#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 5.45 0.67 0.41 0.01 -1.26 -4.98 114.94 115.23 3d2c s ASN 4 Ca 0.00 1.59 -0.17 0.00 -0.71 0.00 0.00 52.86 53.57 3d2c s ASN 4 Cb 0.00 -2.48 0.00 0.00 0.41 0.00 0.00 41.25 39.18 3d2c s ASN 4 CO 0.00 -1.40 1.22 -2.84 -1.51 0.00 0.00 177.10 172.58 3d2c s PRO 5 N -5.06 2.51 -0.17 -0.60 0.02 -1.26 -4.63 135.00 125.81 3d2c s PRO 5 Ca 0.58 1.84 -0.03 0.00 0.02 0.00 0.00 61.00 63.41 3d2c s PRO 5 Cb -0.14 -1.87 -0.02 0.00 0.02 0.00 0.00 34.50 32.49 3d2c s PRO 5 CO 0.55 -1.57 -0.05 0.08 -0.33 0.00 0.00 177.00 175.68 3d2c s VAL 6 N -1.74 3.60 -0.24 3.83 1.01 -0.11 -1.14 120.40 125.62 3d2c s VAL 6 Ca 0.77 -0.45 -0.06 0.00 0.00 0.00 0.00 61.98 62.24 3d2c s VAL 6 Cb -0.31 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 3d2c s VAL 6 CO 0.40 0.48 0.04 -0.69 0.00 0.00 0.00 175.10 175.33 3d2c s VAL 7 N 0.69 4.11 -0.21 2.92 1.01 -0.03 0.40 120.40 129.28 3d2c s VAL 7 Ca -0.03 -0.24 -0.09 0.00 0.00 0.00 0.00 61.98 61.62 3d2c s VAL 7 Cb -0.15 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 3d2c s VAL 7 CO 0.02 0.36 0.11 -0.04 0.00 0.00 0.00 175.10 175.56 3d2c s MET 8 N 1.52 4.06 -0.27 2.72 -1.94 0.19 -2.04 119.30 123.55 3d2c s MET 8 Ca 0.06 -0.29 -0.02 0.00 -1.71 0.00 0.00 55.69 53.73 3d2c s MET 8 Cb -0.15 -3.37 0.03 0.00 2.01 0.00 0.00 34.83 33.35 3d2c s MET 8 CO 0.02 0.21 -0.04 0.08 -0.01 0.00 0.00 175.02 175.28 3d2c s VAL 9 N 0.59 2.94 0.87 -6.03 1.01 0.13 -2.06 120.40 117.85 3d2c s VAL 9 Ca 0.06 -1.12 -0.13 0.00 0.00 0.00 0.00 61.98 60.79 3d2c s VAL 9 Cb -0.12 -2.56 0.12 0.00 0.00 0.00 0.00 36.38 33.82 3d2c s VAL 9 CO 0.01 0.10 1.20 -1.38 0.00 0.00 0.00 175.10 175.02 3d2c s HIS 10 N 1.31 2.56 0.00 5.22 -3.43 -1.26 -1.07 115.29 118.62 3d2c s HIS 10 Ca -0.01 0.69 0.00 0.00 -0.80 0.00 0.00 55.06 54.93 3d2c s HIS 10 Cb -0.18 -3.59 0.00 0.00 -1.43 0.00 0.00 32.58 27.39 3d2c s HIS 10 CO -0.03 -2.11 0.00 0.41 -2.00 0.00 0.00 174.74 171.01 3d2c n GLY 11 N -3.12 4.44 3.69 -1.38 0.00 -1.19 -3.19 105.19 104.44 3d2c n GLY 11 Ca 0.09 -2.00 -0.43 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 0.00 0.28 -0.96 -0.61 5.41 -1.26 -1.26 119.36 120.96 3d2c n ILE 12 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.70 3d2c n ILE 12 Cb 0.00 -2.00 0.00 0.00 -0.71 0.00 0.00 39.64 36.93 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 4.10 0.27 1.72 7.39 0.00 0.30 -4.99 105.19 113.99 3d2c n GLY 13 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.05 1.04 3.81 -0.02 0.00 -0.39 -5.12 105.19 103.46 3d2c n GLY 14 Ca 0.00 -2.04 -0.05 0.00 0.00 0.00 0.00 46.02 43.93 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 -2.75 -0.16 0.60 1.61 1.04 -1.26 -4.88 113.70 107.90 3d2c s SER 15 Ca 0.29 -0.59 0.29 0.00 0.48 0.00 0.00 55.95 56.42 3d2c s SER 15 Cb -0.02 0.61 1.60 0.00 0.10 0.00 0.00 66.02 68.32 3d2c s SER 15 CO 0.19 -1.16 2.01 0.77 0.98 0.00 0.00 173.24 176.04 3d2c h SER 16 N 2.00 0.00 0.11 7.02 4.64 -1.87 -0.71 113.55 124.75 3d2c h SER 16 Ca -0.24 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.07 3d2c h SER 16 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3d2c h SER 16 CO 0.27 0.00 -0.05 0.28 -0.87 0.00 0.00 176.83 176.46 3d2c h SER 17 N 0.00 0.00 0.18 4.97 0.02 -1.95 -1.55 113.55 115.22 3d2c h SER 17 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 3d2c h SER 17 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3d2c h SER 17 CO -0.00 0.05 0.00 0.78 -1.14 0.00 0.00 176.83 176.52 3d2c h ASN 18 N 0.00 0.00 -0.30 3.07 2.35 -1.53 -2.71 115.58 116.46 3d2c h ASN 18 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3d2c h ASN 18 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 3d2c h ASN 18 CO 0.01 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.28 3d2c n PHE 19 N -2.65 0.37 -0.30 1.19 3.72 -0.58 -4.48 117.46 114.73 3d2c n PHE 19 Ca -0.01 -0.19 0.10 0.00 -0.05 0.00 0.00 57.45 57.29 3d2c n PHE 19 Cb 0.10 -0.00 0.32 0.00 -0.94 0.00 0.00 39.48 38.96 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 4.48 0.79 -0.39 -1.08 4.39 -1.63 0.19 114.58 121.33 3d2c h GLU 20 Ca 0.00 -0.05 -0.11 0.00 0.34 0.00 0.00 59.36 59.54 3d2c h GLU 20 Cb 0.98 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 3d2c h GLU 20 CO 0.00 0.52 -0.20 0.78 -1.16 0.00 0.00 179.01 178.95 3d2c h GLY 21 N 0.81 0.89 1.47 -3.84 0.00 -1.83 -1.57 103.07 99.00 3d2c h GLY 21 Ca 0.47 -0.81 -0.12 0.00 0.00 0.00 0.00 47.33 46.86 3d2c h GLY 21 CO -0.23 0.73 -0.35 -2.22 0.00 0.00 0.00 176.54 174.48 3d2c h ILE 22 N 0.62 1.29 -0.06 2.60 2.04 -1.57 -1.88 117.51 120.54 3d2c h ILE 22 Ca 0.09 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.46 3d2c h ILE 22 Cb 0.75 1.46 -0.00 0.00 -0.74 0.00 0.00 36.82 38.29 3d2c h ILE 22 CO 0.06 0.47 0.01 0.11 0.00 0.00 0.00 178.15 178.80 3d2c h LYS 23 N 0.50 0.10 -0.37 2.37 1.57 -0.89 -0.50 116.57 119.34 3d2c h LYS 23 Ca 0.05 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 3d2c h LYS 23 Cb 0.84 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.08 3d2c h LYS 23 CO 0.07 0.31 0.06 0.77 -0.57 0.00 0.00 179.45 180.09 3d2c h SER 24 N -0.12 -0.01 0.11 0.86 0.02 -1.21 0.07 113.55 113.27 3d2c h SER 24 Ca 0.02 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3d2c h SER 24 Cb 0.25 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 3d2c h SER 24 CO 0.00 0.03 -0.11 0.22 -1.14 0.00 0.00 176.83 175.83 3d2c h TYR 25 N 0.19 -0.29 -0.88 3.45 3.20 -1.17 -1.02 116.97 120.44 3d2c h TYR 25 Ca 0.18 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.06 3d2c h TYR 25 Cb 0.22 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.55 3d2c h TYR 25 CO -0.20 -0.17 0.58 -0.07 -1.64 0.00 0.00 178.16 176.66 3d2c h LEU 26 N -0.25 1.01 -0.94 2.82 3.38 -0.73 -1.47 115.31 119.14 3d2c h LEU 26 Ca 0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3d2c h LEU 26 Cb 0.24 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 3d2c h LEU 26 CO -0.03 0.73 0.35 0.58 0.09 0.00 0.00 178.44 180.16 3d2c h VAL 27 N 1.19 1.25 0.00 1.22 2.07 -0.76 -0.40 116.25 120.82 3d2c h VAL 27 Ca 0.32 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 3d2c h VAL 27 Cb -0.14 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 29.91 3d2c h VAL 27 CO -0.07 0.30 -0.06 0.77 0.02 0.00 0.00 177.57 178.53 3d2c h SER 28 N 1.10 0.00 -0.66 0.57 4.64 -0.27 -2.33 113.55 116.61 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 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3d2c h SER 28 CO -0.03 0.06 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 3d2c n GLN 29 N -3.25 2.54 0.00 4.77 1.13 -0.42 -4.94 117.38 117.21 3d2c n GLN 29 Ca -0.01 -2.39 0.00 0.00 -1.94 0.00 0.00 57.00 52.67 3d2c n GLN 29 Cb 0.27 -1.52 0.00 0.00 0.11 0.00 0.00 30.24 29.11 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 1.56 0.75 3.78 1.08 0.00 -0.87 -5.05 105.19 106.44 3d2c n GLY 30 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.03 2.92 -0.19 1.61 0.51 -0.29 -4.98 118.94 116.49 3d2c s TRP 31 Ca 0.00 1.57 -0.25 0.00 -2.12 0.00 0.00 56.10 55.30 3d2c s TRP 31 Cb 0.00 -3.20 -0.01 0.00 -0.81 0.00 0.00 33.47 29.44 3d2c s TRP 31 CO 0.00 -1.15 0.83 0.45 -0.51 0.00 0.00 176.95 176.57 3d2c s SER 32 N -1.73 6.91 0.26 2.95 0.15 -1.26 -4.14 113.70 116.85 3d2c s SER 32 Ca 0.67 1.13 -0.02 0.00 0.70 0.00 0.00 55.95 58.42 3d2c s SER 32 Cb -0.22 -2.45 0.56 0.00 -1.71 0.00 0.00 66.02 62.21 3d2c s SER 32 CO 0.26 -0.43 1.68 -0.09 1.20 0.00 0.00 173.24 175.86 3d2c h ARG 33 N 7.43 0.26 0.00 5.44 2.43 -1.93 0.33 114.38 128.34 3d2c h ARG 33 Ca -0.27 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 3d2c h ARG 33 Cb 1.12 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3d2c h ARG 33 CO 0.85 0.17 0.00 -0.40 -1.51 0.00 0.00 179.97 179.08 3d2c n ASP 34 N -5.16 0.00 -0.73 -3.80 5.68 -1.26 -2.38 116.55 108.90 3d2c n ASP 34 Ca 0.17 -1.20 0.07 0.00 -0.50 0.00 0.00 54.79 53.33 3d2c n ASP 34 Cb 0.54 0.00 0.20 0.00 -1.14 0.00 0.00 41.12 40.72 3d2c n ASP 34 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3d2c n LYS 35 N -0.73 2.86 -4.40 0.11 4.76 0.12 -4.92 118.16 115.96 3d2c n LYS 35 Ca 0.09 -2.44 -0.33 0.00 -2.87 0.00 0.00 58.31 52.76 3d2c n LYS 35 Cb 0.04 -1.55 -0.16 0.00 -1.84 0.00 0.00 35.03 31.52 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 -1.96 2.31 0.09 -0.35 1.43 -1.00 -0.93 118.68 118.27 3d2c s LEU 36 Ca 0.32 -0.55 0.09 0.00 -1.03 0.00 0.00 54.13 52.96 3d2c s LEU 36 Cb 0.23 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.90 3d2c s LEU 36 CO 0.11 0.05 -0.23 -0.31 0.23 0.00 0.00 176.35 176.20 3d2c s TYR 37 N 1.01 2.00 -0.10 0.29 1.51 0.16 -4.96 117.35 117.26 3d2c s TYR 37 Ca -0.02 -0.40 -0.01 0.00 -1.01 0.00 0.00 57.07 55.64 3d2c s TYR 37 Cb -0.15 -1.12 0.03 0.00 -0.11 0.00 0.00 41.96 40.61 3d2c s TYR 37 CO -0.05 0.21 -0.05 0.00 -1.11 0.00 0.00 175.55 174.56 3d2c s ALA 38 N -1.01 1.11 0.73 3.71 0.00 -1.26 0.57 121.76 125.60 3d2c s ALA 38 Ca 0.09 -0.41 -0.11 0.00 0.00 0.00 0.00 51.96 51.53 3d2c s ALA 38 Cb -0.10 -0.87 0.03 0.00 0.00 0.00 0.00 23.12 22.19 3d2c s ALA 38 CO 0.04 -0.46 1.08 0.54 0.00 0.00 0.00 175.76 176.96 3d2c s VAL 39 N 1.80 3.56 -0.23 0.00 0.11 -0.87 -4.80 120.40 119.97 3d2c s VAL 39 Ca 0.05 0.51 -0.03 0.00 -2.93 0.00 0.00 61.98 59.58 3d2c s VAL 39 Cb -0.13 -3.33 0.07 0.00 -1.53 0.00 0.00 36.38 31.47 3d2c s VAL 39 CO -0.07 -0.66 0.06 -1.81 -3.33 0.00 0.00 175.10 169.29 3d2c s ASP 40 N -4.01 3.16 0.18 3.54 1.01 -1.26 -3.63 116.67 115.67 3d2c s ASP 40 Ca 0.59 -1.01 -0.27 0.00 0.71 0.00 0.00 52.55 52.57 3d2c s ASP 40 Cb -0.13 -0.60 -0.08 0.00 1.01 0.00 0.00 42.92 43.12 3d2c s ASP 40 CO 0.54 -0.34 0.83 -0.36 0.21 0.00 0.00 175.17 176.04 3d2c s PHE 41 N 1.86 3.93 0.19 4.23 0.08 -1.26 -4.95 117.98 122.05 3d2c s PHE 41 Ca 0.02 1.72 0.08 0.00 0.12 0.00 0.00 56.93 58.87 3d2c s PHE 41 Cb -0.17 -2.84 0.05 0.00 -0.57 0.00 0.00 43.02 39.50 3d2c s PHE 41 CO -0.14 0.49 1.43 0.11 -0.10 0.00 0.00 175.22 177.01 3d2c h TRP 42 N 4.32 0.02 -2.34 0.36 5.08 -1.99 -3.39 115.95 118.02 3d2c h TRP 42 Ca -0.46 -0.01 -0.62 0.00 1.08 0.00 0.00 58.89 58.87 3d2c h TRP 42 Cb 1.20 -0.00 -0.13 0.00 -3.00 0.00 0.00 29.16 27.23 3d2c h TRP 42 CO 0.63 0.83 0.83 0.34 -1.28 0.00 0.00 178.44 179.80 3d2c s ASP 43 N -6.79 6.31 0.00 0.11 -1.08 -1.26 -4.85 116.67 109.11 3d2c s ASP 43 Ca -0.00 -1.16 0.20 0.00 -0.52 0.00 0.00 52.55 51.06 3d2c s ASP 43 Cb 0.11 -2.46 1.07 0.00 -1.46 0.00 0.00 42.92 40.18 3d2c s ASP 43 CO 0.80 -1.46 1.59 0.29 0.52 0.00 0.00 175.17 176.91 3d2c n LYS 44 N 7.97 0.43 0.00 4.34 4.76 -1.26 -1.88 118.16 132.52 3d2c n LYS 44 Ca 0.08 0.06 0.12 0.00 -2.87 0.00 0.00 58.31 55.70 3d2c n LYS 44 Cb 0.48 -1.50 0.31 0.00 -1.84 0.00 0.00 35.03 32.47 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 -1.15 0.00 -2.21 -0.18 -2.24 -1.26 -0.54 114.28 106.70 3d2c n THR 45 Ca 0.12 -0.02 -0.17 0.00 -2.27 0.00 0.00 64.05 61.71 3d2c n THR 45 Cb 0.11 0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.52 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 1.48 -0.06 3.77 3.38 0.00 -0.79 -4.79 105.19 108.18 3d2c n GLY 46 Ca 0.07 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.82 2.68 0.29 2.61 -4.23 -1.26 -4.80 115.64 108.11 3d2c s THR 47 Ca 0.00 0.64 -0.03 0.00 -1.18 0.00 0.00 61.69 61.12 3d2c s THR 47 Cb 0.00 -3.39 0.26 0.00 1.34 0.00 0.00 72.50 70.71 3d2c s THR 47 CO 0.00 0.12 1.96 0.78 -0.54 0.00 0.00 174.62 176.94 3d2c h ASN 48 N 2.98 1.00 -0.86 3.99 2.35 -1.94 -0.84 115.58 122.25 3d2c h ASN 48 Ca -0.49 -0.03 0.08 0.00 -0.55 0.00 0.00 56.30 55.32 3d2c h ASN 48 Cb 1.24 -0.25 -0.07 0.00 0.05 0.00 0.00 38.32 39.29 3d2c h ASN 48 CO 0.64 0.72 0.52 1.88 -1.65 0.00 0.00 177.43 179.53 3d2c h TYR 49 N 1.18 0.95 0.11 1.19 0.99 -2.00 0.26 116.97 119.65 3d2c h TYR 49 Ca 0.32 0.03 -0.27 0.00 2.00 0.00 0.00 58.73 60.80 3d2c h TYR 49 Cb -0.13 -0.30 -0.00 0.00 1.00 0.00 0.00 36.73 37.30 3d2c h TYR 49 CO -0.00 0.43 -1.41 -0.91 -0.00 0.00 0.00 178.16 176.27 3d2c h ASN 50 N 0.89 0.37 0.73 3.88 2.35 -1.88 -3.40 115.58 118.52 3d2c h ASN 50 Ca 0.40 -0.85 -0.22 0.00 -0.55 0.00 0.00 56.30 55.08 3d2c h ASN 50 Cb 0.29 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 3d2c h ASN 50 CO -0.22 1.62 -1.02 0.78 -1.65 0.00 0.00 177.43 176.94 3d2c h ASN 51 N -0.32 0.22 -0.14 5.81 -0.26 -1.09 -3.30 115.58 116.49 3d2c h ASN 51 Ca -0.30 -0.21 0.05 0.00 -0.56 0.00 0.00 56.30 55.27 3d2c h ASN 51 Cb 1.75 -0.07 -0.06 0.00 -1.06 0.00 0.00 38.32 38.88 3d2c h ASN 51 CO 0.05 1.10 -0.27 1.23 -1.06 0.00 0.00 177.43 178.48 3d2c h GLY 52 N 2.14 -0.32 1.24 2.83 0.00 -0.67 0.63 103.07 108.92 3d2c h GLY 52 Ca -0.06 0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.60 3d2c h GLY 52 CO 0.15 -0.21 0.41 -2.55 0.00 0.00 0.00 176.54 174.34 3d2c h PRO 53 N -0.34 1.00 -0.58 4.80 0.11 -1.77 -1.48 132.00 133.74 3d2c h PRO 53 Ca 0.10 -0.10 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 3d2c h PRO 53 Cb 0.50 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 3d2c h PRO 53 CO -0.34 0.72 -0.03 0.28 -0.21 0.00 0.00 178.00 178.43 3d2c h VAL 54 N 1.01 1.26 -0.61 3.15 2.07 -1.47 -2.13 116.25 119.53 3d2c h VAL 54 Ca 0.26 -1.17 -0.08 0.00 0.82 0.00 0.00 66.70 66.53 3d2c h VAL 54 Cb 0.01 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3d2c h VAL 54 CO -0.04 0.42 0.08 0.25 0.02 0.00 0.00 177.57 178.30 3d2c h LEU 55 N 0.94 0.97 -0.05 2.57 5.85 -0.43 -1.40 115.31 123.76 3d2c h LEU 55 Ca 0.16 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.68 3d2c h LEU 55 Cb 0.58 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 3d2c h LEU 55 CO 0.03 0.98 -0.10 -1.28 -0.34 0.00 0.00 178.44 177.74 3d2c h SER 56 N 0.95 -0.29 -0.21 1.25 0.87 -0.94 0.34 113.55 115.52 3d2c h SER 56 Ca 0.19 0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.71 3d2c h SER 56 Cb 0.44 0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.52 3d2c h SER 56 CO 0.01 -0.14 -0.15 0.03 -0.53 0.00 0.00 176.83 176.05 3d2c h ARG 57 N -0.15 0.63 -0.03 2.24 3.08 -1.23 -2.03 114.38 116.89 3d2c h ARG 57 Ca 0.05 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 3d2c h ARG 57 Cb 0.22 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 3d2c h ARG 57 CO -0.13 0.76 0.01 0.35 -1.07 0.00 0.00 179.97 179.88 3d2c h PHE 58 N 0.57 0.05 -0.68 3.04 3.57 -0.84 -1.57 116.94 121.07 3d2c h PHE 58 Ca 0.10 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.64 3d2c h PHE 58 Cb 0.59 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.26 3d2c h PHE 58 CO 0.02 0.26 0.40 0.28 -2.23 0.00 0.00 178.31 177.04 3d2c h VAL 59 N -0.18 1.01 -0.70 1.41 2.07 -0.81 -1.37 116.25 117.68 3d2c h VAL 59 Ca 0.01 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 3d2c h VAL 59 Cb 0.24 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 3d2c h VAL 59 CO 0.00 0.14 0.32 -0.61 0.02 0.00 0.00 177.57 177.44 3d2c h GLN 60 N 0.75 1.01 -0.48 1.57 5.75 -1.24 0.04 115.11 122.51 3d2c h GLN 60 Ca 0.30 -0.15 -0.04 0.00 -0.15 0.00 0.00 58.65 58.61 3d2c h GLN 60 Cb 0.13 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 3d2c h GLN 60 CO -0.16 0.79 0.15 -0.22 -2.65 0.00 0.00 178.83 176.74 3d2c h LYS 61 N 1.00 0.74 -0.36 1.69 3.64 -0.54 0.01 116.57 122.75 3d2c h LYS 61 Ca 0.24 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3d2c h LYS 61 Cb 0.13 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3d2c h LYS 61 CO -0.03 0.71 0.20 0.28 -2.27 0.00 0.00 179.45 178.34 3d2c h VAL 62 N 0.64 1.14 -0.70 2.00 2.07 -0.60 0.15 116.25 120.95 3d2c h VAL 62 Ca 0.15 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 3d2c h VAL 62 Cb 0.28 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3d2c h VAL 62 CO -0.00 0.14 0.32 -0.07 0.02 0.00 0.00 177.57 177.98 3d2c h LEU 63 N 0.46 0.91 0.72 2.57 3.38 -0.82 -0.39 115.31 122.14 3d2c h LEU 63 Ca 0.13 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 3d2c h LEU 63 Cb 0.05 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.58 3d2c h LEU 63 CO -0.02 0.78 -0.34 0.44 0.09 0.00 0.00 178.44 179.38 3d2c h ASP 64 N 0.99 -0.82 -0.61 -0.43 3.32 -0.47 0.27 116.42 118.68 3d2c h ASP 64 Ca 0.24 0.03 0.12 0.00 0.02 0.00 0.00 57.03 57.44 3d2c h ASP 64 Cb 0.13 0.21 -0.12 0.00 0.22 0.00 0.00 39.33 39.77 3d2c h ASP 64 CO -0.03 -0.47 -0.16 -0.33 -1.72 0.00 0.00 179.24 176.53 3d2c h GLU 65 N -1.19 -0.01 0.00 3.56 5.08 -0.62 -2.71 114.58 118.70 3d2c h GLU 65 Ca -0.10 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 3d2c h GLU 65 Cb 0.74 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3d2c h GLU 65 CO 0.16 -0.01 -0.71 1.79 -1.00 0.00 0.00 179.01 179.25 3d2c h THR 66 N -0.01 0.45 0.00 1.13 1.35 -1.12 -3.48 112.91 111.24 3d2c h THR 66 Ca 0.29 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.44 3d2c h THR 66 Cb 0.45 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3d2c h THR 66 CO -0.63 0.26 0.00 0.61 -0.25 0.00 0.00 175.52 175.51 3d2c n GLY 67 N 1.23 0.39 3.82 5.82 0.00 0.94 -5.00 105.19 112.40 3d2c n GLY 67 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.80 2.91 0.09 4.61 0.00 -1.20 -4.98 121.76 121.38 3d2c s ALA 68 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.25 3d2c s ALA 68 Cb 0.00 -3.17 -0.25 0.00 0.00 0.00 0.00 23.12 19.69 3d2c s ALA 68 CO 0.00 -0.52 1.16 0.87 0.00 0.00 0.00 175.76 177.28 3d2c h LYS 69 N 0.67 0.16 -3.99 0.00 1.57 -1.94 -3.45 116.57 109.59 3d2c h LYS 69 Ca -0.47 -0.27 -0.11 0.00 -1.87 0.00 0.00 60.65 57.93 3d2c h LYS 69 Cb 1.20 0.10 -0.14 0.00 0.08 0.00 0.00 32.23 33.47 3d2c h LYS 69 CO 0.59 1.11 -0.47 0.15 -0.57 0.00 0.00 179.45 180.27 3d2c s LYS 70 N -2.67 0.84 0.34 3.15 1.02 -1.26 -4.75 119.74 116.41 3d2c s LYS 70 Ca -0.02 -1.11 0.09 0.00 0.02 0.00 0.00 55.97 54.95 3d2c s LYS 70 Cb 0.08 0.30 -0.06 0.00 -0.52 0.00 0.00 37.83 37.63 3d2c s LYS 70 CO 0.86 -0.25 -0.08 0.14 -0.92 0.00 0.00 175.35 175.10 3d2c s VAL 71 N -3.91 2.29 0.12 3.17 -7.23 -0.38 -4.18 120.40 110.28 3d2c s VAL 71 Ca 0.09 -2.17 0.05 0.00 -1.81 0.00 0.00 61.98 58.14 3d2c s VAL 71 Cb 0.06 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 3d2c s VAL 71 CO -0.08 -0.20 0.02 -1.81 -0.31 0.00 0.00 175.10 172.73 3d2c s ASP 72 N -3.62 5.08 -0.03 4.85 1.01 -0.29 -1.69 116.67 121.98 3d2c s ASP 72 Ca 0.33 -0.20 0.04 0.00 0.71 0.00 0.00 52.55 53.43 3d2c s ASP 72 Cb 0.02 -1.22 -0.00 0.00 1.01 0.00 0.00 42.92 42.73 3d2c s ASP 72 CO 0.17 0.14 -0.15 -0.63 0.21 0.00 0.00 175.17 174.91 3d2c s ILE 73 N -1.46 1.25 -0.22 0.77 1.01 0.77 -0.85 121.20 122.46 3d2c s ILE 73 Ca 0.27 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.30 3d2c s ILE 73 Cb -0.11 -1.07 0.04 0.00 0.01 0.00 0.00 42.46 41.33 3d2c s ILE 73 CO 0.19 0.36 -0.14 -0.69 0.00 0.00 0.00 174.94 174.66 3d2c s VAL 74 N -0.05 2.20 0.05 2.92 1.01 -0.87 -0.35 120.40 125.31 3d2c s VAL 74 Ca -0.01 -1.27 0.09 0.00 0.00 0.00 0.00 61.98 60.80 3d2c s VAL 74 Cb -0.09 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 3d2c s VAL 74 CO 0.01 0.24 -0.25 0.00 0.00 0.00 0.00 175.10 175.10 3d2c s ALA 75 N 1.21 2.14 -0.08 5.51 0.00 0.73 -0.70 121.76 130.56 3d2c s ALA 75 Ca -0.02 -1.23 0.02 0.00 0.00 0.00 0.00 51.96 50.73 3d2c s ALA 75 Cb -0.17 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 3d2c s ALA 75 CO -0.08 0.50 -0.15 -1.58 0.00 0.00 0.00 175.76 174.44 3d2c s HIS 76 N -0.82 2.71 0.00 0.00 5.65 -0.23 0.63 115.29 123.24 3d2c s HIS 76 Ca 0.11 -0.44 0.00 0.00 0.25 0.00 0.00 55.06 54.98 3d2c s HIS 76 Cb -0.10 -1.72 0.00 0.00 -1.18 0.00 0.00 32.58 29.59 3d2c s HIS 76 CO 0.02 -0.04 0.00 0.45 -0.65 0.00 0.00 174.74 174.53 3d2c n SER 77 N 2.91 0.00 0.31 9.88 2.88 -0.25 -0.03 113.62 129.32 3d2c n SER 77 Ca -0.18 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.55 3d2c n SER 77 Cb 0.52 0.00 1.01 0.00 -0.75 0.00 0.00 64.21 64.99 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 -0.08 -1.46 1.85 -1.86 0.64 114.93 114.02 3d2c h MET 78 Ca 0.00 0.00 0.02 0.00 -0.61 0.00 0.00 59.70 59.11 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 0.02 0.06 0.78 -0.40 0.00 0.00 176.91 177.37 3d2c h GLY 79 N 0.26 0.01 1.09 1.39 0.00 -0.41 0.33 103.07 105.74 3d2c h GLY 79 Ca -0.00 -0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.19 3d2c h GLY 79 CO 0.00 0.00 -0.25 -1.33 0.00 0.00 0.00 176.54 174.97 3d2c h GLY 80 N 0.01 1.03 0.93 4.60 0.00 -1.01 0.05 103.07 108.68 3d2c h GLY 80 Ca 0.04 -0.95 -0.00 0.00 0.00 0.00 0.00 47.33 46.42 3d2c h GLY 80 CO -0.00 0.86 0.06 0.00 0.00 0.00 0.00 176.54 177.46 3d2c h ALA 81 N 0.83 0.15 -0.91 3.60 0.00 -1.07 -1.43 119.26 120.43 3d2c h ALA 81 Ca 0.09 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.99 3d2c h ALA 81 Cb 0.83 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.51 3d2c h ALA 81 CO 0.07 -0.31 0.59 -0.91 0.00 0.00 0.00 179.25 178.69 3d2c h ASN 82 N 0.09 0.96 -0.06 0.00 2.35 -0.88 -1.15 115.58 116.89 3d2c h ASN 82 Ca 0.04 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3d2c h ASN 82 Cb 0.08 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.24 3d2c h ASN 82 CO -0.01 0.64 0.03 0.74 -1.65 0.00 0.00 177.43 177.18 3d2c h THR 83 N 1.11 1.06 -0.39 2.81 2.02 -0.66 -0.80 112.91 118.06 3d2c h THR 83 Ca 0.38 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 67.35 3d2c h THR 83 Cb 0.07 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 3d2c h THR 83 CO -0.14 0.05 0.11 -0.07 0.37 0.00 0.00 175.52 175.84 3d2c h LEU 84 N 0.02 0.51 -0.41 2.58 3.38 -0.91 -1.97 115.31 118.50 3d2c h LEU 84 Ca 0.02 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 3d2c h LEU 84 Cb 0.06 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3d2c h LEU 84 CO -0.00 0.51 0.02 0.22 0.09 0.00 0.00 178.44 179.27 3d2c h TYR 85 N 0.55 0.77 -0.52 1.13 3.20 -0.92 -0.46 116.97 120.72 3d2c h TYR 85 Ca 0.13 -0.13 0.01 0.00 3.14 0.00 0.00 58.73 61.89 3d2c h TYR 85 Cb 0.19 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 3d2c h TYR 85 CO 0.01 0.77 0.33 -0.92 -1.64 0.00 0.00 178.16 176.71 3d2c h TYR 86 N 0.54 0.63 -0.05 -3.82 3.20 -0.55 -0.97 116.97 115.95 3d2c h TYR 86 Ca 0.12 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 3d2c h TYR 86 Cb 0.45 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.51 3d2c h TYR 86 CO 0.03 0.38 -0.06 0.82 -1.64 0.00 0.00 178.16 177.69 3d2c h ILE 87 N 0.67 1.40 0.05 1.81 2.04 -1.28 -2.18 117.51 120.02 3d2c h ILE 87 Ca 0.20 -1.30 -0.27 0.00 1.00 0.00 0.00 64.86 64.49 3d2c h ILE 87 Cb -0.04 2.17 0.02 0.00 -0.74 0.00 0.00 36.82 38.23 3d2c h ILE 87 CO -0.06 0.35 -1.12 0.50 0.00 0.00 0.00 178.15 177.82 3d2c h LYS 88 N -0.36 0.62 0.00 2.37 3.64 -1.08 -2.93 116.57 118.83 3d2c h LYS 88 Ca 0.00 -0.73 -0.07 0.00 -1.27 0.00 0.00 60.65 58.58 3d2c h LYS 88 Cb 0.60 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 3d2c h LYS 88 CO 0.01 1.31 -1.66 0.66 -2.27 0.00 0.00 179.45 177.51 3d2c n TYR 89 N -3.80 0.00 0.00 1.91 4.02 -0.38 -5.01 117.16 113.89 3d2c n TYR 89 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 3d2c n TYR 89 Cb 0.92 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 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 -2.10 0.00 -1.74 7.72 4.77 -0.91 -5.01 117.00 119.73 3d2c n LEU 90 Ca -0.08 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.74 3d2c n LEU 90 Cb 0.51 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.77 3d2c n LEU 90 CO 0.26 0.00 0.97 -0.90 -1.33 0.00 0.00 177.39 176.40 3d2c n ASP 91 N 0.00 3.52 0.01 -1.43 5.75 -1.20 -4.55 116.55 118.66 3d2c n ASP 91 Ca 0.00 -3.72 0.11 0.00 -0.01 0.00 0.00 54.79 51.17 3d2c n ASP 91 Cb 0.00 -0.74 0.08 0.00 -1.03 0.00 0.00 41.12 39.43 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 -1.10 -1.19 0.57 6.12 0.00 -0.87 -4.47 105.19 104.25 3d2c n GLY 92 Ca 0.47 -0.42 0.39 0.00 0.00 0.00 0.00 46.02 46.47 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 4.78 0.07 -0.23 -0.02 0.00 -1.73 -1.58 103.07 104.35 3d2c h GLY 93 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3d2c h GLY 93 CO 0.00 -0.01 -0.12 1.16 0.00 0.00 0.00 176.54 177.57 3d2c n ASN 94 N -4.15 1.63 -0.06 0.19 0.23 -1.26 0.08 115.26 111.91 3d2c n ASN 94 Ca 0.30 -2.57 0.01 0.00 -0.53 0.00 0.00 54.58 51.78 3d2c n ASN 94 Cb 1.41 -0.29 0.01 0.00 -2.08 0.00 0.00 39.78 38.83 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 -0.90 0.62 -4.72 -3.83 5.02 -0.61 -4.88 118.16 108.87 3d2c n LYS 95 Ca 0.09 -0.95 -0.24 0.00 -2.02 0.00 0.00 58.31 55.19 3d2c n LYS 95 Cb 0.59 -1.03 -0.16 0.00 -0.02 0.00 0.00 35.03 34.42 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 -0.45 1.26 -0.08 -0.18 1.01 -1.16 -1.25 120.40 119.56 3d2c s VAL 96 Ca 0.02 -0.63 -0.10 0.00 0.00 0.00 0.00 61.98 61.27 3d2c s VAL 96 Cb 0.01 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 3d2c s VAL 96 CO 0.02 0.37 -0.20 0.00 0.00 0.00 0.00 175.10 175.28 3d2c n ALA 97 N 3.12 1.81 -2.90 5.51 0.00 -0.68 -4.72 120.51 122.65 3d2c n ALA 97 Ca -0.18 -0.50 -0.32 0.00 0.00 0.00 0.00 53.44 52.44 3d2c n ALA 97 Cb 0.53 0.15 -0.15 0.00 0.00 0.00 0.00 19.45 19.98 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 -6.03 3.52 -0.06 0.00 0.01 -1.26 -1.52 114.94 109.60 3d2c s ASN 98 Ca -0.18 -0.41 0.04 0.00 -0.71 0.00 0.00 52.86 51.60 3d2c s ASN 98 Cb 0.03 -1.19 -0.00 0.00 0.41 0.00 0.00 41.25 40.50 3d2c s ASN 98 CO 0.25 0.22 -0.19 -0.69 -1.51 0.00 0.00 177.10 175.18 3d2c s VAL 99 N 0.00 1.61 -0.09 1.60 1.01 -0.00 -0.16 120.40 124.37 3d2c s VAL 99 Ca -0.07 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.12 3d2c s VAL 99 Cb -0.15 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 34.86 3d2c s VAL 99 CO 0.05 0.46 -0.08 -0.69 0.00 0.00 0.00 175.10 174.84 3d2c s VAL 100 N 0.16 0.97 -0.00 2.92 1.01 0.52 -1.28 120.40 124.70 3d2c s VAL 100 Ca -0.08 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.64 3d2c s VAL 100 Cb -0.14 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 3d2c s VAL 100 CO 0.04 0.34 -0.12 0.42 0.00 0.00 0.00 175.10 175.79 3d2c s THR 101 N 1.35 3.28 -0.28 3.92 -4.23 -0.46 -0.19 115.64 119.02 3d2c s THR 101 Ca -0.02 -0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 59.61 3d2c s THR 101 Cb -0.14 -2.38 0.05 0.00 1.34 0.00 0.00 72.50 71.37 3d2c s THR 101 CO -0.04 0.43 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.68 3d2c s LEU 102 N -1.25 3.66 -1.43 4.79 1.43 0.21 -0.75 118.68 125.34 3d2c s LEU 102 Ca 0.15 -1.22 -0.08 0.00 -1.03 0.00 0.00 54.13 51.95 3d2c s LEU 102 Cb -0.11 -1.67 0.05 0.00 0.03 0.00 0.00 46.19 44.49 3d2c s LEU 102 CO 0.05 -0.22 0.64 0.61 0.23 0.00 0.00 176.35 177.66 3d2c n GLY 103 N 4.59 -0.51 3.77 -3.19 0.00 0.12 -1.09 105.19 108.89 3d2c n GLY 103 Ca -0.14 0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.83 2.79 -0.36 -0.02 0.00 -1.26 -3.36 107.32 102.28 3d2c s GLY 104 Ca 0.41 1.38 -0.04 0.00 0.00 0.00 0.00 44.72 46.48 3d2c s GLY 104 CO 0.51 2.12 2.76 0.00 0.00 0.00 0.00 173.10 178.49 3d2c n ALA 105 N 1.12 6.18 -0.24 3.20 0.00 -0.31 -2.91 120.51 127.55 3d2c n ALA 105 Ca 0.02 -2.58 0.05 0.00 0.00 0.00 0.00 53.44 50.93 3d2c n ALA 105 Cb 0.40 -2.02 0.17 0.00 0.00 0.00 0.00 19.45 18.01 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 2.71 0.06 0.14 0.00 2.35 -1.73 -0.92 115.58 118.18 3d2c h ASN 106 Ca 0.34 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 56.23 3d2c h ASN 106 Cb 0.87 0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.42 3d2c h ASN 106 CO 0.75 -0.01 0.00 0.54 -1.65 0.00 0.00 177.43 177.06 3d2c n ARG 107 N -5.13 0.28 0.00 0.81 1.74 -0.02 -1.47 116.66 112.87 3d2c n ARG 107 Ca 0.14 0.10 0.11 0.00 -0.77 0.00 0.00 57.85 57.42 3d2c n ARG 107 Cb 0.44 -1.50 0.65 0.00 -1.02 0.00 0.00 32.46 31.03 3d2c n ARG 107 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3d2c n LEU 108 N -1.17 0.00 0.05 0.55 4.77 -0.35 -3.94 117.00 116.92 3d2c n LEU 108 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3d2c n LEU 108 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3d2c n LEU 108 CO 0.09 0.00 -0.14 0.41 -1.33 0.00 0.00 177.39 176.42 3d2c n THR 109 N -0.88 0.37 -3.58 -5.08 -1.04 -0.54 -5.05 114.28 98.49 3d2c n THR 109 Ca 0.17 0.12 -0.11 0.00 -2.04 0.00 0.00 64.05 62.19 3d2c n THR 109 Cb 0.08 -1.12 -0.04 0.00 -1.82 0.00 0.00 70.33 67.43 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 -2.00 0.05 -0.48 12.58 -1.32 -0.96 -5.02 115.64 118.49 3d2c s THR 110 Ca 0.00 -0.44 0.23 0.00 -1.21 0.00 0.00 61.69 60.27 3d2c s THR 110 Cb 0.00 -1.14 -0.13 0.00 -1.51 0.00 0.00 72.50 69.72 3d2c s THR 110 CO 0.00 -0.23 0.95 0.47 -2.21 0.00 0.00 174.62 173.61 3d2c n ASP 111 N -0.27 0.58 -4.32 8.08 8.00 -1.26 -3.55 116.55 123.80 3d2c n ASP 111 Ca -0.16 -0.11 -0.30 0.00 0.71 0.00 0.00 54.79 54.92 3d2c n ASP 111 Cb 0.64 0.90 -0.15 0.00 -0.02 0.00 0.00 41.12 42.49 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 -3.26 1.97 -0.17 -1.24 1.02 -1.26 -0.96 119.74 115.83 3d2c s LYS 112 Ca 0.02 -0.98 -0.29 0.00 0.02 0.00 0.00 55.97 54.74 3d2c s LYS 112 Cb 0.14 -1.98 -0.05 0.00 -0.52 0.00 0.00 37.83 35.41 3d2c s LYS 112 CO 0.82 0.53 2.01 0.00 -0.92 0.00 0.00 175.35 177.78 3d2c s ALA 113 N -0.67 3.04 0.19 5.17 0.00 -0.49 -4.88 121.76 124.11 3d2c s ALA 113 Ca 0.10 0.79 -0.32 0.00 0.00 0.00 0.00 51.96 52.54 3d2c s ALA 113 Cb -0.10 -3.97 -0.12 0.00 0.00 0.00 0.00 23.12 18.93 3d2c s ALA 113 CO 0.00 -2.34 1.75 -2.30 0.00 0.00 0.00 175.76 172.87 3d2c n PRO 114 N 8.24 2.78 0.12 0.00 -0.02 -1.26 -4.84 135.00 140.02 3d2c n PRO 114 Ca 0.25 1.01 -0.01 0.00 -2.02 0.00 0.00 63.50 62.72 3d2c n PRO 114 Cb 0.44 -2.86 0.26 0.00 -0.02 0.00 0.00 33.50 31.31 3d2c n PRO 114 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3d2c h PRO 115 N 7.15 0.16 0.00 0.52 0.11 -1.91 -3.39 132.00 134.64 3d2c h PRO 115 Ca -0.44 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3d2c h PRO 115 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3d2c h PRO 115 CO 0.96 0.55 0.00 0.41 -0.21 0.00 0.00 178.00 179.71 3d2c n GLY 116 N -0.23 -3.26 0.55 -0.55 0.00 -1.26 -0.48 105.19 99.95 3d2c n GLY 116 Ca -0.02 -2.01 0.06 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.10 1.42 -3.11 2.61 -2.24 0.11 -4.93 114.28 108.04 3d2c n THR 117 Ca 0.00 -1.34 -0.43 0.00 -2.27 0.00 0.00 64.05 60.01 3d2c n THR 117 Cb 0.00 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.41 6.28 0.63 3.42 -1.08 -1.25 -4.87 116.67 118.39 3d2c s ASP 118 Ca 0.25 -0.58 0.34 0.00 -0.52 0.00 0.00 52.55 52.04 3d2c s ASP 118 Cb 0.17 -2.32 1.90 0.00 -1.46 0.00 0.00 42.92 41.21 3d2c s ASP 118 CO 0.10 -0.86 2.16 -0.65 0.52 0.00 0.00 175.17 176.45 3d2c h PRO 119 N 8.96 0.00 0.00 4.34 0.11 -1.97 -2.50 132.00 140.94 3d2c h PRO 119 Ca -0.26 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.61 3d2c h PRO 119 Cb 1.09 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 3d2c h PRO 119 CO 0.93 0.00 -1.30 -0.91 -0.21 0.00 0.00 178.00 176.51 3d2c h ASN 120 N 0.00 0.00 -3.13 -2.05 2.35 -2.02 -3.47 115.58 107.27 3d2c h ASN 120 Ca 0.04 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.69 3d2c h ASN 120 Cb 0.33 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 38.44 3d2c h ASN 120 CO -0.00 0.95 -0.26 -1.58 -1.65 0.00 0.00 177.43 174.89 3d2c s GLN 121 N -2.69 0.43 0.47 0.81 0.74 -0.94 -5.15 119.66 113.33 3d2c s GLN 121 Ca -0.01 0.87 -0.19 0.00 0.05 0.00 0.00 55.36 56.07 3d2c s GLN 121 Cb 0.09 0.03 -0.09 0.00 1.10 0.00 0.00 33.01 34.13 3d2c s GLN 121 CO 0.82 -0.17 0.98 0.15 -0.55 0.00 0.00 175.29 176.52 3d2c s LYS 122 N 1.54 4.04 0.29 1.67 1.02 -1.26 -4.45 119.74 122.59 3d2c s LYS 122 Ca -0.09 1.12 -0.29 0.00 0.02 0.00 0.00 55.97 56.73 3d2c s LYS 122 Cb -0.08 -2.15 -0.10 0.00 -0.52 0.00 0.00 37.83 34.98 3d2c s LYS 122 CO -0.14 -0.20 1.32 0.42 -0.92 0.00 0.00 175.35 175.83 3d2c s ILE 123 N -2.28 2.84 -0.11 2.17 1.01 0.37 -5.01 121.20 120.20 3d2c s ILE 123 Ca 0.62 0.79 -0.05 0.00 0.00 0.00 0.00 60.65 62.02 3d2c s ILE 123 Cb -0.11 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 3d2c s ILE 123 CO 0.20 0.17 0.08 -0.76 0.00 0.00 0.00 174.94 174.62 3d2c s LEU 124 N -1.24 4.00 0.02 2.97 1.43 -0.57 -4.59 118.68 120.70 3d2c s LEU 124 Ca 0.52 0.30 0.06 0.00 -1.03 0.00 0.00 54.13 53.98 3d2c s LEU 124 Cb -0.39 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 43.85 3d2c s LEU 124 CO 0.48 0.37 -0.19 -0.31 0.23 0.00 0.00 176.35 176.93 3d2c s TYR 125 N -0.82 1.66 -0.14 0.29 1.51 0.13 -0.82 117.35 119.17 3d2c s TYR 125 Ca 0.13 -0.35 -0.02 0.00 -1.01 0.00 0.00 57.07 55.83 3d2c s TYR 125 Cb -0.12 -1.02 0.04 0.00 -0.11 0.00 0.00 41.96 40.76 3d2c s TYR 125 CO 0.03 0.04 -0.00 0.99 -1.11 0.00 0.00 175.55 175.50 3d2c s THR 126 N -0.68 0.65 -0.33 -0.71 2.01 -0.40 -1.12 115.64 115.06 3d2c s THR 126 Ca 0.06 -0.34 -0.09 0.00 0.31 0.00 0.00 61.69 61.63 3d2c s THR 126 Cb -0.08 -0.94 0.02 0.00 0.01 0.00 0.00 72.50 71.51 3d2c s THR 126 CO 0.01 0.06 0.14 -0.55 -0.69 0.00 0.00 174.62 173.59 3d2c s SER 127 N 1.83 5.46 -0.15 3.53 0.15 0.66 -1.36 113.70 123.82 3d2c s SER 127 Ca 0.02 -0.84 -0.06 0.00 0.70 0.00 0.00 55.95 55.77 3d2c s SER 127 Cb -0.15 -1.95 -0.04 0.00 -1.71 0.00 0.00 66.02 62.17 3d2c s SER 127 CO -0.07 -0.28 0.06 -0.63 1.20 0.00 0.00 173.24 173.52 3d2c s ILE 128 N 1.53 4.80 0.04 6.45 1.01 0.07 -0.59 121.20 134.51 3d2c s ILE 128 Ca 0.02 -0.04 -0.17 0.00 0.00 0.00 0.00 60.65 60.46 3d2c s ILE 128 Cb -0.18 -3.12 0.03 0.00 0.01 0.00 0.00 42.46 39.20 3d2c s ILE 128 CO 0.05 0.52 0.38 -0.72 0.00 0.00 0.00 174.94 175.16 3d2c s TYR 129 N -0.11 -0.22 0.02 3.97 -0.85 -0.95 0.13 117.35 119.35 3d2c s TYR 129 Ca 0.07 0.14 0.04 0.00 -0.52 0.00 0.00 57.07 56.80 3d2c s TYR 129 Cb -0.12 0.18 -0.03 0.00 0.38 0.00 0.00 41.96 42.37 3d2c s TYR 129 CO 0.01 -0.55 -0.07 0.45 -1.52 0.00 0.00 175.55 173.87 3d2c s SER 130 N -2.03 4.60 0.10 -0.18 0.15 -1.26 -0.60 113.70 114.48 3d2c s SER 130 Ca -0.05 -0.18 0.22 0.00 0.70 0.00 0.00 55.95 56.64 3d2c s SER 130 Cb -0.01 -1.04 0.89 0.00 -1.71 0.00 0.00 66.02 64.14 3d2c s SER 130 CO -0.03 0.26 1.69 -1.54 1.20 0.00 0.00 173.24 174.82 3d2c n SER 131 N 1.38 0.30 -1.17 5.45 3.41 -0.46 -2.44 113.62 120.09 3d2c n SER 131 Ca -0.15 0.55 0.10 0.00 -0.26 0.00 0.00 58.87 59.11 3d2c n SER 131 Cb 0.52 -0.62 0.28 0.00 -0.26 0.00 0.00 64.21 64.13 3d2c n SER 131 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d2c n ASP 132 N -1.81 3.73 -4.66 4.04 8.00 -1.26 -4.94 116.55 119.65 3d2c n ASP 132 Ca 0.04 -2.04 -0.43 0.00 0.71 0.00 0.00 54.79 53.07 3d2c n ASP 132 Cb 0.27 -0.43 -0.02 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.01 6.88 0.00 -2.24 -1.08 -1.02 -4.58 116.67 113.62 3d2c s ASP 133 Ca 0.42 1.84 0.25 0.00 -0.52 0.00 0.00 52.55 54.54 3d2c s ASP 133 Cb 0.22 -2.54 0.44 0.00 -1.46 0.00 0.00 42.92 39.58 3d2c s ASP 133 CO 0.28 -0.79 1.36 0.23 0.52 0.00 0.00 175.17 176.77 3d2c n MET 134 N 6.58 0.55 -0.13 4.34 2.81 -1.26 -4.52 117.12 125.49 3d2c n MET 134 Ca 0.14 -0.37 -0.25 0.00 -1.81 0.00 0.00 57.70 55.42 3d2c n MET 134 Cb 0.44 -1.49 -0.10 0.00 -0.71 0.00 0.00 33.22 31.36 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 -0.91 1.45 -3.94 2.02 2.08 -1.26 -4.92 119.36 113.88 3d2c n ILE 135 Ca 0.09 -0.43 -0.35 0.00 0.56 0.00 0.00 62.75 62.62 3d2c n ILE 135 Cb 0.36 -1.71 -0.14 0.00 -0.75 0.00 0.00 39.64 37.39 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 -2.49 3.01 0.40 1.39 1.01 -1.26 -5.09 120.40 117.37 3d2c s VAL 136 Ca -0.36 -0.86 -0.27 0.00 0.00 0.00 0.00 61.98 60.49 3d2c s VAL 136 Cb 0.13 -2.47 -0.10 0.00 0.00 0.00 0.00 36.38 33.93 3d2c s VAL 136 CO 0.50 0.27 1.47 0.23 0.00 0.00 0.00 175.10 177.57 3d2c n MET 137 N 4.71 2.54 0.30 2.72 2.81 -1.26 -4.85 117.12 124.10 3d2c n MET 137 Ca -0.17 0.89 0.17 0.00 -1.81 0.00 0.00 57.70 56.79 3d2c n MET 137 Cb 0.48 -2.65 0.99 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 2.73 0.00 -0.97 7.83 -0.26 -1.91 -0.64 115.58 122.36 3d2c h ASN 138 Ca -0.51 0.00 0.01 0.00 -0.56 0.00 0.00 56.30 55.25 3d2c h ASN 138 Cb 1.25 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.46 3d2c h ASN 138 CO 0.63 0.00 0.64 0.22 -1.06 0.00 0.00 177.43 177.86 3d2c h TYR 139 N 0.00 1.21 0.00 1.19 3.20 -1.95 -1.34 116.97 119.29 3d2c h TYR 139 Ca 0.01 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.78 3d2c h TYR 139 Cb 0.05 -0.41 -0.02 0.00 1.54 0.00 0.00 36.73 37.89 3d2c h TYR 139 CO 0.00 0.75 -0.62 -0.07 -1.64 0.00 0.00 178.16 176.58 3d2c h LEU 140 N 1.30 0.00 0.01 2.82 3.38 -1.42 -3.30 115.31 118.10 3d2c h LEU 140 Ca 0.36 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.16 3d2c h LEU 140 Cb -0.12 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.64 3d2c h LEU 140 CO -0.09 0.62 -0.66 0.28 0.09 0.00 0.00 178.44 178.68 3d2c h SER 141 N 0.00 0.57 -1.84 -0.43 0.02 -1.30 0.06 113.55 110.62 3d2c h SER 141 Ca -0.01 -0.77 -0.65 0.00 -0.84 0.00 0.00 61.79 59.53 3d2c h SER 141 Cb 1.20 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 63.58 3d2c h SER 141 CO 0.08 1.27 1.10 0.54 -1.14 0.00 0.00 176.83 178.68 3d2c n ARG 142 N -4.17 1.86 -4.06 3.45 1.74 -0.55 -4.74 116.66 110.18 3d2c n ARG 142 Ca -0.11 0.67 -0.35 0.00 -0.77 0.00 0.00 57.85 57.29 3d2c n ARG 142 Cb 0.71 -2.54 -0.14 0.00 -1.02 0.00 0.00 32.46 29.47 3d2c n ARG 142 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3d2c s LEU 143 N 4.42 2.95 0.10 0.55 0.20 -1.26 -4.82 118.68 120.82 3d2c s LEU 143 Ca 0.96 -0.34 -0.31 0.00 0.69 0.00 0.00 54.13 55.13 3d2c s LEU 143 Cb -0.78 -1.74 -0.10 0.00 -0.43 0.00 0.00 46.19 43.14 3d2c s LEU 143 CO 0.54 0.03 1.88 -1.81 -0.29 0.00 0.00 176.35 176.69 3d2c s ASP 144 N 1.21 6.42 0.00 3.68 1.01 -0.14 -1.89 116.67 126.96 3d2c s ASP 144 Ca 0.03 2.75 0.00 0.00 0.71 0.00 0.00 52.55 56.03 3d2c s ASP 144 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.23 3d2c s ASP 144 CO -0.01 -1.02 0.00 0.61 0.21 0.00 0.00 175.17 174.96 3d2c n GLY 145 N 4.34 0.89 3.98 0.21 0.00 -1.26 -1.40 105.19 111.94 3d2c n GLY 145 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.66 4.41 -0.71 4.61 0.00 -0.79 -0.87 121.76 125.74 3d2c s ALA 146 Ca 0.00 -1.73 -0.24 0.00 0.00 0.00 0.00 51.96 49.99 3d2c s ALA 146 Cb 0.00 -1.46 0.06 0.00 0.00 0.00 0.00 23.12 21.72 3d2c s ALA 146 CO 0.00 -0.28 1.10 0.50 0.00 0.00 0.00 175.76 177.08 3d2c s ARG 147 N -4.30 3.18 -0.24 0.00 3.52 -0.27 -4.88 118.95 115.96 3d2c s ARG 147 Ca 0.53 -0.69 -0.17 0.00 -0.13 0.00 0.00 55.73 55.27 3d2c s ARG 147 Cb -0.08 -4.29 -0.03 0.00 -1.56 0.00 0.00 34.95 28.98 3d2c s ARG 147 CO 0.32 -1.94 0.46 -0.80 -0.81 0.00 0.00 175.30 172.52 3d2c s ASN 148 N 3.75 6.42 -0.18 -2.12 0.01 -1.26 -0.25 114.94 121.31 3d2c s ASN 148 Ca 0.28 0.50 0.00 0.00 -0.71 0.00 0.00 52.86 52.93 3d2c s ASN 148 Cb -0.13 -2.26 0.04 0.00 0.41 0.00 0.00 41.25 39.32 3d2c s ASN 148 CO 0.10 -0.19 -0.09 -0.69 -1.51 0.00 0.00 177.10 174.71 3d2c s VAL 149 N 1.90 1.46 -0.06 1.60 1.01 0.24 -4.96 120.40 121.59 3d2c s VAL 149 Ca 0.20 -0.84 -0.15 0.00 0.00 0.00 0.00 61.98 61.19 3d2c s VAL 149 Cb -0.15 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.63 3d2c s VAL 149 CO 0.09 0.19 0.38 -1.58 0.00 0.00 0.00 175.10 174.18 3d2c s GLN 150 N 1.48 4.02 0.48 2.72 0.74 -1.26 -2.25 119.66 125.59 3d2c s GLN 150 Ca 0.00 0.31 0.02 0.00 0.05 0.00 0.00 55.36 55.75 3d2c s GLN 150 Cb -0.15 -3.30 -0.02 0.00 1.10 0.00 0.00 33.01 30.64 3d2c s GLN 150 CO -0.08 0.52 0.04 0.96 -0.55 0.00 0.00 175.29 176.17 3d2c s ILE 151 N -0.48 1.07 0.13 -2.34 -4.36 0.23 -4.97 121.20 110.49 3d2c s ILE 151 Ca 0.22 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.62 3d2c s ILE 151 Cb -0.15 -2.27 -0.04 0.00 1.25 0.00 0.00 42.46 41.24 3d2c s ILE 151 CO 0.10 0.00 -0.00 -1.00 0.24 0.00 0.00 174.94 174.28 3d2c s HIS 152 N -2.96 0.94 0.00 1.37 3.76 -1.26 -1.36 115.29 115.78 3d2c s HIS 152 Ca 0.13 -1.06 0.00 0.00 -0.15 0.00 0.00 55.06 53.97 3d2c s HIS 152 Cb 0.03 -0.55 0.00 0.00 1.11 0.00 0.00 32.58 33.17 3d2c s HIS 152 CO 0.07 -0.31 0.00 0.41 -0.85 0.00 0.00 174.74 174.06 3d2c n GLY 153 N -0.10 0.43 3.15 -2.22 0.00 -1.26 -4.97 105.19 100.22 3d2c n GLY 153 Ca -0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.87 1.66 0.87 1.61 1.01 -1.26 -5.07 120.40 117.35 3d2c s VAL 154 Ca 0.00 -0.81 -0.13 0.00 0.00 0.00 0.00 61.98 61.04 3d2c s VAL 154 Cb 0.00 -1.44 0.13 0.00 0.00 0.00 0.00 36.38 35.07 3d2c s VAL 154 CO 0.00 0.47 1.23 -0.83 0.00 0.00 0.00 175.10 175.97 3d2c s GLY 155 N 0.26 1.66 0.12 4.51 0.00 -1.26 -3.82 107.32 108.78 3d2c s GLY 155 Ca -0.11 -0.84 -0.25 0.00 0.00 0.00 0.00 44.72 43.51 3d2c s GLY 155 CO 0.05 -0.25 1.65 0.84 0.00 0.00 0.00 173.10 175.40 3d2c h HIS 156 N -1.29 -0.55 0.00 1.90 2.76 -1.93 -2.24 115.15 113.80 3d2c h HIS 156 Ca -0.46 0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 57.59 3d2c h HIS 156 Cb 1.30 0.24 -0.02 0.00 1.55 0.00 0.00 27.41 30.47 3d2c h HIS 156 CO -0.22 -0.30 -0.67 0.52 -1.30 0.00 0.00 177.93 175.97 3d2c h MET 157 N -0.36 0.00 -0.06 5.26 2.86 -2.01 -3.06 114.93 117.57 3d2c h MET 157 Ca 0.05 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 3d2c h MET 157 Cb 0.41 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.07 3d2c h MET 157 CO -0.16 0.67 0.07 0.78 1.06 0.00 0.00 176.91 179.33 3d2c h GLY 158 N 2.23 0.00 0.35 8.32 0.00 -1.80 -1.68 103.07 110.50 3d2c h GLY 158 Ca -0.01 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.49 3d2c h GLY 158 CO 0.09 0.00 0.60 1.41 0.00 0.00 0.00 176.54 178.64 3d2c h LEU 159 N 0.00 0.66 0.00 3.11 3.38 -1.31 -0.18 115.31 120.97 3d2c h LEU 159 Ca 0.03 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3d2c h LEU 159 Cb 0.17 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3d2c h LEU 159 CO -0.00 0.29 0.00 0.18 0.09 0.00 0.00 178.44 179.00 3d2c n LEU 160 N -4.61 0.00 -0.08 1.67 4.77 -0.63 -3.01 117.00 115.10 3d2c n LEU 160 Ca 0.20 0.46 0.01 0.00 -0.03 0.00 0.00 56.01 56.65 3d2c n LEU 160 Cb 0.54 -0.46 0.01 0.00 -2.33 0.00 0.00 43.42 41.18 3d2c n LEU 160 CO 0.27 -0.30 0.32 -1.22 -1.33 0.00 0.00 177.39 175.14 3d2c n TYR 161 N -1.46 0.00 -2.66 -1.77 4.01 -0.16 -4.31 117.16 110.80 3d2c n TYR 161 Ca 0.03 -0.16 -0.41 0.00 -0.16 0.00 0.00 57.90 57.20 3d2c n TYR 161 Cb 0.12 -0.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.08 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 -0.53 7.40 0.20 7.72 0.15 -0.70 -4.96 113.70 122.99 3d2c s SER 162 Ca 0.02 1.85 -0.06 0.00 0.70 0.00 0.00 55.95 58.46 3d2c s SER 162 Cb 0.02 -2.59 0.15 0.00 -1.71 0.00 0.00 66.02 61.89 3d2c s SER 162 CO 0.00 -0.16 1.62 0.77 1.20 0.00 0.00 173.24 176.68 3d2c h SER 163 N 5.77 0.85 0.52 5.45 4.64 -1.92 -1.15 113.55 127.72 3d2c h SER 163 Ca -0.43 -0.30 -0.11 0.00 -0.47 0.00 0.00 61.79 60.48 3d2c h SER 163 Cb 1.21 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 3d2c h SER 163 CO 0.73 1.02 -0.53 0.06 -0.87 0.00 0.00 176.83 177.24 3d2c h GLN 164 N 0.74 0.01 -0.42 4.77 3.07 -1.97 -2.25 115.11 119.06 3d2c h GLN 164 Ca 0.11 -0.01 -0.13 0.00 0.09 0.00 0.00 58.65 58.72 3d2c h GLN 164 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.26 3d2c h GLN 164 CO 0.05 0.54 -0.23 0.28 0.09 0.00 0.00 178.83 179.57 3d2c h VAL 165 N 0.01 1.28 -0.46 1.86 2.07 -1.79 -2.56 116.25 116.65 3d2c h VAL 165 Ca -0.00 -1.38 0.05 0.00 0.82 0.00 0.00 66.70 66.18 3d2c h VAL 165 Cb 0.94 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 3d2c h VAL 165 CO 0.07 0.47 0.22 1.88 0.02 0.00 0.00 177.57 180.22 3d2c h TYR 166 N 0.71 0.39 -0.86 1.57 -1.99 -0.84 0.54 116.97 116.49 3d2c h TYR 166 Ca 0.09 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.83 3d2c h TYR 166 Cb 0.80 -0.11 -0.04 0.00 2.00 0.00 0.00 36.73 39.38 3d2c h TYR 166 CO 0.06 0.18 0.50 0.77 -0.00 0.00 0.00 178.16 179.67 3d2c h SER 167 N 0.43 1.06 0.17 3.88 0.02 -1.33 -0.94 113.55 116.83 3d2c h SER 167 Ca 0.21 -0.08 -0.13 0.00 -0.84 0.00 0.00 61.79 60.94 3d2c h SER 167 Cb 0.14 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 3d2c h SER 167 CO -0.16 0.83 -0.47 -0.07 -1.14 0.00 0.00 176.83 175.82 3d2c h LEU 168 N 1.19 0.39 -0.15 5.07 3.38 -1.00 -1.56 115.31 122.64 3d2c h LEU 168 Ca 0.31 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3d2c h LEU 168 Cb -0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3d2c h LEU 168 CO -0.05 0.80 0.05 0.40 0.09 0.00 0.00 178.44 179.73 3d2c h ILE 169 N 0.29 1.18 -0.46 1.22 2.04 -0.33 0.36 117.51 121.82 3d2c h ILE 169 Ca 0.02 -0.54 0.03 0.00 1.00 0.00 0.00 64.86 65.36 3d2c h ILE 169 Cb 0.94 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.25 3d2c h ILE 169 CO 0.08 0.17 0.26 0.50 0.00 0.00 0.00 178.15 179.15 3d2c h LYS 170 N 0.07 0.50 -0.54 2.37 3.64 -1.04 0.25 116.57 121.82 3d2c h LYS 170 Ca 0.05 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3d2c h LYS 170 Cb 0.21 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 3d2c h LYS 170 CO -0.00 0.33 0.33 0.93 -2.27 0.00 0.00 179.45 178.77 3d2c h GLU 171 N 0.51 0.63 -0.40 1.90 5.08 -1.09 0.85 114.58 122.07 3d2c h GLU 171 Ca 0.19 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 3d2c h GLU 171 Cb 0.05 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 3d2c h GLU 171 CO -0.10 0.42 0.17 0.78 -1.00 0.00 0.00 179.01 179.28 3d2c h GLY 172 N 0.65 0.62 2.00 -3.84 0.00 -0.11 0.21 103.07 102.61 3d2c h GLY 172 Ca 0.22 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 3d2c h GLY 172 CO -0.10 0.31 -0.08 1.41 0.00 0.00 0.00 176.54 178.08 3d2c h LEU 173 N 0.50 0.00 -3.21 3.11 3.38 -0.10 -1.71 115.31 117.28 3d2c h LEU 173 Ca 0.13 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.90 3d2c h LEU 173 Cb 0.15 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.78 3d2c h LEU 173 CO -0.01 0.08 0.25 0.59 0.09 0.00 0.00 178.44 179.44 3d2c n ASN 174 N -3.35 4.04 0.00 -0.43 3.02 0.26 -4.88 115.26 113.92 3d2c n ASN 174 Ca -0.01 -2.96 0.00 0.00 -0.03 0.00 0.00 54.58 51.58 3d2c n ASN 174 Cb 0.26 -0.70 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 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 -0.15 0.70 0.00 7.41 0.00 -0.65 -4.95 105.19 107.55 3d2c n GLY 175 Ca 0.33 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.44 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 -2.56 -0.70 3.58 -0.02 0.00 0.68 -4.85 105.19 101.31 3d2c n GLY 176 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 3d2c n GLY 176 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d2c s GLY 177 N -2.22 1.56 0.13 -0.02 0.00 -1.26 -4.85 107.32 100.67 3d2c s GLY 177 Ca 0.24 -0.84 -0.03 0.00 0.00 0.00 0.00 44.72 44.09 3d2c s GLY 177 CO 0.24 0.02 0.11 1.20 0.00 0.00 0.00 173.10 174.67 3d2c s GLN 178 N -5.29 0.96 -0.42 2.90 -0.21 -0.45 -4.67 119.66 112.48 3d2c s GLN 178 Ca 0.70 -1.34 0.01 0.00 0.02 0.00 0.00 55.36 54.75 3d2c s GLN 178 Cb -0.12 0.28 0.24 0.00 1.00 0.00 0.00 33.01 34.41 3d2c s GLN 178 CO 0.57 -0.29 1.00 -1.71 -2.12 0.00 0.00 175.29 172.74 3d2c n ASN 179 N -0.11 -2.26 -0.94 5.90 2.85 -0.68 -0.69 115.26 119.32 3d2c n ASN 179 Ca -0.07 -2.33 0.00 0.00 -0.11 0.00 0.00 54.58 52.07 3d2c n ASN 179 Cb 0.63 1.28 0.00 0.00 1.24 0.00 0.00 39.78 42.93 3d2c n ASN 179 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 3d2c n THR 180 N 2.04 0.74 0.23 -0.44 -2.24 -0.05 -5.01 114.28 109.55 3d2c n THR 180 Ca 0.09 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.90 3d2c n THR 180 Cb 0.64 -0.86 0.02 0.00 -2.10 0.00 0.00 70.33 68.03 3d2c n THR 180 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09