0.71 0.00 0.00 52.86 51.62 3d2c s ASN 98 Cb 0.04 -1.01 0.00 0.00 0.41 0.00 0.00 41.25 40.70 3d2c s ASN 98 CO 0.19 0.25 -0.15 -0.69 -1.51 0.00 0.00 177.10 175.19 3d2c s VAL 99 N -0.16 1.33 -0.10 1.60 1.01 -0.10 -0.58 120.40 123.40 3d2c s VAL 99 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.33 3d2c s VAL 99 Cb -0.14 -1.17 0.02 0.00 0.00 0.00 0.00 36.38 35.10 3d2c s VAL 99 CO 0.04 0.39 -0.09 -0.69 0.00 0.00 0.00 175.10 174.75 3d2c s VAL 100 N 0.31 1.05 0.05 2.92 1.01 0.46 -1.32 120.40 124.88 3d2c s VAL 100 Ca -0.09 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.59 3d2c s VAL 100 Cb -0.14 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3d2c s VAL 100 CO 0.03 0.36 -0.03 0.42 0.00 0.00 0.00 175.10 175.88 3d2c s THR 101 N 1.42 3.84 -0.26 3.92 -4.23 -0.45 -0.52 115.64 119.36 3d2c s THR 101 Ca -0.00 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.63 3d2c s THR 101 Cb -0.13 -2.76 0.06 0.00 1.34 0.00 0.00 72.50 71.00 3d2c s THR 101 CO -0.05 0.24 -0.10 -0.76 -0.54 0.00 0.00 174.62 173.41 3d2c s LEU 102 N -1.91 3.44 -1.41 4.79 1.43 0.21 -1.14 118.68 124.11 3d2c s LEU 102 Ca 0.22 -1.34 -0.10 0.00 -1.03 0.00 0.00 54.13 51.87 3d2c s LEU 102 Cb -0.11 -1.57 0.07 0.00 0.03 0.00 0.00 46.19 44.61 3d2c s LEU 102 CO 0.13 -0.19 0.64 0.61 0.23 0.00 0.00 176.35 177.77 3d2c n GLY 103 N 4.47 -0.49 3.77 -3.19 0.00 0.11 -0.81 105.19 109.05 3d2c n GLY 103 Ca -0.14 0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 3d2c n GLY 103 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d2c s GLY 104 N -2.88 2.98 -0.93 -0.02 0.00 -1.26 -3.37 107.32 101.84 3d2c s GLY 104 Ca 0.47 1.28 -0.05 0.00 0.00 0.00 0.00 44.72 46.42 3d2c s GLY 104 CO 0.58 1.92 2.64 0.00 0.00 0.00 0.00 173.10 178.24 3d2c n ALA 105 N 0.66 6.69 -0.37 3.20 0.00 -0.54 -3.06 120.51 127.10 3d2c n ALA 105 Ca 0.01 -3.53 -0.00 0.00 0.00 0.00 0.00 53.44 49.91 3d2c n ALA 105 Cb 0.42 -2.54 0.14 0.00 0.00 0.00 0.00 19.45 17.47 3d2c n ALA 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3d2c h ASN 106 N 3.91 1.11 0.12 0.00 2.35 -1.73 -2.33 115.58 119.01 3d2c h ASN 106 Ca 0.57 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.30 3d2c h ASN 106 Cb 0.53 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.64 3d2c h ASN 106 CO 1.19 0.78 0.00 0.54 -1.65 0.00 0.00 177.43 178.29 3d2c n ARG 107 N -4.42 0.20 0.20 0.81 5.12 -0.23 -1.15 116.66 117.19 3d2c n ARG 107 Ca 0.13 0.13 0.14 0.00 -1.93 0.00 0.00 57.85 56.32 3d2c n ARG 107 Cb 0.06 -1.50 0.51 0.00 -1.16 0.00 0.00 32.46 30.38 3d2c n ARG 107 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 3d2c h LEU 108 N 0.00 0.00 0.00 0.55 -0.00 -1.70 -3.36 115.31 110.80 3d2c h LEU 108 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 3d2c h LEU 108 Cb 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.71 3d2c h LEU 108 CO 0.00 0.00 -0.89 0.41 -0.00 0.00 0.00 178.44 177.96 3d2c n THR 109 N -2.72 0.82 -3.89 0.22 -1.04 -0.30 -5.08 114.28 102.29 3d2c n THR 109 Ca 0.02 0.10 -0.09 0.00 -2.04 0.00 0.00 64.05 62.04 3d2c n THR 109 Cb 0.33 -1.69 -0.05 0.00 -1.82 0.00 0.00 70.33 67.10 3d2c n THR 109 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3d2c s THR 110 N -2.19 0.03 -0.14 12.58 -1.32 -0.96 -5.02 115.64 118.62 3d2c s THR 110 Ca -0.09 -1.16 0.16 0.00 -1.21 0.00 0.00 61.69 59.38 3d2c s THR 110 Cb 0.03 -1.86 -0.24 0.00 -1.51 0.00 0.00 72.50 68.91 3d2c s THR 110 CO 0.12 -0.13 0.29 0.47 -2.21 0.00 0.00 174.62 173.17 3d2c n ASP 111 N -0.32 0.32 -4.59 8.08 8.00 -1.26 -3.60 116.55 123.18 3d2c n ASP 111 Ca -0.06 0.15 -0.32 0.00 0.71 0.00 0.00 54.79 55.27 3d2c n ASP 111 Cb 0.62 0.62 -0.11 0.00 -0.02 0.00 0.00 41.12 42.23 3d2c n ASP 111 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3d2c s LYS 112 N -2.54 2.59 -0.13 -1.24 1.02 -1.26 -0.38 119.74 117.79 3d2c s LYS 112 Ca -0.08 -0.69 -0.29 0.00 0.02 0.00 0.00 55.97 54.93 3d2c s LYS 112 Cb 0.07 -2.52 -0.05 0.00 -0.52 0.00 0.00 37.83 34.81 3d2c s LYS 112 CO 0.83 0.61 1.90 0.00 -0.92 0.00 0.00 175.35 177.77 3d2c s ALA 113 N -0.96 3.23 0.09 5.17 0.00 -0.79 -4.87 121.76 123.63 3d2c s ALA 113 Ca 0.16 0.84 -0.31 0.00 0.00 0.00 0.00 51.96 52.65 3d2c s ALA 113 Cb -0.11 -3.91 -0.10 0.00 0.00 0.00 0.00 23.12 19.00 3d2c s ALA 113 CO 0.06 -2.05 1.82 -2.14 0.00 0.00 0.00 175.76 173.46 3d2c s PRO 114 N 5.06 4.15 0.50 0.00 0.02 -1.26 -4.86 135.00 138.60 3d2c s PRO 114 Ca 0.85 2.55 0.28 0.00 0.02 0.00 0.00 61.00 64.70 3d2c s PRO 114 Cb -0.33 -3.71 1.28 0.00 0.02 0.00 0.00 34.50 31.77 3d2c s PRO 114 CO 0.35 -0.85 1.98 -1.35 -0.33 0.00 0.00 177.00 176.80 3d2c h PRO 115 N 8.94 0.00 0.00 5.54 0.11 -1.91 -3.41 132.00 141.26 3d2c h PRO 115 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3d2c h PRO 115 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3d2c h PRO 115 CO 0.94 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 179.28 3d2c n GLY 116 N -0.27 -2.27 0.34 -0.55 0.00 -1.26 -1.46 105.19 99.71 3d2c n GLY 116 Ca -0.01 -1.76 0.09 0.00 0.00 0.00 0.00 46.02 44.34 3d2c n GLY 116 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d2c n THR 117 N -0.14 2.04 -3.47 2.61 -2.24 0.72 -4.94 114.28 108.85 3d2c n THR 117 Ca 0.00 -2.33 -0.42 0.00 -2.27 0.00 0.00 64.05 59.03 3d2c n THR 117 Cb 0.00 -0.25 -0.10 0.00 -2.10 0.00 0.00 70.33 67.88 3d2c n THR 117 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d2c s ASP 118 N -2.72 6.10 0.49 3.42 -1.08 -1.25 -4.83 116.67 116.80 3d2c s ASP 118 Ca 0.35 -0.73 0.14 0.00 -0.52 0.00 0.00 52.55 51.79 3d2c s ASP 118 Cb 0.31 -2.16 1.14 0.00 -1.46 0.00 0.00 42.92 40.76 3d2c s ASP 118 CO 0.03 -0.39 2.11 -0.65 0.52 0.00 0.00 175.17 176.80 3d2c h PRO 119 N 8.59 0.14 0.09 4.34 0.11 -1.97 -2.96 132.00 140.34 3d2c h PRO 119 Ca -0.28 -0.01 -0.29 0.00 0.11 0.00 0.00 66.00 65.53 3d2c h PRO 119 Cb 1.13 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3d2c h PRO 119 CO 0.70 0.11 -1.44 -0.91 -0.21 0.00 0.00 178.00 176.25 3d2c h ASN 120 N 0.14 0.29 -3.23 -2.05 2.35 -2.02 -3.45 115.58 107.62 3d2c h ASN 120 Ca 0.04 -0.40 -0.50 0.00 -0.55 0.00 0.00 56.30 54.89 3d2c h ASN 120 Cb 0.01 -0.10 -0.38 0.00 0.05 0.00 0.00 38.32 37.91 3d2c h ASN 120 CO -0.01 1.33 -0.79 -1.58 -1.65 0.00 0.00 177.43 174.73 3d2c s GLN 121 N -2.63 1.18 0.21 0.81 0.74 -1.12 -5.13 119.66 113.72 3d2c s GLN 121 Ca -0.07 -0.18 -0.27 0.00 0.05 0.00 0.00 55.36 54.89 3d2c s GLN 121 Cb 0.07 -1.47 -0.09 0.00 1.10 0.00 0.00 33.01 32.63 3d2c s GLN 121 CO 0.85 -0.32 0.86 0.21 -0.55 0.00 0.00 175.29 176.34 3d2c s LYS 122 N 1.79 4.70 0.23 1.67 2.20 -1.26 -4.34 119.74 124.74 3d2c s LYS 122 Ca 0.04 1.32 -0.30 0.00 -0.36 0.00 0.00 55.97 56.67 3d2c s LYS 122 Cb -0.13 -3.25 -0.09 0.00 -1.51 0.00 0.00 37.83 32.84 3d2c s LYS 122 CO -0.07 0.54 1.36 0.42 -0.36 0.00 0.00 175.35 177.23 3d2c s ILE 123 N -1.18 2.94 -0.08 5.43 1.01 -0.54 -5.00 121.20 123.78 3d2c s ILE 123 Ca 0.39 0.80 -0.02 0.00 0.00 0.00 0.00 60.65 61.81 3d2c s ILE 123 Cb -0.24 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 3d2c s ILE 123 CO 0.29 0.13 0.02 -0.76 0.00 0.00 0.00 174.94 174.62 3d2c s LEU 124 N -0.43 3.70 0.04 2.97 1.43 -0.71 -4.65 118.68 121.02 3d2c s LEU 124 Ca 0.57 0.18 0.06 0.00 -1.03 0.00 0.00 54.13 53.91 3d2c s LEU 124 Cb -0.39 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 3d2c s LEU 124 CO 0.42 0.37 -0.18 -0.31 0.23 0.00 0.00 176.35 176.88 3d2c s TYR 125 N -0.92 1.58 -0.18 0.29 1.51 -0.15 -0.92 117.35 118.56 3d2c s TYR 125 Ca 0.14 -0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 55.82 3d2c s TYR 125 Cb -0.11 -0.95 0.05 0.00 -0.11 0.00 0.00 41.96 40.84 3d2c s TYR 125 CO 0.03 0.06 0.02 0.99 -1.11 0.00 0.00 175.55 175.55 3d2c s THR 126 N -0.78 0.56 -0.31 -0.71 2.01 -0.44 -1.35 115.64 114.63 3d2c s THR 126 Ca 0.05 -0.48 -0.10 0.00 0.31 0.00 0.00 61.69 61.47 3d2c s THR 126 Cb -0.08 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.42 3d2c s THR 126 CO 0.01 -0.12 0.16 -0.55 -0.69 0.00 0.00 174.62 173.43 3d2c s SER 127 N 1.85 5.57 -0.11 3.53 0.15 0.19 -1.34 113.70 123.55 3d2c s SER 127 Ca -0.00 -0.53 -0.03 0.00 0.70 0.00 0.00 55.95 56.09 3d2c s SER 127 Cb -0.16 -2.01 -0.03 0.00 -1.71 0.00 0.00 66.02 62.11 3d2c s SER 127 CO -0.07 -0.20 0.02 -0.63 1.20 0.00 0.00 173.24 173.56 3d2c s ILE 128 N 1.62 4.46 -0.04 6.45 1.01 -0.29 -0.23 121.20 134.17 3d2c s ILE 128 Ca 0.05 -0.18 -0.25 0.00 0.00 0.00 0.00 60.65 60.26 3d2c s ILE 128 Cb -0.17 -2.90 0.05 0.00 0.01 0.00 0.00 42.46 39.45 3d2c s ILE 128 CO 0.06 0.58 0.55 -0.72 0.00 0.00 0.00 174.94 175.41 3d2c s TYR 129 N -0.64 -0.49 -0.17 3.97 -0.85 -0.57 0.07 117.35 118.67 3d2c s TYR 129 Ca 0.11 0.83 -0.08 0.00 -0.52 0.00 0.00 57.07 57.41 3d2c s TYR 129 Cb -0.12 0.30 -0.04 0.00 0.38 0.00 0.00 41.96 42.48 3d2c s TYR 129 CO 0.02 -0.53 0.11 0.45 -1.52 0.00 0.00 175.55 174.09 3d2c s SER 130 N -1.23 6.11 0.56 -0.18 0.15 -1.26 -1.18 113.70 116.68 3d2c s SER 130 Ca -0.12 0.27 0.36 0.00 0.70 0.00 0.00 55.95 57.17 3d2c s SER 130 Cb -0.02 -2.03 1.75 0.00 -1.71 0.00 0.00 66.02 64.01 3d2c s SER 130 CO 0.08 0.26 2.10 0.77 1.20 0.00 0.00 173.24 177.64 3d2c h SER 131 N 6.08 0.00 -0.62 5.45 4.64 -1.68 -1.54 113.55 125.89 3d2c h SER 131 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3d2c h SER 131 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3d2c h SER 131 CO 0.69 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.12 3d2c n ASP 132 N -2.96 5.20 -4.67 4.97 8.00 -1.26 -4.92 116.55 120.91 3d2c n ASP 132 Ca -0.01 -2.67 -0.43 0.00 0.71 0.00 0.00 54.79 52.40 3d2c n ASP 132 Cb 0.19 -0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 40.64 3d2c n ASP 132 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3d2c s ASP 133 N -0.88 7.14 0.05 -2.24 -1.08 -0.58 -4.58 116.67 114.50 3d2c s ASP 133 Ca 0.53 1.42 0.23 0.00 -0.52 0.00 0.00 52.55 54.21 3d2c s ASP 133 Cb 0.37 -2.54 0.14 0.00 -1.46 0.00 0.00 42.92 39.43 3d2c s ASP 133 CO 0.21 -0.61 1.12 0.23 0.52 0.00 0.00 175.17 176.64 3d2c n MET 134 N 5.98 0.24 -0.10 4.34 2.81 -1.26 -4.54 117.12 124.59 3d2c n MET 134 Ca 0.11 0.01 -0.18 0.00 -1.81 0.00 0.00 57.70 55.84 3d2c n MET 134 Cb 0.47 -1.60 -0.08 0.00 -0.71 0.00 0.00 33.22 31.30 3d2c n MET 134 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3d2c n ILE 135 N -1.92 1.50 -3.85 2.02 2.08 -1.26 -4.89 119.36 113.04 3d2c n ILE 135 Ca 0.03 0.00 -0.36 0.00 0.56 0.00 0.00 62.75 62.98 3d2c n ILE 135 Cb 0.42 -2.13 -0.13 0.00 -0.75 0.00 0.00 39.64 37.05 3d2c n ILE 135 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3d2c s VAL 136 N -2.38 3.57 0.45 1.39 1.01 -1.26 -5.09 120.40 118.10 3d2c s VAL 136 Ca -0.26 -0.64 -0.25 0.00 0.00 0.00 0.00 61.98 60.83 3d2c s VAL 136 Cb 0.06 -2.75 -0.09 0.00 0.00 0.00 0.00 36.38 33.60 3d2c s VAL 136 CO 0.47 0.24 1.32 0.23 0.00 0.00 0.00 175.10 177.36 3d2c n MET 137 N 4.81 1.96 0.28 2.72 2.81 -1.26 -4.85 117.12 123.58 3d2c n MET 137 Ca -0.16 0.70 0.13 0.00 -1.81 0.00 0.00 57.70 56.56 3d2c n MET 137 Cb 0.49 -2.47 0.80 0.00 -0.71 0.00 0.00 33.22 31.33 3d2c n MET 137 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 3d2c h ASN 138 N 2.01 0.00 -0.61 7.83 -0.26 -1.90 -1.18 115.58 121.46 3d2c h ASN 138 Ca -0.49 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.24 3d2c h ASN 138 Cb 1.29 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.52 3d2c h ASN 138 CO 0.60 0.07 0.35 0.22 -1.06 0.00 0.00 177.43 177.61 3d2c h TYR 139 N 0.00 0.84 0.00 1.19 5.03 -1.95 -2.12 116.97 119.95 3d2c h TYR 139 Ca -0.00 -0.01 -0.14 0.00 2.58 0.00 0.00 58.73 61.16 3d2c h TYR 139 Cb 0.19 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.18 3d2c h TYR 139 CO 0.00 0.58 -0.66 -0.07 -1.32 0.00 0.00 178.16 176.69 3d2c h LEU 140 N 0.87 0.00 -0.06 2.82 3.38 -1.53 -3.29 115.31 117.50 3d2c h LEU 140 Ca 0.23 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.97 3d2c h LEU 140 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3d2c h LEU 140 CO -0.04 0.66 -1.04 0.28 0.09 0.00 0.00 178.44 178.39 3d2c h SER 141 N 0.00 0.27 -2.81 -0.43 0.02 -1.32 -0.49 113.55 108.79 3d2c h SER 141 Ca -0.01 -0.26 -0.53 0.00 -0.84 0.00 0.00 61.79 60.15 3d2c h SER 141 Cb 1.20 -0.09 0.02 0.00 0.14 0.00 0.00 62.40 63.68 3d2c h SER 141 CO 0.09 1.14 0.89 -0.13 -1.14 0.00 0.00 176.83 177.68 3d2c s ARG 142 N -2.89 4.24 -0.12 3.45 0.52 -0.88 -4.75 118.95 118.51 3d2c s ARG 142 Ca -0.02 2.25 0.01 0.00 -0.52 0.00 0.00 55.73 57.44 3d2c s ARG 142 Cb 0.09 -3.41 -0.01 0.00 0.52 0.00 0.00 34.95 32.14 3d2c s ARG 142 CO 0.85 -0.62 -0.15 -0.51 0.02 0.00 0.00 175.30 174.88 3d2c s LEU 143 N 1.91 2.58 0.06 2.53 1.43 -1.26 -4.83 118.68 121.09 3d2c s LEU 143 Ca 0.70 -0.38 -0.31 0.00 -1.03 0.00 0.00 54.13 53.11 3d2c s LEU 143 Cb -0.39 -1.57 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 3d2c s LEU 143 CO 0.31 0.16 1.64 -1.81 0.23 0.00 0.00 176.35 176.88 3d2c s ASP 144 N 0.37 6.62 0.00 2.29 1.01 0.48 -2.22 116.67 125.23 3d2c s ASP 144 Ca -0.12 2.45 0.00 0.00 0.71 0.00 0.00 52.55 55.58 3d2c s ASP 144 Cb -0.16 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.21 3d2c s ASP 144 CO 0.06 -0.88 0.00 0.61 0.21 0.00 0.00 175.17 175.17 3d2c n GLY 145 N 3.98 1.87 3.97 0.21 0.00 -1.26 -1.89 105.19 112.07 3d2c n GLY 145 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 3d2c n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d2c s ALA 146 N -2.47 3.99 -0.57 4.61 0.00 -0.94 -0.22 121.76 126.15 3d2c s ALA 146 Ca 0.00 -1.26 -0.27 0.00 0.00 0.00 0.00 51.96 50.43 3d2c s ALA 146 Cb 0.00 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.23 3d2c s ALA 146 CO 0.00 -0.25 1.10 0.50 0.00 0.00 0.00 175.76 177.11 3d2c s ARG 147 N -4.40 3.43 -0.24 0.00 3.52 -0.46 -4.88 118.95 115.93 3d2c s ARG 147 Ca 0.47 0.04 -0.15 0.00 -0.13 0.00 0.00 55.73 55.96 3d2c s ARG 147 Cb -0.10 -4.03 -0.04 0.00 -1.56 0.00 0.00 34.95 29.22 3d2c s ARG 147 CO 0.35 -1.62 0.35 -0.80 -0.81 0.00 0.00 175.30 172.78 3d2c s ASN 148 N 2.93 6.31 -0.14 -2.12 0.01 -1.26 -0.63 114.94 120.04 3d2c s ASN 148 Ca 0.38 0.36 0.02 0.00 -0.71 0.00 0.00 52.86 52.90 3d2c s ASN 148 Cb -0.09 -2.21 0.02 0.00 0.41 0.00 0.00 41.25 39.38 3d2c s ASN 148 CO 0.23 -0.11 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.84 3d2c s VAL 149 N 1.62 1.82 -0.14 1.60 1.01 0.68 -4.96 120.40 122.02 3d2c s VAL 149 Ca 0.16 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 3d2c s VAL 149 Cb -0.15 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 3d2c s VAL 149 CO 0.08 0.50 0.04 -1.58 0.00 0.00 0.00 175.10 174.14 3d2c s GLN 150 N 1.10 3.55 0.36 2.72 0.74 -1.26 -1.52 119.66 125.36 3d2c s GLN 150 Ca -0.02 -0.36 0.01 0.00 0.05 0.00 0.00 55.36 55.04 3d2c s GLN 150 Cb -0.14 -3.03 -0.00 0.00 1.10 0.00 0.00 33.01 30.93 3d2c s GLN 150 CO -0.06 0.47 0.02 0.44 -0.55 0.00 0.00 175.29 175.61 3d2c n ILE 151 N 2.90 0.00 -4.10 -2.34 -0.00 -0.32 -4.97 119.36 110.52 3d2c n ILE 151 Ca -0.18 -1.79 -0.07 0.00 -0.00 0.00 0.00 62.75 60.71 3d2c n ILE 151 Cb 0.53 0.42 -0.10 0.00 -0.00 0.00 0.00 39.64 40.49 3d2c n ILE 151 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.55 175.55 3d2c s HIS 152 N -2.44 0.57 -0.58 4.28 3.76 -1.26 -1.85 115.29 117.77 3d2c s HIS 152 Ca 0.04 -1.05 0.00 0.00 -0.15 0.00 0.00 55.06 53.89 3d2c s HIS 152 Cb 0.00 -0.41 0.00 0.00 1.11 0.00 0.00 32.58 33.28 3d2c s HIS 152 CO 0.02 -0.35 0.00 0.41 -0.85 0.00 0.00 174.74 173.97 3d2c n GLY 153 N 0.09 0.80 3.13 -2.22 0.00 -1.26 -4.97 105.19 100.75 3d2c n GLY 153 Ca -0.14 -0.70 -0.25 0.00 0.00 0.00 0.00 46.02 44.94 3d2c n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d2c s VAL 154 N -2.17 1.31 0.64 1.61 1.01 -1.26 -5.06 120.40 116.47 3d2c s VAL 154 Ca 0.00 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 3d2c s VAL 154 Cb 0.00 -1.11 0.03 0.00 0.00 0.00 0.00 36.38 35.30 3d2c s VAL 154 CO 0.00 0.38 0.94 -0.83 0.00 0.00 0.00 175.10 175.59 3d2c s GLY 155 N -0.14 1.66 0.13 4.51 0.00 -1.26 -3.91 107.32 108.31 3d2c s GLY 155 Ca 0.01 -0.85 -0.33 0.00 0.00 0.00 0.00 44.72 43.55 3d2c s GLY 155 CO 0.01 -0.51 1.55 0.84 0.00 0.00 0.00 173.10 174.99 3d2c h HIS 156 N -0.34 -1.67 -0.20 1.90 2.76 -1.94 -1.23 115.15 114.43 3d2c h HIS 156 Ca -0.45 0.07 -0.12 0.00 -2.20 0.00 0.00 60.37 57.68 3d2c h HIS 156 Cb 1.29 0.77 -0.01 0.00 1.55 0.00 0.00 27.41 31.00 3d2c h HIS 156 CO 0.40 -0.51 -0.39 0.52 -1.30 0.00 0.00 177.93 176.65 3d2c h MET 157 N -0.47 0.46 -0.19 5.26 2.86 -2.00 -2.99 114.93 117.86 3d2c h MET 157 Ca 0.06 -0.22 0.05 0.00 -2.06 0.00 0.00 59.70 57.53 3d2c h MET 157 Cb 0.63 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 3d2c h MET 157 CO -0.53 0.78 0.32 0.78 1.06 0.00 0.00 176.91 179.31 3d2c h GLY 158 N 1.10 0.00 1.25 8.32 0.00 -1.63 -0.86 103.07 111.26 3d2c h GLY 158 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.44 3d2c h GLY 158 CO 0.07 0.00 0.33 1.41 0.00 0.00 0.00 176.54 178.35 3d2c h LEU 159 N 0.00 0.31 -1.61 3.11 3.38 -1.21 -1.51 115.31 117.78 3d2c h LEU 159 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3d2c h LEU 159 Cb 0.72 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.41 3d2c h LEU 159 CO -0.00 0.20 0.00 -0.07 0.09 0.00 0.00 178.44 178.66 3d2c h LEU 160 N 0.35 0.00 -2.37 1.67 3.38 -1.37 -3.13 115.31 113.84 3d2c h LEU 160 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3d2c h LEU 160 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3d2c h LEU 160 CO -0.05 0.00 -0.12 -1.22 0.09 0.00 0.00 178.44 177.14 3d2c n TYR 161 N -2.70 0.00 -2.71 1.13 4.01 -0.61 -4.19 117.16 112.09 3d2c n TYR 161 Ca -0.00 -0.44 -0.43 0.00 -0.16 0.00 0.00 57.90 56.87 3d2c n TYR 161 Cb 0.18 -0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 39.11 3d2c n TYR 161 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3d2c s SER 162 N -1.40 6.99 0.58 7.72 0.15 -0.97 -4.89 113.70 121.89 3d2c s SER 162 Ca 0.10 1.21 0.28 0.00 0.70 0.00 0.00 55.95 58.24 3d2c s SER 162 Cb 0.09 -2.52 1.70 0.00 -1.71 0.00 0.00 66.02 63.58 3d2c s SER 162 CO 0.01 -0.69 2.17 0.77 1.20 0.00 0.00 173.24 176.69 3d2c h SER 163 N 7.68 0.00 0.21 5.45 4.64 -1.92 0.36 113.55 129.96 3d2c h SER 163 Ca -0.20 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.97 3d2c h SER 163 Cb 1.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 3d2c h SER 163 CO 0.97 0.00 -0.56 -0.61 -0.87 0.00 0.00 176.83 175.76 3d2c h GLN 164 N 0.00 0.37 -0.10 4.77 4.15 -1.97 -2.56 115.11 119.77 3d2c h GLN 164 Ca 0.05 -0.24 -0.16 0.00 0.77 0.00 0.00 58.65 59.07 3d2c h GLN 164 Cb 0.26 0.03 0.01 0.00 0.21 0.00 0.00 27.48 27.99 3d2c h GLN 164 CO -0.00 0.83 -0.55 0.28 -1.93 0.00 0.00 178.83 177.47 3d2c h VAL 165 N 0.28 1.36 -0.55 2.39 2.07 -0.73 -3.09 116.25 117.98 3d2c h VAL 165 Ca 0.00 -1.86 0.11 0.00 0.82 0.00 0.00 66.70 65.77 3d2c h VAL 165 Cb 1.07 2.18 -0.11 0.00 -1.52 0.00 0.00 31.29 32.92 3d2c h VAL 165 CO 0.10 0.56 -0.26 1.88 0.02 0.00 0.00 177.57 179.87 3d2c h TYR 166 N 0.17 -0.66 -1.00 1.57 0.05 -0.62 0.26 116.97 116.73 3d2c h TYR 166 Ca -0.04 0.06 0.05 0.00 0.05 0.00 0.00 58.73 58.85 3d2c h TYR 166 Cb 1.19 0.37 -0.06 0.00 1.01 0.00 0.00 36.73 39.24 3d2c h TYR 166 CO 0.11 -0.33 0.65 0.77 -1.05 0.00 0.00 178.16 178.31 3d2c h SER 167 N -0.12 1.07 0.13 3.88 0.02 -1.50 -1.85 113.55 115.19 3d2c h SER 167 Ca 0.25 -0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.05 3d2c h SER 167 Cb 0.51 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 3d2c h SER 167 CO -0.63 0.71 -0.51 -0.07 -1.14 0.00 0.00 176.83 175.19 3d2c h LEU 168 N 1.22 0.47 -0.28 5.07 3.38 -1.06 -2.04 115.31 122.06 3d2c h LEU 168 Ca 0.41 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 3d2c h LEU 168 Cb 0.08 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3d2c h LEU 168 CO -0.14 0.90 0.10 0.40 0.09 0.00 0.00 178.44 179.78 3d2c h ILE 169 N 0.33 1.19 -0.39 1.22 2.04 -0.51 -0.67 117.51 120.72 3d2c h ILE 169 Ca 0.01 -0.59 0.06 0.00 1.00 0.00 0.00 64.86 65.34 3d2c h ILE 169 Cb 1.01 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 38.10 3d2c h ILE 169 CO 0.09 0.20 0.09 0.50 0.00 0.00 0.00 178.15 179.03 3d2c h LYS 170 N 0.30 0.21 -0.30 2.37 3.64 -1.21 0.16 116.57 121.74 3d2c h LYS 170 Ca 0.09 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 3d2c h LYS 170 Cb 0.21 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 3d2c h LYS 170 CO -0.01 0.14 0.04 0.93 -2.27 0.00 0.00 179.45 178.29 3d2c h GLU 171 N 0.22 0.14 -0.15 1.90 5.08 -1.04 -0.26 114.58 120.47 3d2c h GLU 171 Ca 0.19 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3d2c h GLU 171 Cb 0.21 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3d2c h GLU 171 CO -0.23 0.09 0.10 0.78 -1.00 0.00 0.00 179.01 178.75 3d2c h GLY 172 N 0.15 0.22 2.00 -3.84 0.00 -0.25 0.35 103.07 101.69 3d2c h GLY 172 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 3d2c h GLY 172 CO -0.20 0.08 -0.04 1.41 0.00 0.00 0.00 176.54 177.78 3d2c h LEU 173 N 0.20 0.00 -2.84 3.11 3.38 -0.33 -0.39 115.31 118.45 3d2c h LEU 173 Ca 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 3d2c h LEU 173 Cb -0.02 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3d2c h LEU 173 CO -0.02 0.04 0.11 0.59 0.09 0.00 0.00 178.44 179.25 3d2c n ASN 174 N -3.29 3.97 0.00 -0.43 3.02 -0.14 -4.86 115.26 113.53 3d2c n ASN 174 Ca -0.02 -2.72 0.00 0.00 -0.03 0.00 0.00 54.58 51.81 3d2c n ASN 174 Cb 0.20 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 3d2c n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d2c n GLY 175 N 0.17 0.58 0.65 7.41 0.00 -0.16 -4.93 105.19 108.91 3d2c n GLY 175 Ca 0.23 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3d2c n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2c n GLY 176 N -2.83 1.59 0.00 -0.02 0.00 0.12 -4.81 105.19 99.24 3d2c n GLY 176 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3d2c n GLY 176 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2c n GLY 177 N 0.17 0.21 3.46 -0.02 0.00 -1.26 -4.64 105.19 103.10 3d2c n GLY 177 Ca 0.00 -1.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.07 3d2c n GLY 177 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3d2c s GLN 178 N -0.25 1.17 -0.39 1.61 0.74 -0.68 -4.80 119.66 117.06 3d2c s GLN 178 Ca 0.00 -0.22 0.01 0.00 0.05 0.00 0.00 55.36 55.20 3d2c s GLN 178 Cb 0.00 0.54 0.19 0.00 1.10 0.00 0.00 33.01 34.84 3d2c s GLN 178 CO 0.00 -0.47 0.83 1.21 -0.55 0.00 0.00 175.29 176.31 3d2c s ASN 179 N -2.21 -1.00 -0.22 6.67 3.84 -0.88 -0.98 114.94 120.15 3d2c s ASN 179 Ca -0.03 -0.69 0.05 0.00 0.21 0.00 0.00 52.86 52.40 3d2c s ASN 179 Cb -0.01 1.29 0.44 0.00 -0.55 0.00 0.00 41.25 42.42 3d2c s ASN 179 CO -0.05 -0.09 1.44 0.35 -2.79 0.00 0.00 177.10 175.96 3d2c n THR 180 N 3.75 2.09 1.49 -5.21 -2.24 0.69 -4.99 114.28 109.86 3d2c n THR 180 Ca 0.10 -1.04 0.14 0.00 -2.27 0.00 0.00 64.05 60.99 3d2c n THR 180 Cb 0.60 -0.57 0.52 0.00 -2.10 0.00 0.00 70.33 68.78 3d2c n THR 180 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09