#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 4.99 0.66 0.41 0.01 -1.26 -4.98 114.94 114.77 3d2c s ASN 4 Ca 0.00 1.53 -0.17 0.00 -0.71 0.00 0.00 52.86 53.51 3d2c s ASN 4 Cb 0.00 -2.34 0.00 0.00 0.41 0.00 0.00 41.25 39.32 3d2c s ASN 4 CO 0.00 -1.68 1.25 -2.84 -1.51 0.00 0.00 177.10 172.31 3d2c s PRO 5 N -5.07 2.51 -0.15 -0.60 0.02 -1.26 -4.66 135.00 125.79 3d2c s PRO 5 Ca 0.59 1.91 -0.01 0.00 0.02 0.00 0.00 61.00 63.51 3d2c s PRO 5 Cb -0.14 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.50 3d2c s PRO 5 CO 0.55 -1.59 -0.10 0.08 -0.33 0.00 0.00 177.00 175.60 3d2c s VAL 6 N -1.63 3.22 -0.20 3.83 1.01 -0.58 -0.96 120.40 125.10 3d2c s VAL 6 Ca 0.79 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 62.14 3d2c s VAL 6 Cb -0.33 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 3d2c s VAL 6 CO 0.40 0.51 -0.05 -0.69 0.00 0.00 0.00 175.10 175.26 3d2c s VAL 7 N 0.49 3.40 -0.16 2.92 1.01 0.14 0.16 120.40 128.36 3d2c s VAL 7 Ca -0.08 -0.50 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 3d2c s VAL 7 Cb -0.15 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 3d2c s VAL 7 CO 0.04 0.45 0.05 -0.04 0.00 0.00 0.00 175.10 175.59 3d2c s MET 8 N 1.15 3.81 -0.24 2.72 -1.94 0.12 -1.66 119.30 123.26 3d2c s MET 8 Ca 0.02 -0.36 -0.00 0.00 -1.71 0.00 0.00 55.69 53.63 3d2c s MET 8 Cb -0.14 -3.13 0.03 0.00 2.01 0.00 0.00 34.83 33.60 3d2c s MET 8 CO -0.01 0.34 -0.10 0.08 -0.01 0.00 0.00 175.02 175.33 3d2c s VAL 9 N 0.16 2.60 0.83 -6.03 1.01 0.16 -2.00 120.40 117.14 3d2c s VAL 9 Ca 0.04 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 60.78 3d2c s VAL 9 Cb -0.12 -2.31 0.09 0.00 0.00 0.00 0.00 36.38 34.04 3d2c s VAL 9 CO 0.01 0.22 1.15 -1.38 0.00 0.00 0.00 175.10 175.10 3d2c s HIS 10 N 1.28 2.82 0.00 5.22 -3.43 -1.26 -0.78 115.29 119.13 3d2c s HIS 10 Ca -0.00 0.86 0.00 0.00 -0.80 0.00 0.00 55.06 55.12 3d2c s HIS 10 Cb -0.17 -3.37 0.00 0.00 -1.43 0.00 0.00 32.58 27.61 3d2c s HIS 10 CO -0.06 -1.93 0.00 0.41 -2.00 0.00 0.00 174.74 171.16 3d2c n GLY 11 N -2.75 2.18 3.70 -1.38 0.00 -1.20 -3.48 105.19 102.27 3d2c n GLY 11 Ca 0.07 -2.09 -0.42 0.00 0.00 0.00 0.00 46.02 43.58 3d2c n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d2c s ILE 12 N 1.36 3.21 0.00 -0.61 1.01 -1.26 -1.70 121.20 123.21 3d2c s ILE 12 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.44 3d2c s ILE 12 Cb 0.00 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.97 3d2c s ILE 12 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.58 3d2c n GLY 13 N 3.68 1.07 1.65 6.18 0.00 -1.26 -5.02 105.19 111.49 3d2c n GLY 13 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.00 1.11 3.82 -0.02 0.00 -0.69 -5.14 105.19 102.27 3d2c n GLY 14 Ca 0.00 -2.05 -0.07 0.00 0.00 0.00 0.00 46.02 43.91 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 -2.66 -0.26 0.52 1.61 1.04 -1.26 -4.85 113.70 107.83 3d2c s SER 15 Ca 0.27 -0.54 0.26 0.00 0.48 0.00 0.00 55.95 56.42 3d2c s SER 15 Cb -0.02 0.68 1.38 0.00 0.10 0.00 0.00 66.02 68.16 3d2c s SER 15 CO 0.18 -1.25 1.94 0.77 0.98 0.00 0.00 173.24 175.86 3d2c h SER 16 N 2.00 0.06 0.44 7.02 4.64 -1.88 0.12 113.55 125.95 3d2c h SER 16 Ca -0.21 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 3d2c h SER 16 Cb 1.25 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3d2c h SER 16 CO 0.24 0.03 0.00 0.77 -0.87 0.00 0.00 176.83 177.00 3d2c h SER 17 N 0.06 0.00 0.37 4.97 4.64 -1.95 -2.06 113.55 119.58 3d2c h SER 17 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 3d2c h SER 17 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3d2c h SER 17 CO -0.03 0.00 0.00 0.78 -0.87 0.00 0.00 176.83 176.71 3d2c h ASN 18 N 0.00 0.00 -0.67 4.97 2.35 -1.38 -2.83 115.58 118.03 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 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 3d2c h ASN 18 CO 0.00 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.27 3d2c n PHE 19 N -2.92 1.44 -0.33 1.19 3.72 -0.78 -4.51 117.46 115.27 3d2c n PHE 19 Ca -0.01 -0.59 -0.03 0.00 -0.05 0.00 0.00 57.45 56.77 3d2c n PHE 19 Cb 0.15 -0.21 0.10 0.00 -0.94 0.00 0.00 39.48 38.58 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 4.18 1.25 0.09 -1.08 4.39 -1.68 0.01 114.58 121.73 3d2c h GLU 20 Ca 0.00 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.56 3d2c h GLU 20 Cb 1.39 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3d2c h GLU 20 CO 0.20 0.90 -0.04 0.78 -1.16 0.00 0.00 179.01 179.69 3d2c h GLY 21 N 1.27 -0.12 0.69 -3.84 0.00 -1.83 -1.56 103.07 97.67 3d2c h GLY 21 Ca 0.32 0.05 0.06 0.00 0.00 0.00 0.00 47.33 47.75 3d2c h GLY 21 CO -0.05 -0.04 0.39 -2.22 0.00 0.00 0.00 176.54 174.62 3d2c h ILE 22 N -0.40 0.98 -0.00 2.60 2.04 -1.68 -0.40 117.51 120.65 3d2c h ILE 22 Ca -0.01 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.60 3d2c h ILE 22 Cb 0.34 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 3d2c h ILE 22 CO 0.02 0.13 -0.02 0.11 0.00 0.00 0.00 178.15 178.39 3d2c h LYS 23 N 0.73 -0.03 -0.35 2.37 1.57 -0.94 -1.02 116.57 118.90 3d2c h LYS 23 Ca 0.31 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 59.15 3d2c h LYS 23 Cb 0.18 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.44 3d2c h LYS 23 CO -0.18 -0.02 -0.00 0.77 -0.57 0.00 0.00 179.45 179.45 3d2c h SER 24 N -0.04 -0.14 0.02 0.86 0.02 -0.66 -0.47 113.55 113.14 3d2c h SER 24 Ca 0.01 0.08 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 3d2c h SER 24 Cb 0.05 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3d2c h SER 24 CO -0.03 -0.04 -0.13 0.22 -1.14 0.00 0.00 176.83 175.72 3d2c h TYR 25 N 0.10 -0.33 -0.81 3.45 3.20 -0.83 -1.25 116.97 120.50 3d2c h TYR 25 Ca 0.17 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.08 3d2c h TYR 25 Cb 0.23 0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 3d2c h TYR 25 CO -0.24 -0.19 0.52 -0.07 -1.64 0.00 0.00 178.16 176.53 3d2c h LEU 26 N -0.23 0.87 -0.84 2.82 3.38 -0.72 -1.25 115.31 119.33 3d2c h LEU 26 Ca 0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3d2c h LEU 26 Cb 0.27 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 3d2c h LEU 26 CO -0.11 0.60 0.51 0.58 0.09 0.00 0.00 178.44 180.11 3d2c h VAL 27 N 1.02 1.23 0.00 1.22 2.07 -0.82 0.19 116.25 121.17 3d2c h VAL 27 Ca 0.32 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 3d2c h VAL 27 Cb -0.01 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 3d2c h VAL 27 CO -0.11 0.24 -0.01 0.77 0.02 0.00 0.00 177.57 178.49 3d2c h SER 28 N 1.16 0.00 -0.34 0.57 4.64 -0.19 -2.34 113.55 117.04 3d2c h SER 28 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3d2c h SER 28 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3d2c h SER 28 CO -0.06 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.91 3d2c n GLN 29 N -3.12 2.42 0.00 4.77 1.13 -0.05 -4.96 117.38 117.58 3d2c n GLN 29 Ca -0.01 -2.14 0.00 0.00 -1.94 0.00 0.00 57.00 52.91 3d2c n GLN 29 Cb 0.19 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.04 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 1.46 1.37 3.79 1.08 0.00 -0.87 -5.06 105.19 106.96 3d2c n GLY 30 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 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 2.90 -0.02 1.61 0.51 -0.57 -4.99 118.94 116.35 3d2c s TRP 31 Ca 0.00 1.55 -0.27 0.00 -2.12 0.00 0.00 56.10 55.26 3d2c s TRP 31 Cb 0.00 -3.11 -0.04 0.00 -0.81 0.00 0.00 33.47 29.52 3d2c s TRP 31 CO 0.00 -1.13 0.84 -1.12 -0.51 0.00 0.00 176.95 175.04 3d2c s SER 32 N -2.18 7.20 0.17 2.95 0.01 -1.26 -4.26 113.70 116.33 3d2c s SER 32 Ca 0.68 1.45 -0.15 0.00 1.31 0.00 0.00 55.95 59.24 3d2c s SER 32 Cb -0.18 -2.50 0.13 0.00 0.21 0.00 0.00 66.02 63.68 3d2c s SER 32 CO 0.27 -0.17 1.71 -0.09 0.41 0.00 0.00 173.24 175.38 3d2c h ARG 33 N 6.62 0.16 0.00 12.44 2.43 -1.94 -0.42 114.38 133.67 3d2c h ARG 33 Ca -0.41 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 3d2c h ARG 33 Cb 1.21 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3d2c h ARG 33 CO 0.75 0.11 0.00 -0.40 -1.51 0.00 0.00 179.97 178.91 3d2c n ASP 34 N -5.15 0.00 -1.26 -3.80 5.75 -1.26 -2.20 116.55 108.63 3d2c n ASP 34 Ca 0.03 0.12 0.01 0.00 -0.01 0.00 0.00 54.79 54.94 3d2c n ASP 34 Cb 0.21 -0.30 0.25 0.00 -1.03 0.00 0.00 41.12 40.25 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 -1.30 2.81 -4.04 0.11 5.02 -0.17 -4.89 118.16 115.70 3d2c n LYS 35 Ca 0.06 -3.00 -0.31 0.00 -2.02 0.00 0.00 58.31 53.04 3d2c n LYS 35 Cb 0.12 -1.94 -0.16 0.00 -0.02 0.00 0.00 35.03 33.03 3d2c n LYS 35 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d2c s LEU 36 N -3.00 2.01 0.09 -0.35 1.43 -0.93 -1.53 118.68 116.40 3d2c s LEU 36 Ca 0.46 -0.66 0.10 0.00 -1.03 0.00 0.00 54.13 53.00 3d2c s LEU 36 Cb 0.39 -1.28 -0.03 0.00 0.03 0.00 0.00 46.19 45.29 3d2c s LEU 36 CO 0.08 -0.07 -0.25 -0.31 0.23 0.00 0.00 176.35 176.03 3d2c s TYR 37 N 1.40 2.15 -0.08 0.29 1.51 0.12 -4.97 117.35 117.77 3d2c s TYR 37 Ca 0.03 -0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 55.70 3d2c s TYR 37 Cb -0.14 -1.21 0.02 0.00 -0.11 0.00 0.00 41.96 40.52 3d2c s TYR 37 CO -0.10 0.23 -0.05 0.00 -1.11 0.00 0.00 175.55 174.51 3d2c s ALA 38 N -0.98 0.99 0.59 3.71 0.00 -1.26 0.13 121.76 124.93 3d2c s ALA 38 Ca 0.11 -0.30 -0.08 0.00 0.00 0.00 0.00 51.96 51.69 3d2c s ALA 38 Cb -0.10 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.29 3d2c s ALA 38 CO 0.04 -0.27 0.94 0.54 0.00 0.00 0.00 175.76 177.01 3d2c s VAL 39 N 1.47 4.39 -0.17 0.00 0.11 -0.85 -4.83 120.40 120.53 3d2c s VAL 39 Ca -0.01 0.45 -0.00 0.00 -2.93 0.00 0.00 61.98 59.49 3d2c s VAL 39 Cb -0.13 -3.73 0.04 0.00 -1.53 0.00 0.00 36.38 31.03 3d2c s VAL 39 CO -0.04 -0.86 -0.05 -1.81 -3.33 0.00 0.00 175.10 169.01 3d2c s ASP 40 N -4.21 2.83 -0.06 3.54 1.01 -1.26 -3.70 116.67 114.82 3d2c s ASP 40 Ca 0.53 -0.66 -0.21 0.00 0.71 0.00 0.00 52.55 52.91 3d2c s ASP 40 Cb -0.11 -0.91 -0.04 0.00 1.01 0.00 0.00 42.92 42.87 3d2c s ASP 40 CO 0.49 -0.18 0.62 -0.36 0.21 0.00 0.00 175.17 175.95 3d2c s PHE 41 N 1.63 3.60 0.14 4.23 0.08 -1.26 -4.96 117.98 121.44 3d2c s PHE 41 Ca 0.01 1.16 -0.06 0.00 0.12 0.00 0.00 56.93 58.16 3d2c s PHE 41 Cb -0.15 -2.69 -0.05 0.00 -0.57 0.00 0.00 43.02 39.56 3d2c s PHE 41 CO -0.08 0.19 1.35 0.11 -0.10 0.00 0.00 175.22 176.70 3d2c h TRP 42 N 6.37 0.72 -2.58 0.36 5.08 -2.00 -3.42 115.95 120.48 3d2c h TRP 42 Ca -0.42 -0.34 -0.55 0.00 1.08 0.00 0.00 58.89 58.66 3d2c h TRP 42 Cb 1.19 -0.10 -0.04 0.00 -3.00 0.00 0.00 29.16 27.21 3d2c h TRP 42 CO 0.64 1.14 1.23 0.34 -1.28 0.00 0.00 178.44 180.52 3d2c s ASP 43 N -7.06 5.82 0.37 0.11 -1.08 -1.26 -4.86 116.67 108.70 3d2c s ASP 43 Ca -0.07 0.73 0.27 0.00 -0.52 0.00 0.00 52.55 52.96 3d2c s ASP 43 Cb 0.09 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.26 3d2c s ASP 43 CO 0.87 -1.87 1.81 0.11 0.52 0.00 0.00 175.17 176.60 3d2c h LYS 44 N 12.82 0.00 0.00 4.34 1.79 -1.99 -2.32 116.57 131.21 3d2c h LYS 44 Ca -0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 3d2c h LYS 44 Cb 1.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 3d2c h LYS 44 CO 1.13 0.00 -0.29 0.25 -1.08 0.00 0.00 179.45 179.46 3d2c n THR 45 N -2.47 0.37 -2.00 -0.16 -2.24 -1.26 -4.24 114.28 102.27 3d2c n THR 45 Ca 0.00 -0.22 -0.16 0.00 -2.27 0.00 0.00 64.05 61.41 3d2c n THR 45 Cb 0.18 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.06 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 1.36 0.37 3.77 3.38 0.00 -0.87 -4.96 105.19 108.23 3d2c n GLY 46 Ca 0.05 -0.25 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.71 2.75 0.42 2.61 -4.23 -1.26 -4.87 115.64 108.35 3d2c s THR 47 Ca 0.00 0.71 0.08 0.00 -1.18 0.00 0.00 61.69 61.30 3d2c s THR 47 Cb 0.00 -3.43 0.26 0.00 1.34 0.00 0.00 72.50 70.67 3d2c s THR 47 CO 0.00 0.13 2.06 0.78 -0.54 0.00 0.00 174.62 177.05 3d2c h ASN 48 N 3.02 0.42 -0.97 3.99 2.35 -1.94 -0.81 115.58 121.64 3d2c h ASN 48 Ca -0.49 -0.01 0.04 0.00 -0.55 0.00 0.00 56.30 55.28 3d2c h ASN 48 Cb 1.23 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 39.44 3d2c h ASN 48 CO 0.64 0.31 0.64 1.88 -1.65 0.00 0.00 177.43 179.25 3d2c h TYR 49 N 0.49 1.18 0.06 1.19 0.05 -1.99 0.15 116.97 118.10 3d2c h TYR 49 Ca 0.13 0.03 -0.36 0.00 0.05 0.00 0.00 58.73 58.58 3d2c h TYR 49 Cb -0.04 -0.39 -0.04 0.00 1.01 0.00 0.00 36.73 37.27 3d2c h TYR 49 CO 0.00 0.68 -2.06 0.09 -1.05 0.00 0.00 178.16 175.82 3d2c n ASN 50 N -4.45 2.04 0.06 3.88 3.02 -1.04 -4.34 115.26 114.43 3d2c n ASN 50 Ca 0.13 0.16 -0.10 0.00 -0.03 0.00 0.00 54.58 54.74 3d2c n ASN 50 Cb 0.11 -0.76 0.01 0.00 -0.61 0.00 0.00 39.78 38.53 3d2c n ASN 50 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 3d2c h ASN 51 N -0.20 0.45 0.06 6.41 -0.26 -1.18 -3.02 115.58 117.84 3d2c h ASN 51 Ca -0.48 -0.32 0.02 0.00 -0.56 0.00 0.00 56.30 54.97 3d2c h ASN 51 Cb 1.85 -0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 38.94 3d2c h ASN 51 CO -0.05 1.07 -0.25 1.23 -1.06 0.00 0.00 177.43 178.38 3d2c h GLY 52 N 1.35 -0.41 1.01 2.83 0.00 -0.87 0.52 103.07 107.50 3d2c h GLY 52 Ca -0.04 0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 3d2c h GLY 52 CO 0.13 -0.21 0.38 -2.55 0.00 0.00 0.00 176.54 174.30 3d2c h PRO 53 N -0.41 1.05 -0.46 4.80 0.11 -1.75 -0.18 132.00 135.16 3d2c h PRO 53 Ca 0.05 -0.14 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 3d2c h PRO 53 Cb 0.47 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 3d2c h PRO 53 CO -0.18 0.80 0.27 0.28 -0.21 0.00 0.00 178.00 178.96 3d2c h VAL 54 N 1.03 1.15 -0.43 3.15 2.07 -1.36 -0.92 116.25 120.94 3d2c h VAL 54 Ca 0.26 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 3d2c h VAL 54 Cb 0.08 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3d2c h VAL 54 CO -0.04 0.15 0.17 0.25 0.02 0.00 0.00 177.57 178.12 3d2c h LEU 55 N 0.61 0.60 -0.24 2.57 5.85 -0.64 -0.38 115.31 123.67 3d2c h LEU 55 Ca 0.16 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.77 3d2c h LEU 55 Cb 0.01 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.82 3d2c h LEU 55 CO -0.03 0.61 -0.16 -1.28 -0.34 0.00 0.00 178.44 177.24 3d2c h SER 56 N 0.55 -0.51 -0.62 1.25 0.87 -0.58 0.17 113.55 114.69 3d2c h SER 56 Ca 0.14 0.11 -0.05 0.00 -1.23 0.00 0.00 61.79 60.76 3d2c h SER 56 Cb 0.20 0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 62.39 3d2c h SER 56 CO -0.01 -0.19 0.17 0.03 -0.53 0.00 0.00 176.83 176.30 3d2c h ARG 57 N -0.14 0.97 -0.90 2.24 3.08 -1.01 -2.09 114.38 116.53 3d2c h ARG 57 Ca 0.13 -0.22 0.01 0.00 0.07 0.00 0.00 59.98 59.97 3d2c h ARG 57 Cb 0.34 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 3d2c h ARG 57 CO -0.32 0.88 0.60 0.35 -1.07 0.00 0.00 179.97 180.40 3d2c h PHE 58 N 0.89 1.13 -0.36 3.04 3.57 -0.27 -1.22 116.94 123.71 3d2c h PHE 58 Ca 0.20 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.65 3d2c h PHE 58 Cb 0.32 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 3d2c h PHE 58 CO 0.02 0.70 -0.04 0.28 -2.23 0.00 0.00 178.31 177.04 3d2c h VAL 59 N 1.21 1.27 -0.65 1.41 2.07 -0.47 -2.42 116.25 118.66 3d2c h VAL 59 Ca 0.34 -1.08 0.04 0.00 0.82 0.00 0.00 66.70 66.82 3d2c h VAL 59 Cb -0.11 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 3d2c h VAL 59 CO -0.08 0.36 0.39 -0.61 0.02 0.00 0.00 177.57 177.65 3d2c h GLN 60 N 0.48 0.74 -0.66 1.57 5.75 -1.00 -0.44 115.11 121.54 3d2c h GLN 60 Ca 0.10 -0.04 0.04 0.00 -0.15 0.00 0.00 58.65 58.59 3d2c h GLN 60 Cb 0.53 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.87 3d2c h GLN 60 CO 0.03 0.49 0.40 -0.22 -2.65 0.00 0.00 178.83 176.87 3d2c h LYS 61 N 0.76 0.74 -0.35 1.69 3.64 -1.11 0.23 116.57 122.17 3d2c h LYS 61 Ca 0.27 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 3d2c h LYS 61 Cb 0.06 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 3d2c h LYS 61 CO -0.12 0.49 0.15 0.28 -2.27 0.00 0.00 179.45 177.98 3d2c h VAL 62 N 0.76 1.18 -0.36 2.00 2.07 -0.79 0.27 116.25 121.37 3d2c h VAL 62 Ca 0.28 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3d2c h VAL 62 Cb 0.08 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 30.70 3d2c h VAL 62 CO -0.13 0.19 0.24 -0.07 0.02 0.00 0.00 177.57 177.82 3d2c h LEU 63 N 0.43 0.42 -0.46 2.57 3.38 -0.55 0.40 115.31 121.50 3d2c h LEU 63 Ca 0.12 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3d2c h LEU 63 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3d2c h LEU 63 CO -0.01 0.30 0.22 0.44 0.09 0.00 0.00 178.44 179.48 3d2c h ASP 64 N 0.49 0.61 -0.55 -0.43 3.32 -0.29 1.17 116.42 120.74 3d2c h ASP 64 Ca 0.13 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 3d2c h ASP 64 Cb -0.06 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3d2c h ASP 64 CO -0.03 0.57 0.03 -0.08 -1.72 0.00 0.00 179.24 178.01 3d2c h GLU 65 N 0.61 0.95 0.00 3.56 4.81 -0.02 -3.24 114.58 121.25 3d2c h GLU 65 Ca 0.16 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 3d2c h GLU 65 Cb 0.12 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.40 3d2c h GLU 65 CO -0.02 0.94 -1.22 0.25 -0.73 0.00 0.00 179.01 178.23 3d2c n THR 66 N -4.29 0.22 -1.40 0.32 -2.24 0.14 -4.96 114.28 102.07 3d2c n THR 66 Ca 0.02 -0.35 -0.14 0.00 -2.27 0.00 0.00 64.05 61.31 3d2c n THR 66 Cb 0.31 0.08 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 3d2c n THR 66 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d2c n GLY 67 N 1.31 1.43 3.87 3.38 0.00 0.40 -4.98 105.19 110.61 3d2c n GLY 67 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.47 3.25 0.08 4.61 0.00 -1.20 -5.00 121.76 121.04 3d2c s ALA 68 Ca 0.00 -0.13 -0.04 0.00 0.00 0.00 0.00 51.96 51.80 3d2c s ALA 68 Cb 0.00 -2.85 -0.27 0.00 0.00 0.00 0.00 23.12 20.00 3d2c s ALA 68 CO 0.00 -0.20 1.15 -0.22 0.00 0.00 0.00 175.76 176.49 3d2c h LYS 69 N 0.83 0.26 -4.04 0.00 3.64 -1.93 -3.45 116.57 111.87 3d2c h LYS 69 Ca -0.47 -0.44 -0.12 0.00 -1.27 0.00 0.00 60.65 58.35 3d2c h LYS 69 Cb 1.19 0.16 -0.14 0.00 -0.41 0.00 0.00 32.23 33.04 3d2c h LYS 69 CO 0.63 1.21 -0.44 0.15 -2.27 0.00 0.00 179.45 178.72 3d2c s LYS 70 N -2.67 1.01 0.42 1.90 1.02 -1.26 -4.75 119.74 115.40 3d2c s LYS 70 Ca -0.04 -1.22 0.07 0.00 0.02 0.00 0.00 55.97 54.80 3d2c s LYS 70 Cb 0.07 0.32 -0.07 0.00 -0.52 0.00 0.00 37.83 37.64 3d2c s LYS 70 CO 0.88 -0.34 0.04 0.14 -0.92 0.00 0.00 175.35 175.16 3d2c s VAL 71 N -3.97 2.02 0.17 3.17 -7.23 -0.05 -4.07 120.40 110.43 3d2c s VAL 71 Ca 0.17 -1.94 0.10 0.00 -1.81 0.00 0.00 61.98 58.49 3d2c s VAL 71 Cb 0.05 -2.96 -0.04 0.00 0.56 0.00 0.00 36.38 33.99 3d2c s VAL 71 CO -0.02 0.00 -0.16 -1.81 -0.31 0.00 0.00 175.10 172.80 3d2c s ASP 72 N -3.75 3.90 -0.02 4.85 1.01 -0.13 -1.50 116.67 121.03 3d2c s ASP 72 Ca 0.35 -0.67 0.04 0.00 0.71 0.00 0.00 52.55 52.98 3d2c s ASP 72 Cb 0.09 -0.53 -0.01 0.00 1.01 0.00 0.00 42.92 43.48 3d2c s ASP 72 CO 0.18 0.13 -0.14 -0.63 0.21 0.00 0.00 175.17 174.92 3d2c s ILE 73 N -1.56 1.14 -0.22 0.77 1.01 0.32 -0.68 121.20 121.98 3d2c s ILE 73 Ca 0.22 -0.60 0.02 0.00 0.00 0.00 0.00 60.65 60.29 3d2c s ILE 73 Cb -0.09 -0.96 0.04 0.00 0.01 0.00 0.00 42.46 41.47 3d2c s ILE 73 CO 0.12 0.33 -0.14 -0.69 0.00 0.00 0.00 174.94 174.56 3d2c s VAL 74 N -0.22 2.02 0.05 2.92 1.01 -0.66 -0.63 120.40 124.88 3d2c s VAL 74 Ca 0.03 -1.28 0.09 0.00 0.00 0.00 0.00 61.98 60.83 3d2c s VAL 74 Cb -0.07 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 3d2c s VAL 74 CO -0.00 0.20 -0.26 0.00 0.00 0.00 0.00 175.10 175.04 3d2c s ALA 75 N 1.23 2.23 -0.06 5.51 0.00 -0.37 -0.66 121.76 129.63 3d2c s ALA 75 Ca -0.03 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 50.69 3d2c s ALA 75 Cb -0.17 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 3d2c s ALA 75 CO -0.08 0.53 -0.10 -1.58 0.00 0.00 0.00 175.76 174.52 3d2c s HIS 76 N -0.81 2.83 0.00 0.00 2.46 0.03 0.14 115.29 119.94 3d2c s HIS 76 Ca 0.12 -0.08 0.00 0.00 0.47 0.00 0.00 55.06 55.56 3d2c s HIS 76 Cb -0.10 -1.68 0.00 0.00 -0.13 0.00 0.00 32.58 30.67 3d2c s HIS 76 CO 0.02 0.24 0.00 0.45 -2.47 0.00 0.00 174.74 172.99 3d2c n SER 77 N 2.32 0.00 0.32 9.88 2.88 -0.05 0.01 113.62 128.99 3d2c n SER 77 Ca -0.18 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.57 3d2c n SER 77 Cb 0.53 0.00 1.09 0.00 -0.75 0.00 0.00 64.21 65.08 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 -0.34 114.93 113.12 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 0.01 -0.04 0.78 -0.40 0.00 0.00 176.91 177.26 3d2c h GLY 79 N 0.32 0.00 1.33 1.39 0.00 -0.44 -1.01 103.07 104.65 3d2c h GLY 79 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 3d2c h GLY 79 CO 0.00 0.00 -0.17 -1.33 0.00 0.00 0.00 176.54 175.04 3d2c h GLY 80 N 0.20 0.84 1.04 4.60 0.00 -1.24 -0.93 103.07 107.58 3d2c h GLY 80 Ca -0.00 -0.68 -0.13 0.00 0.00 0.00 0.00 47.33 46.52 3d2c h GLY 80 CO 0.01 0.63 -0.27 0.00 0.00 0.00 0.00 176.54 176.90 3d2c h ALA 81 N 1.11 0.53 -0.66 3.60 0.00 -1.33 -1.73 119.26 120.78 3d2c h ALA 81 Ca 0.11 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 3d2c h ALA 81 Cb 0.67 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3d2c h ALA 81 CO 0.05 0.55 0.19 -0.91 0.00 0.00 0.00 179.25 179.12 3d2c h ASN 82 N 0.64 0.97 -0.07 0.00 2.35 -1.26 -0.42 115.58 117.79 3d2c h ASN 82 Ca 0.07 -0.22 -0.00 0.00 -0.55 0.00 0.00 56.30 55.60 3d2c h ASN 82 Cb 0.84 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.95 3d2c h ASN 82 CO 0.07 0.94 0.04 0.74 -1.65 0.00 0.00 177.43 177.57 3d2c h THR 83 N 0.96 1.08 -0.47 2.81 2.02 -1.07 -0.12 112.91 118.13 3d2c h THR 83 Ca 0.21 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 3d2c h THR 83 Cb 0.32 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 3d2c h THR 83 CO -0.00 0.07 0.08 -0.07 0.37 0.00 0.00 175.52 175.97 3d2c h LEU 84 N 0.01 0.67 -0.03 2.58 3.38 -1.15 -1.05 115.31 119.72 3d2c h LEU 84 Ca 0.02 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3d2c h LEU 84 Cb 0.08 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3d2c h LEU 84 CO -0.00 0.69 0.01 0.22 0.09 0.00 0.00 178.44 179.44 3d2c h TYR 85 N 0.69 0.06 -0.96 1.13 3.20 -0.80 0.23 116.97 120.51 3d2c h TYR 85 Ca 0.15 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.09 3d2c h TYR 85 Cb 0.31 -0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.49 3d2c h TYR 85 CO 0.02 0.23 0.61 -0.92 -1.64 0.00 0.00 178.16 176.45 3d2c h TYR 86 N -0.13 1.13 0.12 -3.82 3.20 -0.72 0.28 116.97 117.03 3d2c h TYR 86 Ca 0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 3d2c h TYR 86 Cb 0.20 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 38.10 3d2c h TYR 86 CO -0.01 0.57 -0.06 0.82 -1.64 0.00 0.00 178.16 177.84 3d2c h ILE 87 N 1.10 0.97 -0.08 1.81 2.04 -1.01 -2.47 117.51 119.87 3d2c h ILE 87 Ca 0.42 -1.27 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 3d2c h ILE 87 Cb 0.20 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 3d2c h ILE 87 CO -0.18 0.26 -0.08 0.50 0.00 0.00 0.00 178.15 178.65 3d2c h LYS 88 N -0.85 0.20 -0.44 2.37 3.64 -0.45 -3.06 116.57 117.98 3d2c h LYS 88 Ca -0.02 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3d2c h LYS 88 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 3d2c h LYS 88 CO 0.03 0.62 0.00 0.66 -2.27 0.00 0.00 179.45 178.49 3d2c n TYR 89 N -4.70 1.00 -1.45 1.91 4.02 0.98 -4.98 117.16 113.94 3d2c n TYR 89 Ca -0.07 -0.65 0.00 0.00 -0.01 0.00 0.00 57.90 57.17 3d2c n TYR 89 Cb 0.31 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.43 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 0.46 0.00 -0.87 7.72 4.77 -0.98 -4.95 117.00 123.14 3d2c n LEU 90 Ca 0.20 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.27 3d2c n LEU 90 Cb 0.74 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 42.09 3d2c n LEU 90 CO 0.16 0.00 0.71 -0.90 -1.33 0.00 0.00 177.39 176.04 3d2c n ASP 91 N 0.00 2.57 0.04 -1.43 5.75 -1.22 -4.24 116.55 118.02 3d2c n ASP 91 Ca 0.00 -1.93 0.12 0.00 -0.01 0.00 0.00 54.79 52.98 3d2c n ASP 91 Cb 0.00 -0.26 0.50 0.00 -1.03 0.00 0.00 41.12 40.33 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 1.29 -1.44 0.55 6.12 0.00 -0.97 -3.99 105.19 106.75 3d2c n GLY 92 Ca 0.17 -0.05 0.37 0.00 0.00 0.00 0.00 46.02 46.51 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 4.17 0.05 -0.30 -0.02 0.00 -1.71 -1.63 103.07 103.63 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 -0.15 1.16 0.00 0.00 0.00 176.54 177.54 3d2c n ASN 94 N -4.17 1.52 0.00 0.19 6.94 -1.26 0.79 115.26 119.27 3d2c n ASN 94 Ca 0.28 -2.59 0.00 0.00 -0.02 0.00 0.00 54.58 52.25 3d2c n ASN 94 Cb 1.32 -0.31 0.00 0.00 -2.36 0.00 0.00 39.78 38.44 3d2c n ASN 94 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3d2c n LYS 95 N -0.87 0.93 -4.75 -3.83 5.02 -0.62 -4.88 118.16 109.16 3d2c n LYS 95 Ca 0.09 -0.97 -0.25 0.00 -2.02 0.00 0.00 58.31 55.16 3d2c n LYS 95 Cb 0.62 -0.99 -0.16 0.00 -0.02 0.00 0.00 35.03 34.48 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 -0.48 1.33 -0.17 -0.18 1.01 -1.17 -0.87 120.40 119.88 3d2c s VAL 96 Ca 0.00 -0.64 -0.14 0.00 0.00 0.00 0.00 61.98 61.20 3d2c s VAL 96 Cb 0.00 -1.16 -0.06 0.00 0.00 0.00 0.00 36.38 35.16 3d2c s VAL 96 CO 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 175.10 175.19 3d2c n ALA 97 N 3.36 1.26 -3.05 5.51 0.00 -0.56 -4.68 120.51 122.35 3d2c n ALA 97 Ca -0.19 -0.76 -0.32 0.00 0.00 0.00 0.00 53.44 52.16 3d2c n ALA 97 Cb 0.53 0.10 -0.17 0.00 0.00 0.00 0.00 19.45 19.91 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 -6.24 3.17 -0.07 0.00 0.01 -1.26 -1.71 114.94 108.84 3d2c s ASN 98 Ca -0.27 -0.52 0.05 0.00 -0.71 0.00 0.00 52.86 51.41 3d2c s ASN 98 Cb 0.06 -1.25 -0.00 0.00 0.41 0.00 0.00 41.25 40.47 3d2c s ASN 98 CO 0.38 0.19 -0.22 -0.69 -1.51 0.00 0.00 177.10 175.25 3d2c s VAL 99 N 0.17 1.88 -0.09 1.60 1.01 0.03 -0.52 120.40 124.47 3d2c s VAL 99 Ca -0.13 -0.94 -0.00 0.00 0.00 0.00 0.00 61.98 60.90 3d2c s VAL 99 Cb -0.16 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.63 3d2c s VAL 99 CO 0.07 0.52 -0.06 -0.69 0.00 0.00 0.00 175.10 174.95 3d2c s VAL 100 N 0.13 0.83 0.08 2.92 1.01 0.20 -1.15 120.40 124.41 3d2c s VAL 100 Ca -0.11 -0.19 0.05 0.00 0.00 0.00 0.00 61.98 61.74 3d2c s VAL 100 Cb -0.15 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 3d2c s VAL 100 CO 0.05 0.33 -0.03 0.42 0.00 0.00 0.00 175.10 175.87 3d2c s THR 101 N 1.60 3.85 -0.23 3.92 -4.23 -0.45 -1.23 115.64 118.86 3d2c s THR 101 Ca 0.02 -0.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.56 3d2c s THR 101 Cb -0.13 -2.80 0.05 0.00 1.34 0.00 0.00 72.50 70.96 3d2c s THR 101 CO -0.06 0.17 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.31 3d2c s LEU 102 N -2.12 2.98 -1.41 4.79 1.43 0.12 -0.69 118.68 123.77 3d2c s LEU 102 Ca 0.23 -1.17 -0.07 0.00 -1.03 0.00 0.00 54.13 52.09 3d2c s LEU 102 Cb -0.11 -1.47 0.04 0.00 0.03 0.00 0.00 46.19 44.67 3d2c s LEU 102 CO 0.15 -0.15 0.56 0.61 0.23 0.00 0.00 176.35 177.75 3d2c n GLY 103 N 4.52 -0.50 3.73 -3.19 0.00 0.37 -0.87 105.19 109.24 3d2c n GLY 103 Ca -0.15 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.72 2.00 -0.87 -0.02 0.00 -1.26 -3.31 107.32 101.14 3d2c s GLY 104 Ca 0.36 1.34 -0.05 0.00 0.00 0.00 0.00 44.72 46.36 3d2c s GLY 104 CO 0.44 2.43 2.63 0.00 0.00 0.00 0.00 173.10 178.59 3d2c n ALA 105 N 3.06 6.65 -0.35 3.20 0.00 -0.29 -2.88 120.51 129.90 3d2c n ALA 105 Ca 0.10 -3.50 -0.01 0.00 0.00 0.00 0.00 53.44 50.02 3d2c n ALA 105 Cb 0.40 -2.47 0.12 0.00 0.00 0.00 0.00 19.45 17.49 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 3.79 1.04 0.00 0.00 2.35 -1.71 -2.80 115.58 118.25 3d2c h ASN 106 Ca 0.54 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.28 3d2c h ASN 106 Cb 0.54 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.67 3d2c h ASN 106 CO 1.15 0.73 0.00 0.54 -1.65 0.00 0.00 177.43 178.20 3d2c n ARG 107 N -4.47 0.28 0.00 0.81 1.74 -0.43 -0.98 116.66 113.60 3d2c n ARG 107 Ca 0.12 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.33 3d2c n ARG 107 Cb 0.07 -1.24 0.46 0.00 -1.02 0.00 0.00 32.46 30.74 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 -0.74 0.50 0.00 0.55 4.77 -1.06 -4.14 117.00 116.89 3d2c n LEU 108 Ca 0.03 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3d2c n LEU 108 Cb 0.01 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 3d2c n LEU 108 CO 0.02 0.10 -0.48 0.41 -1.33 0.00 0.00 177.39 176.12 3d2c n THR 109 N -1.15 0.00 -3.60 -5.08 -1.04 -0.16 -5.08 114.28 98.17 3d2c n THR 109 Ca 0.10 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.06 3d2c n THR 109 Cb 0.32 -0.64 -0.02 0.00 -1.82 0.00 0.00 70.33 68.17 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 -1.96 0.00 -0.58 12.58 -1.32 -0.96 -4.98 115.64 118.41 3d2c s THR 110 Ca 0.00 -0.18 0.19 0.00 -1.21 0.00 0.00 61.69 60.49 3d2c s THR 110 Cb 0.00 -1.37 -0.24 0.00 -1.51 0.00 0.00 72.50 69.38 3d2c s THR 110 CO 0.00 0.00 0.67 0.47 -2.21 0.00 0.00 174.62 173.55 3d2c n ASP 111 N -0.29 0.77 -4.36 8.08 8.00 -1.26 -3.51 116.55 123.98 3d2c n ASP 111 Ca -0.06 -0.61 -0.31 0.00 0.71 0.00 0.00 54.79 54.52 3d2c n ASP 111 Cb 0.61 1.31 -0.15 0.00 -0.02 0.00 0.00 41.12 42.87 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 -2.98 2.09 -0.15 -1.24 1.02 -1.26 0.57 119.74 117.79 3d2c s LYS 112 Ca 0.02 -0.94 -0.29 0.00 0.02 0.00 0.00 55.97 54.78 3d2c s LYS 112 Cb 0.14 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 35.29 3d2c s LYS 112 CO 0.78 0.56 1.96 0.00 -0.92 0.00 0.00 175.35 177.73 3d2c s ALA 113 N -0.72 3.13 0.10 5.17 0.00 -0.01 -4.86 121.76 124.57 3d2c s ALA 113 Ca 0.11 0.83 -0.31 0.00 0.00 0.00 0.00 51.96 52.60 3d2c s ALA 113 Cb -0.10 -3.94 -0.09 0.00 0.00 0.00 0.00 23.12 18.98 3d2c s ALA 113 CO 0.01 -2.20 1.72 -2.14 0.00 0.00 0.00 175.76 173.15 3d2c s PRO 114 N 5.30 4.17 0.42 0.00 0.02 -1.26 -4.87 135.00 138.78 3d2c s PRO 114 Ca 0.88 2.45 0.16 0.00 0.02 0.00 0.00 61.00 64.51 3d2c s PRO 114 Cb -0.33 -3.57 0.91 0.00 0.02 0.00 0.00 34.50 31.54 3d2c s PRO 114 CO 0.35 -0.77 1.90 -1.35 -0.33 0.00 0.00 177.00 176.80 3d2c h PRO 115 N 8.34 0.00 0.00 5.54 0.11 -1.91 -3.41 132.00 140.67 3d2c h PRO 115 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3d2c h PRO 115 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3d2c h PRO 115 CO 0.94 0.28 0.00 0.41 -0.21 0.00 0.00 178.00 179.42 3d2c n GLY 116 N -0.59 -2.52 1.44 -0.55 0.00 -1.26 -1.46 105.19 100.24 3d2c n GLY 116 Ca -0.02 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.29 2.56 -3.85 2.61 -2.24 0.24 -4.95 114.28 108.36 3d2c n THR 117 Ca 0.00 -3.42 -0.36 0.00 -2.27 0.00 0.00 64.05 58.00 3d2c n THR 117 Cb 0.00 -0.67 -0.13 0.00 -2.10 0.00 0.00 70.33 67.43 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 -3.03 4.91 0.26 3.42 -1.08 -1.26 -4.79 116.67 115.10 3d2c s ASP 118 Ca 0.47 -1.01 -0.02 0.00 -0.52 0.00 0.00 52.55 51.47 3d2c s ASP 118 Cb 0.41 -1.78 0.45 0.00 -1.46 0.00 0.00 42.92 40.55 3d2c s ASP 118 CO -0.01 -0.23 1.83 -0.65 0.52 0.00 0.00 175.17 176.63 3d2c h PRO 119 N 8.11 0.88 -0.00 4.34 0.11 -1.97 -2.67 132.00 140.80 3d2c h PRO 119 Ca -0.27 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 65.62 3d2c h PRO 119 Cb 1.09 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.98 3d2c h PRO 119 CO 0.58 0.58 -0.81 -0.91 -0.21 0.00 0.00 178.00 177.23 3d2c h ASN 120 N 0.91 0.06 -3.52 -2.05 2.35 -2.02 -3.45 115.58 107.86 3d2c h ASN 120 Ca 0.44 -0.05 -0.27 0.00 -0.55 0.00 0.00 56.30 55.87 3d2c h ASN 120 Cb 0.39 -0.02 -0.32 0.00 0.05 0.00 0.00 38.32 38.42 3d2c h ASN 120 CO -0.25 0.84 -0.67 -1.10 -1.65 0.00 0.00 177.43 174.60 3d2c s GLN 121 N -3.22 0.02 -0.04 0.81 -1.52 -1.01 -5.14 119.66 109.57 3d2c s GLN 121 Ca -0.01 0.24 -0.14 0.00 -1.95 0.00 0.00 55.36 53.50 3d2c s GLN 121 Cb 0.11 -0.19 -0.05 0.00 -0.22 0.00 0.00 33.01 32.66 3d2c s GLN 121 CO 0.80 -0.15 0.38 0.21 -0.25 0.00 0.00 175.29 176.28 3d2c s LYS 122 N 0.97 3.95 0.27 2.91 2.20 -1.26 -4.12 119.74 124.66 3d2c s LYS 122 Ca -0.08 0.34 -0.31 0.00 -0.36 0.00 0.00 55.97 55.56 3d2c s LYS 122 Cb -0.11 -3.26 -0.12 0.00 -1.51 0.00 0.00 37.83 32.83 3d2c s LYS 122 CO -0.04 0.60 1.61 -0.89 -0.36 0.00 0.00 175.35 176.27 3d2c n ILE 123 N 2.20 0.76 -4.10 5.43 5.41 -0.54 -4.97 119.36 123.55 3d2c n ILE 123 Ca -0.14 -0.19 -0.35 0.00 1.00 0.00 0.00 62.75 63.07 3d2c n ILE 123 Cb 0.52 -1.92 -0.09 0.00 -0.71 0.00 0.00 39.64 37.45 3d2c n ILE 123 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3d2c s LEU 124 N -0.03 3.88 0.10 1.39 1.43 -0.69 -4.64 118.68 120.11 3d2c s LEU 124 Ca 0.67 0.20 0.10 0.00 -1.03 0.00 0.00 54.13 54.08 3d2c s LEU 124 Cb -0.52 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 3d2c s LEU 124 CO 0.45 0.31 -0.26 -0.31 0.23 0.00 0.00 176.35 176.76 3d2c s TYR 125 N -0.43 2.32 -0.13 0.29 1.51 0.17 -0.79 117.35 120.29 3d2c s TYR 125 Ca 0.10 -0.39 -0.03 0.00 -1.01 0.00 0.00 57.07 55.73 3d2c s TYR 125 Cb -0.12 -1.31 0.05 0.00 -0.11 0.00 0.00 41.96 40.47 3d2c s TYR 125 CO 0.02 0.26 0.06 0.99 -1.11 0.00 0.00 175.55 175.77 3d2c s THR 126 N -0.96 0.09 -0.31 -0.71 2.01 -0.30 -0.99 115.64 114.47 3d2c s THR 126 Ca 0.13 -0.07 -0.08 0.00 0.31 0.00 0.00 61.69 61.98 3d2c s THR 126 Cb -0.10 -0.56 0.00 0.00 0.01 0.00 0.00 72.50 71.85 3d2c s THR 126 CO 0.05 -0.09 0.12 -0.55 -0.69 0.00 0.00 174.62 173.45 3d2c s SER 127 N 2.07 5.35 -0.15 3.53 0.15 0.51 -1.34 113.70 123.82 3d2c s SER 127 Ca 0.02 -0.64 -0.06 0.00 0.70 0.00 0.00 55.95 55.97 3d2c s SER 127 Cb -0.15 -1.94 -0.04 0.00 -1.71 0.00 0.00 66.02 62.18 3d2c s SER 127 CO -0.07 -0.20 0.05 -0.63 1.20 0.00 0.00 173.24 173.58 3d2c s ILE 128 N 1.55 4.68 0.01 6.45 1.01 0.13 -1.12 121.20 133.92 3d2c s ILE 128 Ca 0.03 -0.08 -0.17 0.00 0.00 0.00 0.00 60.65 60.43 3d2c s ILE 128 Cb -0.17 -3.07 0.03 0.00 0.01 0.00 0.00 42.46 39.26 3d2c s ILE 128 CO 0.04 0.51 0.36 -0.72 0.00 0.00 0.00 174.94 175.14 3d2c s TYR 129 N -0.07 -0.22 -0.13 3.97 -0.85 -0.86 -0.48 117.35 118.71 3d2c s TYR 129 Ca 0.06 0.25 -0.05 0.00 -0.52 0.00 0.00 57.07 56.81 3d2c s TYR 129 Cb -0.12 0.15 -0.04 0.00 0.38 0.00 0.00 41.96 42.33 3d2c s TYR 129 CO 0.01 -0.48 0.04 0.45 -1.52 0.00 0.00 175.55 174.04 3d2c s SER 130 N -1.68 5.46 0.26 -0.18 0.15 -1.26 -1.15 113.70 115.30 3d2c s SER 130 Ca -0.09 0.13 0.21 0.00 0.70 0.00 0.00 55.95 56.90 3d2c s SER 130 Cb -0.03 -1.77 0.99 0.00 -1.71 0.00 0.00 66.02 63.51 3d2c s SER 130 CO 0.01 0.28 1.65 -1.54 1.20 0.00 0.00 173.24 174.85 3d2c n SER 131 N 2.81 0.57 -1.38 5.45 3.41 -0.68 -1.55 113.62 122.25 3d2c n SER 131 Ca -0.18 0.69 -0.01 0.00 -0.26 0.00 0.00 58.87 59.11 3d2c n SER 131 Cb 0.53 -0.79 0.26 0.00 -0.26 0.00 0.00 64.21 63.95 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 -2.18 3.83 -4.64 4.04 8.00 -1.26 -4.94 116.55 119.40 3d2c n ASP 132 Ca 0.01 -3.31 -0.42 0.00 0.71 0.00 0.00 54.79 51.78 3d2c n ASP 132 Cb 0.15 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.57 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 -1.78 6.87 0.00 -2.24 -1.08 -0.59 -4.45 116.67 113.40 3d2c s ASP 133 Ca 0.48 1.03 0.28 0.00 -0.52 0.00 0.00 52.55 53.81 3d2c s ASP 133 Cb 0.40 -2.48 0.95 0.00 -1.46 0.00 0.00 42.92 40.33 3d2c s ASP 133 CO 0.08 -0.66 1.69 0.23 0.52 0.00 0.00 175.17 177.03 3d2c n MET 134 N 6.32 1.66 -0.08 4.34 2.81 -1.26 -4.46 117.12 126.45 3d2c n MET 134 Ca 0.08 -1.01 -0.17 0.00 -1.81 0.00 0.00 57.70 54.78 3d2c n MET 134 Cb 0.47 -1.48 -0.06 0.00 -0.71 0.00 0.00 33.22 31.44 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 0.21 0.89 -3.92 2.02 2.08 -1.26 -4.97 119.36 114.41 3d2c n ILE 135 Ca 0.18 -0.23 -0.35 0.00 0.56 0.00 0.00 62.75 62.91 3d2c n ILE 135 Cb 0.38 -1.70 -0.14 0.00 -0.75 0.00 0.00 39.64 37.43 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 -2.30 3.18 0.47 1.39 1.01 -1.26 -5.08 120.40 117.80 3d2c s VAL 136 Ca -0.23 -0.72 -0.24 0.00 0.00 0.00 0.00 61.98 60.80 3d2c s VAL 136 Cb 0.09 -2.51 -0.08 0.00 0.00 0.00 0.00 36.38 33.87 3d2c s VAL 136 CO 0.29 0.32 1.26 0.23 0.00 0.00 0.00 175.10 177.20 3d2c n MET 137 N 4.75 1.77 0.24 2.72 2.81 -1.26 -4.82 117.12 123.33 3d2c n MET 137 Ca -0.17 0.64 0.08 0.00 -1.81 0.00 0.00 57.70 56.43 3d2c n MET 137 Cb 0.49 -2.41 0.59 0.00 -0.71 0.00 0.00 33.22 31.18 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 1.77 0.00 -0.81 7.83 -0.26 -1.91 -2.08 115.58 120.11 3d2c h ASN 138 Ca -0.49 0.00 0.13 0.00 -0.56 0.00 0.00 56.30 55.38 3d2c h ASN 138 Cb 1.30 0.00 -0.09 0.00 -1.06 0.00 0.00 38.32 38.48 3d2c h ASN 138 CO 0.58 0.16 0.42 0.22 -1.06 0.00 0.00 177.43 177.75 3d2c h TYR 139 N 0.00 0.74 0.00 1.19 3.20 -1.95 -0.26 116.97 119.89 3d2c h TYR 139 Ca -0.00 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 3d2c h TYR 139 Cb 0.31 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 3d2c h TYR 139 CO 0.00 0.21 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.34 3d2c h LEU 140 N 0.64 0.00 0.13 2.82 3.38 -1.69 -3.27 115.31 117.32 3d2c h LEU 140 Ca 0.43 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.12 3d2c h LEU 140 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3d2c h LEU 140 CO -0.33 0.33 -1.28 0.28 0.09 0.00 0.00 178.44 177.53 3d2c h SER 141 N 0.00 0.42 -2.61 -0.43 0.02 -0.96 -1.05 113.55 108.94 3d2c h SER 141 Ca -0.00 -0.46 -0.53 0.00 -0.84 0.00 0.00 61.79 59.96 3d2c h SER 141 Cb 1.00 -0.14 0.03 0.00 0.14 0.00 0.00 62.40 63.43 3d2c h SER 141 CO 0.04 1.36 1.06 -0.13 -1.14 0.00 0.00 176.83 178.02 3d2c s ARG 142 N -2.65 4.17 -0.18 3.45 0.52 -0.39 -4.79 118.95 119.08 3d2c s ARG 142 Ca -0.04 2.46 -0.02 0.00 -0.52 0.00 0.00 55.73 57.60 3d2c s ARG 142 Cb 0.07 -3.62 -0.01 0.00 0.52 0.00 0.00 34.95 31.91 3d2c s ARG 142 CO 0.88 -0.79 -0.09 -0.51 0.02 0.00 0.00 175.30 174.81 3d2c s LEU 143 N 2.77 2.78 0.11 2.53 1.43 -1.26 -4.84 118.68 122.20 3d2c s LEU 143 Ca 0.77 -0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 53.19 3d2c s LEU 143 Cb -0.42 -1.67 -0.09 0.00 0.03 0.00 0.00 46.19 44.03 3d2c s LEU 143 CO 0.34 0.07 1.65 -1.81 0.23 0.00 0.00 176.35 176.83 3d2c s ASP 144 N 0.96 6.56 0.00 2.29 1.01 0.19 -1.87 116.67 125.81 3d2c s ASP 144 Ca -0.01 2.59 0.00 0.00 0.71 0.00 0.00 52.55 55.83 3d2c s ASP 144 Cb -0.15 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.21 3d2c s ASP 144 CO -0.00 -0.89 0.00 0.61 0.21 0.00 0.00 175.17 175.10 3d2c n GLY 145 N 3.95 1.22 3.99 0.21 0.00 -1.26 -0.83 105.19 112.47 3d2c n GLY 145 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.29 4.26 -0.48 4.61 0.00 -0.78 -0.57 121.76 126.52 3d2c s ALA 146 Ca 0.00 -1.48 -0.27 0.00 0.00 0.00 0.00 51.96 50.22 3d2c s ALA 146 Cb 0.00 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.43 3d2c s ALA 146 CO 0.00 -0.14 1.01 0.50 0.00 0.00 0.00 175.76 177.12 3d2c s ARG 147 N -4.27 3.58 -0.31 0.00 3.52 -0.67 -4.88 118.95 115.92 3d2c s ARG 147 Ca 0.48 0.28 -0.12 0.00 -0.13 0.00 0.00 55.73 56.24 3d2c s ARG 147 Cb -0.10 -3.93 -0.03 0.00 -1.56 0.00 0.00 34.95 29.33 3d2c s ARG 147 CO 0.32 -1.31 0.21 -0.80 -0.81 0.00 0.00 175.30 172.91 3d2c s ASN 148 N 2.38 5.96 -0.19 -2.12 0.01 -1.26 -0.36 114.94 119.36 3d2c s ASN 148 Ca 0.41 -0.26 -0.01 0.00 -0.71 0.00 0.00 52.86 52.29 3d2c s ASN 148 Cb -0.09 -2.11 0.01 0.00 0.41 0.00 0.00 41.25 39.47 3d2c s ASN 148 CO 0.28 -0.15 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.89 3d2c s VAL 149 N 1.72 2.57 -0.17 1.60 1.01 -0.27 -4.98 120.40 121.88 3d2c s VAL 149 Ca 0.06 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 3d2c s VAL 149 Cb -0.17 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 3d2c s VAL 149 CO 0.10 0.50 0.09 -1.58 0.00 0.00 0.00 175.10 174.21 3d2c s GLN 150 N 1.27 3.92 0.52 2.72 0.74 -1.26 -2.03 119.66 125.55 3d2c s GLN 150 Ca 0.04 -0.28 0.00 0.00 0.05 0.00 0.00 55.36 55.17 3d2c s GLN 150 Cb -0.14 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.72 3d2c s GLN 150 CO -0.08 0.38 0.00 0.44 -0.55 0.00 0.00 175.29 175.49 3d2c n ILE 151 N 3.23 0.00 -4.10 -2.34 -5.35 -0.30 -4.98 119.36 105.51 3d2c n ILE 151 Ca -0.17 -2.45 -0.07 0.00 -0.27 0.00 0.00 62.75 59.78 3d2c n ILE 151 Cb 0.53 0.49 -0.10 0.00 -1.74 0.00 0.00 39.64 38.81 3d2c n ILE 151 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3d2c s HIS 152 N -2.87 0.56 -0.07 4.28 3.76 -1.26 -1.69 115.29 117.99 3d2c s HIS 152 Ca 0.00 -1.08 0.00 0.00 -0.15 0.00 0.00 55.06 53.83 3d2c s HIS 152 Cb -0.00 -0.40 0.00 0.00 1.11 0.00 0.00 32.58 33.29 3d2c s HIS 152 CO 0.00 -0.39 0.00 0.41 -0.85 0.00 0.00 174.74 173.92 3d2c n GLY 153 N 0.09 0.45 3.21 -2.22 0.00 -1.26 -4.98 105.19 100.48 3d2c n GLY 153 Ca -0.13 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 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 2.05 0.82 1.61 1.01 -1.26 -5.07 120.40 117.70 3d2c s VAL 154 Ca 0.00 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 3d2c s VAL 154 Cb 0.00 -1.78 0.09 0.00 0.00 0.00 0.00 36.38 34.69 3d2c s VAL 154 CO 0.00 0.56 1.17 -0.83 0.00 0.00 0.00 175.10 175.99 3d2c s GLY 155 N 0.42 1.59 0.18 4.51 0.00 -1.26 -4.03 107.32 108.72 3d2c s GLY 155 Ca -0.17 -0.61 -0.18 0.00 0.00 0.00 0.00 44.72 43.76 3d2c s GLY 155 CO 0.07 -0.11 1.63 0.84 0.00 0.00 0.00 173.10 175.53 3d2c h HIS 156 N -1.12 -0.48 0.00 1.90 2.76 -1.93 -1.60 115.15 114.68 3d2c h HIS 156 Ca -0.47 0.05 -0.16 0.00 -2.20 0.00 0.00 60.37 57.59 3d2c h HIS 156 Cb 1.33 0.28 -0.02 0.00 1.55 0.00 0.00 27.41 30.54 3d2c h HIS 156 CO 0.32 -0.28 -0.78 0.52 -1.30 0.00 0.00 177.93 176.41 3d2c h MET 157 N -0.11 0.00 -0.13 5.26 2.86 -2.00 -3.21 114.93 117.60 3d2c h MET 157 Ca 0.21 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.89 3d2c h MET 157 Cb 0.43 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 3d2c h MET 157 CO -0.50 0.78 0.20 0.78 1.06 0.00 0.00 176.91 179.23 3d2c h GLY 158 N 2.98 0.00 1.61 8.32 0.00 -1.66 -1.05 103.07 113.27 3d2c h GLY 158 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.38 3d2c h GLY 158 CO 0.10 0.00 0.14 1.41 0.00 0.00 0.00 176.54 178.19 3d2c h LEU 159 N 0.00 0.00 -0.01 3.11 3.38 -1.45 -1.40 115.31 118.94 3d2c h LEU 159 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3d2c h LEU 159 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3d2c h LEU 159 CO -0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 3d2c n LEU 160 N -4.44 0.04 -0.02 1.67 4.77 -0.40 -3.59 117.00 115.03 3d2c n LEU 160 Ca 0.02 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 3d2c n LEU 160 Cb 0.28 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 40.88 3d2c n LEU 160 CO 0.35 -0.09 0.37 -1.22 -1.33 0.00 0.00 177.39 175.46 3d2c n TYR 161 N -1.54 0.00 -2.81 -1.77 4.01 -0.60 -4.19 117.16 110.26 3d2c n TYR 161 Ca 0.06 -0.25 -0.42 0.00 -0.16 0.00 0.00 57.90 57.13 3d2c n TYR 161 Cb 0.29 -0.03 -0.03 0.00 -0.31 0.00 0.00 39.34 39.26 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 -0.58 7.04 0.28 7.72 0.15 -0.75 -4.94 113.70 122.61 3d2c s SER 162 Ca 0.01 1.28 0.01 0.00 0.70 0.00 0.00 55.95 57.95 3d2c s SER 162 Cb 0.01 -2.49 0.56 0.00 -1.71 0.00 0.00 66.02 62.39 3d2c s SER 162 CO 0.00 -0.46 1.82 0.28 1.20 0.00 0.00 173.24 176.08 3d2c h SER 163 N 7.32 0.85 -0.20 5.45 0.02 -1.93 0.23 113.55 125.28 3d2c h SER 163 Ca -0.27 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 60.77 3d2c h SER 163 Cb 1.12 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.51 3d2c h SER 163 CO 0.87 0.43 -0.05 1.56 -1.14 0.00 0.00 176.83 178.49 3d2c h GLN 164 N 0.91 -0.01 -0.53 3.45 4.20 -1.98 -2.11 115.11 119.05 3d2c h GLN 164 Ca 0.49 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.17 3d2c h GLN 164 Cb 0.54 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 3d2c h GLN 164 CO -0.29 -0.00 0.18 0.28 -0.67 0.00 0.00 178.83 178.33 3d2c h VAL 165 N -0.01 1.23 -0.49 -0.54 2.07 -1.20 -2.71 116.25 114.60 3d2c h VAL 165 Ca 0.10 -0.74 0.09 0.00 0.82 0.00 0.00 66.70 66.97 3d2c h VAL 165 Cb 0.16 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 30.57 3d2c h VAL 165 CO -0.21 0.28 0.06 1.88 0.02 0.00 0.00 177.57 179.59 3d2c h TYR 166 N 0.72 0.07 -0.58 1.57 -1.99 -0.28 0.18 116.97 116.66 3d2c h TYR 166 Ca 0.17 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.89 3d2c h TYR 166 Cb 0.25 0.04 -0.03 0.00 2.00 0.00 0.00 36.73 38.99 3d2c h TYR 166 CO 0.01 -0.06 0.20 0.77 -0.00 0.00 0.00 178.16 179.08 3d2c h SER 167 N 0.18 0.79 -0.03 3.88 0.02 -1.24 -0.85 113.55 116.30 3d2c h SER 167 Ca 0.25 -0.12 -0.16 0.00 -0.84 0.00 0.00 61.79 60.92 3d2c h SER 167 Cb 0.36 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 3d2c h SER 167 CO -0.36 0.74 -0.52 -0.07 -1.14 0.00 0.00 176.83 175.48 3d2c h LEU 168 N 0.84 0.66 -0.37 5.07 3.38 -0.97 -2.21 115.31 121.71 3d2c h LEU 168 Ca 0.19 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 3d2c h LEU 168 Cb 0.22 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3d2c h LEU 168 CO -0.01 1.05 0.10 0.40 0.09 0.00 0.00 178.44 180.07 3d2c h ILE 169 N 0.47 1.22 -0.49 1.22 2.04 -0.18 -1.29 117.51 120.50 3d2c h ILE 169 Ca 0.02 -0.74 0.05 0.00 1.00 0.00 0.00 64.86 65.19 3d2c h ILE 169 Cb 1.06 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 38.09 3d2c h ILE 169 CO 0.10 0.25 0.22 0.50 0.00 0.00 0.00 178.15 179.22 3d2c h LYS 170 N 0.45 0.42 -0.48 2.37 3.64 -1.06 0.16 116.57 122.06 3d2c h LYS 170 Ca 0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3d2c h LYS 170 Cb 0.29 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 3d2c h LYS 170 CO -0.00 0.28 0.32 0.93 -2.27 0.00 0.00 179.45 178.70 3d2c h GLU 171 N 0.43 0.64 -0.47 1.90 5.08 -1.13 -0.90 114.58 120.13 3d2c h GLU 171 Ca 0.22 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.50 3d2c h GLU 171 Cb 0.17 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3d2c h GLU 171 CO -0.18 0.43 0.14 0.78 -1.00 0.00 0.00 179.01 179.17 3d2c h GLY 172 N 0.65 0.80 2.00 -3.84 0.00 -0.67 0.31 103.07 102.32 3d2c h GLY 172 Ca 0.18 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 3d2c h GLY 172 CO -0.04 0.45 -0.12 1.41 0.00 0.00 0.00 176.54 178.24 3d2c h LEU 173 N 0.63 0.00 -2.64 3.11 3.38 -0.77 -1.45 115.31 117.58 3d2c h LEU 173 Ca 0.15 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.03 3d2c h LEU 173 Cb 0.29 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 3d2c h LEU 173 CO -0.00 0.12 0.11 0.59 0.09 0.00 0.00 178.44 179.36 3d2c n ASN 174 N -3.45 3.57 0.00 -0.43 3.02 -0.36 -4.86 115.26 112.75 3d2c n ASN 174 Ca -0.01 -2.64 0.00 0.00 -0.03 0.00 0.00 54.58 51.90 3d2c n ASN 174 Cb 0.29 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 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 0.11 0.51 0.00 7.41 0.00 -0.55 -4.94 105.19 107.74 3d2c n GLY 175 Ca 0.21 -0.51 0.10 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.86 -0.80 0.77 -0.02 0.00 0.10 -4.85 105.19 97.52 3d2c n GLY 176 Ca 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 46.02 45.83 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 0.55 -2.52 3.37 -0.02 0.00 -1.26 -4.82 105.19 100.48 3d2c n GLY 177 Ca 0.15 -1.46 -0.10 0.00 0.00 0.00 0.00 46.02 44.61 3d2c n GLY 177 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d2c s GLN 178 N -3.55 1.16 -0.41 1.61 -0.21 -0.16 -4.77 119.66 113.33 3d2c s GLN 178 Ca 0.16 -0.71 0.02 0.00 0.02 0.00 0.00 55.36 54.85 3d2c s GLN 178 Cb -0.02 0.50 0.19 0.00 1.00 0.00 0.00 33.01 34.68 3d2c s GLN 178 CO 0.12 -0.47 0.82 1.21 -2.12 0.00 0.00 175.29 174.85 3d2c s ASN 179 N -2.81 -1.07 -0.22 5.90 3.84 -0.79 -0.65 114.94 119.14 3d2c s ASN 179 Ca 0.04 -0.85 -0.00 0.00 0.21 0.00 0.00 52.86 52.26 3d2c s ASN 179 Cb 0.01 1.38 0.18 0.00 -0.55 0.00 0.00 41.25 42.27 3d2c s ASN 179 CO -0.10 -0.08 1.86 0.35 -2.79 0.00 0.00 177.10 176.33 3d2c n THR 180 N 3.58 2.40 0.19 -5.21 -2.24 0.27 -5.00 114.28 108.26 3d2c n THR 180 Ca 0.12 -1.21 0.02 0.00 -2.27 0.00 0.00 64.05 60.71 3d2c n THR 180 Cb 0.59 -1.25 0.02 0.00 -2.10 0.00 0.00 70.33 67.59 3d2c n THR 180 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09