#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 5.16 0.60 0.41 0.01 -1.26 -4.97 114.94 114.89 3d2c s ASN 4 Ca 0.00 1.68 -0.19 0.00 -0.71 0.00 0.00 52.86 53.64 3d2c s ASN 4 Cb 0.00 -2.50 -0.03 0.00 0.41 0.00 0.00 41.25 39.12 3d2c s ASN 4 CO 0.00 -1.59 1.27 -2.84 -1.51 0.00 0.00 177.10 172.43 3d2c s PRO 5 N -4.96 2.89 -0.15 -0.60 0.02 -1.26 -4.66 135.00 126.28 3d2c s PRO 5 Ca 0.59 1.99 -0.03 0.00 0.02 0.00 0.00 61.00 63.58 3d2c s PRO 5 Cb -0.15 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.36 3d2c s PRO 5 CO 0.54 -1.32 -0.06 0.08 -0.33 0.00 0.00 177.00 175.92 3d2c s VAL 6 N -1.46 3.66 -0.19 3.83 1.01 0.19 -1.41 120.40 126.04 3d2c s VAL 6 Ca 0.78 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 62.28 3d2c s VAL 6 Cb -0.35 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 3d2c s VAL 6 CO 0.38 0.50 -0.05 -0.69 0.00 0.00 0.00 175.10 175.24 3d2c s VAL 7 N 0.43 3.53 -0.18 2.92 1.01 -0.39 0.10 120.40 127.82 3d2c s VAL 7 Ca -0.05 -0.46 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 3d2c s VAL 7 Cb -0.15 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 3d2c s VAL 7 CO 0.03 0.45 -0.01 -0.04 0.00 0.00 0.00 175.10 175.53 3d2c s MET 8 N 0.99 3.67 -0.27 2.72 -1.94 0.23 -1.78 119.30 122.91 3d2c s MET 8 Ca 0.00 -0.51 -0.04 0.00 -1.71 0.00 0.00 55.69 53.43 3d2c s MET 8 Cb -0.15 -3.01 0.02 0.00 2.01 0.00 0.00 34.83 33.70 3d2c s MET 8 CO 0.01 0.14 0.02 0.08 -0.01 0.00 0.00 175.02 175.25 3d2c s VAL 9 N 0.66 3.45 0.89 -6.03 1.01 -0.32 -1.59 120.40 118.47 3d2c s VAL 9 Ca -0.01 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 60.97 3d2c s VAL 9 Cb -0.14 -2.78 0.14 0.00 0.00 0.00 0.00 36.38 33.60 3d2c s VAL 9 CO 0.02 0.12 1.23 -1.38 0.00 0.00 0.00 175.10 175.09 3d2c s HIS 10 N 1.41 2.33 0.00 5.22 -3.43 -1.26 -0.90 115.29 118.66 3d2c s HIS 10 Ca 0.01 0.59 0.00 0.00 -0.80 0.00 0.00 55.06 54.87 3d2c s HIS 10 Cb -0.17 -3.72 0.00 0.00 -1.43 0.00 0.00 32.58 27.26 3d2c s HIS 10 CO -0.01 -2.23 0.00 0.41 -2.00 0.00 0.00 174.74 170.91 3d2c n GLY 11 N -3.29 3.59 3.73 -1.38 0.00 -1.18 -3.28 105.19 103.37 3d2c n GLY 11 Ca 0.11 -2.00 -0.42 0.00 0.00 0.00 0.00 46.02 43.70 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 0.40 -1.13 -0.61 5.41 -1.26 -1.23 119.36 120.94 3d2c n ILE 12 Ca 0.00 -0.10 -0.04 0.00 1.00 0.00 0.00 62.75 63.61 3d2c n ILE 12 Cb 0.00 -1.97 -0.02 0.00 -0.71 0.00 0.00 39.64 36.94 3d2c n ILE 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3d2c n GLY 13 N 3.26 0.53 3.97 7.39 0.00 -0.05 -4.96 105.19 115.33 3d2c n GLY 13 Ca 0.13 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 3d2c n GLY 13 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d2c s GLY 14 N -2.23 1.78 0.10 -0.02 0.00 -0.37 -5.12 107.32 101.47 3d2c s GLY 14 Ca 0.00 -1.61 -0.19 0.00 0.00 0.00 0.00 44.72 42.92 3d2c s GLY 14 CO 0.00 -0.88 0.47 -0.45 0.00 0.00 0.00 173.10 172.24 3d2c s SER 15 N -4.89 -0.36 0.65 1.64 0.15 -1.26 -4.90 113.70 104.74 3d2c s SER 15 Ca 0.72 -0.09 0.42 0.00 0.70 0.00 0.00 55.95 57.70 3d2c s SER 15 Cb -0.03 0.50 2.31 0.00 -1.71 0.00 0.00 66.02 67.08 3d2c s SER 15 CO 0.50 -0.82 2.34 0.77 1.20 0.00 0.00 173.24 177.23 3d2c h SER 16 N 2.47 0.00 0.56 5.45 4.64 -1.88 0.14 113.55 124.93 3d2c h SER 16 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3d2c h SER 16 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3d2c h SER 16 CO 0.43 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.85 3d2c n SER 17 N -3.22 0.00 0.21 4.97 3.41 -1.26 -2.69 113.62 115.04 3d2c n SER 17 Ca -0.03 0.25 0.05 0.00 -0.26 0.00 0.00 58.87 58.89 3d2c n SER 17 Cb 0.08 -0.40 0.46 0.00 -0.26 0.00 0.00 64.21 64.10 3d2c n SER 17 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3d2c h ASN 18 N 0.00 0.00 -0.45 4.04 2.35 -1.13 -3.04 115.58 117.34 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 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3d2c h ASN 18 CO 0.00 0.27 0.00 0.49 -1.65 0.00 0.00 177.43 176.54 3d2c n PHE 19 N -4.06 1.41 -0.24 1.19 3.72 -1.09 -4.43 117.46 113.95 3d2c n PHE 19 Ca -0.02 -0.51 -0.06 0.00 -0.05 0.00 0.00 57.45 56.81 3d2c n PHE 19 Cb 0.33 -0.34 0.05 0.00 -0.94 0.00 0.00 39.48 38.58 3d2c n PHE 19 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 3d2c h GLU 20 N 3.02 0.96 -0.46 -1.08 4.57 -1.72 -0.52 114.58 119.35 3d2c h GLU 20 Ca 0.00 -0.12 -0.12 0.00 -1.18 0.00 0.00 59.36 57.94 3d2c h GLU 20 Cb 1.45 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.85 3d2c h GLU 20 CO 0.30 0.73 -0.18 0.78 -1.18 0.00 0.00 179.01 179.46 3d2c h GLY 21 N 0.93 0.97 1.34 1.92 0.00 -1.84 -2.40 103.07 103.99 3d2c h GLY 21 Ca 0.24 -0.81 -0.12 0.00 0.00 0.00 0.00 47.33 46.63 3d2c h GLY 21 CO -0.04 0.74 -0.27 -2.22 0.00 0.00 0.00 176.54 174.76 3d2c h ILE 22 N 0.78 1.28 0.01 2.60 2.04 -1.67 -2.38 117.51 120.17 3d2c h ILE 22 Ca 0.11 -1.39 -0.00 0.00 1.00 0.00 0.00 64.86 64.58 3d2c h ILE 22 Cb 0.72 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 3d2c h ILE 22 CO 0.06 0.46 -0.01 0.11 0.00 0.00 0.00 178.15 178.77 3d2c h LYS 23 N 0.65 -0.01 -0.47 2.37 1.57 -0.98 -1.67 116.57 118.03 3d2c h LYS 23 Ca 0.08 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.93 3d2c h LYS 23 Cb 0.78 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.04 3d2c h LYS 23 CO 0.06 0.16 0.15 0.77 -0.57 0.00 0.00 179.45 180.03 3d2c h SER 24 N -0.19 0.13 -0.24 0.86 0.02 -1.40 0.17 113.55 112.90 3d2c h SER 24 Ca -0.00 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 3d2c h SER 24 Cb 0.19 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 3d2c h SER 24 CO 0.00 0.11 0.15 0.22 -1.14 0.00 0.00 176.83 176.17 3d2c h TYR 25 N 0.32 0.28 -0.65 3.45 3.20 -1.32 -0.85 116.97 121.39 3d2c h TYR 25 Ca 0.23 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 3d2c h TYR 25 Cb 0.25 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 3d2c h TYR 25 CO -0.17 0.17 0.16 -0.07 -1.64 0.00 0.00 178.16 176.61 3d2c h LEU 26 N 0.30 0.96 -0.64 2.82 3.38 -0.82 -1.33 115.31 120.00 3d2c h LEU 26 Ca 0.09 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 3d2c h LEU 26 Cb -0.02 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 3d2c h LEU 26 CO -0.03 0.93 0.28 0.58 0.09 0.00 0.00 178.44 180.28 3d2c h VAL 27 N 0.98 1.23 0.00 1.22 2.07 -0.74 -0.68 116.25 120.32 3d2c h VAL 27 Ca 0.21 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3d2c h VAL 27 Cb 0.34 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3d2c h VAL 27 CO -0.00 0.27 0.00 0.77 0.02 0.00 0.00 177.57 178.63 3d2c h SER 28 N 0.89 0.00 -0.55 0.57 4.64 -0.55 -2.04 113.55 116.51 3d2c h SER 28 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 3d2c h SER 28 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3d2c h SER 28 CO -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 3d2c n GLN 29 N -2.98 2.42 0.00 4.77 1.13 -0.47 -4.94 117.38 117.30 3d2c n GLN 29 Ca -0.01 -2.19 0.00 0.00 -1.94 0.00 0.00 57.00 52.86 3d2c n GLN 29 Cb 0.21 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.07 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 1.48 0.88 3.78 1.08 0.00 -0.76 -5.05 105.19 106.60 3d2c n GLY 30 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.01 3.28 -0.02 1.61 0.51 -0.39 -4.99 118.94 116.93 3d2c s TRP 31 Ca 0.00 1.65 -0.29 0.00 -2.12 0.00 0.00 56.10 55.33 3d2c s TRP 31 Cb 0.00 -3.14 -0.03 0.00 -0.81 0.00 0.00 33.47 29.49 3d2c s TRP 31 CO 0.00 -0.63 0.96 -1.12 -0.51 0.00 0.00 176.95 175.65 3d2c s SER 32 N -1.52 7.32 0.28 2.95 0.01 -1.26 -4.14 113.70 117.34 3d2c s SER 32 Ca 0.57 1.61 0.01 0.00 1.31 0.00 0.00 55.95 59.45 3d2c s SER 32 Cb -0.23 -2.56 0.64 0.00 0.21 0.00 0.00 66.02 64.09 3d2c s SER 32 CO 0.28 -0.27 1.71 -0.09 0.41 0.00 0.00 173.24 175.28 3d2c h ARG 33 N 6.84 0.41 -0.76 12.44 9.65 -1.94 0.37 114.38 141.40 3d2c h ARG 33 Ca -0.40 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.46 3d2c h ARG 33 Cb 1.21 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 3d2c h ARG 33 CO 0.76 0.27 0.00 -0.40 2.80 0.00 0.00 179.97 183.41 3d2c n ASP 34 N -5.03 2.54 -0.03 -3.80 5.68 -1.26 -2.97 116.55 111.68 3d2c n ASP 34 Ca 0.20 -2.29 0.03 0.00 -0.50 0.00 0.00 54.79 52.22 3d2c n ASP 34 Cb 0.57 -0.51 0.04 0.00 -1.14 0.00 0.00 41.12 40.08 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 0.24 2.31 -4.03 0.11 4.76 0.12 -4.95 118.16 116.71 3d2c n LYS 35 Ca 0.10 -1.72 -0.34 0.00 -2.87 0.00 0.00 58.31 53.48 3d2c n LYS 35 Cb 0.54 -1.10 -0.15 0.00 -1.84 0.00 0.00 35.03 32.48 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 -1.43 2.51 0.07 -0.35 1.43 -1.16 -0.64 118.68 119.11 3d2c s LEU 36 Ca 0.09 -0.59 0.09 0.00 -1.03 0.00 0.00 54.13 52.69 3d2c s LEU 36 Cb 0.08 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 3d2c s LEU 36 CO 0.01 -0.02 -0.25 -0.31 0.23 0.00 0.00 176.35 176.01 3d2c s TYR 37 N 1.36 2.13 -0.13 0.29 1.51 0.28 -4.96 117.35 117.83 3d2c s TYR 37 Ca 0.05 -0.40 -0.00 0.00 -1.01 0.00 0.00 57.07 55.71 3d2c s TYR 37 Cb -0.14 -1.23 0.03 0.00 -0.11 0.00 0.00 41.96 40.50 3d2c s TYR 37 CO -0.09 0.18 -0.09 0.00 -1.11 0.00 0.00 175.55 174.44 3d2c s ALA 38 N -0.91 1.51 0.57 3.71 0.00 -1.26 0.74 121.76 126.11 3d2c s ALA 38 Ca 0.11 -0.69 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 3d2c s ALA 38 Cb -0.10 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 3d2c s ALA 38 CO 0.03 -0.45 0.96 0.54 0.00 0.00 0.00 175.76 176.85 3d2c s VAL 39 N 1.63 4.73 -0.15 0.00 0.11 -0.62 -4.83 120.40 121.28 3d2c s VAL 39 Ca 0.05 0.78 -0.01 0.00 -2.93 0.00 0.00 61.98 59.87 3d2c s VAL 39 Cb -0.13 -3.84 0.04 0.00 -1.53 0.00 0.00 36.38 30.92 3d2c s VAL 39 CO -0.09 -0.99 -0.04 -1.81 -3.33 0.00 0.00 175.10 168.83 3d2c s ASP 40 N -3.95 2.55 0.06 3.54 1.01 -1.26 -3.85 116.67 114.76 3d2c s ASP 40 Ca 0.54 -0.53 -0.11 0.00 0.71 0.00 0.00 52.55 53.16 3d2c s ASP 40 Cb -0.11 -0.81 -0.06 0.00 1.01 0.00 0.00 42.92 42.95 3d2c s ASP 40 CO 0.48 -0.18 0.41 -0.36 0.21 0.00 0.00 175.17 175.72 3d2c s PHE 41 N 1.71 3.62 -0.11 4.23 0.08 -1.26 -4.97 117.98 121.27 3d2c s PHE 41 Ca 0.02 0.85 0.15 0.00 0.12 0.00 0.00 56.93 58.07 3d2c s PHE 41 Cb -0.14 -2.20 -0.03 0.00 -0.57 0.00 0.00 43.02 40.08 3d2c s PHE 41 CO -0.08 0.55 1.24 0.11 -0.10 0.00 0.00 175.22 176.95 3d2c h TRP 42 N 3.99 0.00 -1.42 0.36 5.08 -1.98 -3.41 115.95 118.57 3d2c h TRP 42 Ca -0.50 0.00 -0.62 0.00 1.08 0.00 0.00 58.89 58.85 3d2c h TRP 42 Cb 1.20 0.00 -0.12 0.00 -3.00 0.00 0.00 29.16 27.24 3d2c h TRP 42 CO 0.68 0.59 1.34 0.34 -1.28 0.00 0.00 178.44 180.11 3d2c s ASP 43 N -6.29 6.53 0.20 0.11 2.15 -1.26 -4.82 116.67 113.29 3d2c s ASP 43 Ca 0.02 -1.59 0.16 0.00 0.43 0.00 0.00 52.55 51.56 3d2c s ASP 43 Cb 0.08 -2.53 0.79 0.00 -0.30 0.00 0.00 42.92 40.97 3d2c s ASP 43 CO 0.77 -1.40 1.48 0.29 -0.17 0.00 0.00 175.17 176.14 3d2c n LYS 44 N 8.34 0.10 0.04 4.34 4.76 -1.26 -0.99 118.16 133.49 3d2c n LYS 44 Ca 0.31 0.54 0.13 0.00 -2.87 0.00 0.00 58.31 56.42 3d2c n LYS 44 Cb 0.51 -1.79 0.44 0.00 -1.84 0.00 0.00 35.03 32.34 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 -2.00 0.24 -1.81 -0.18 -2.24 -1.26 -0.87 114.28 106.16 3d2c n THR 45 Ca -0.00 -0.13 -0.12 0.00 -2.27 0.00 0.00 64.05 61.53 3d2c n THR 45 Cb 0.06 -0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 67.89 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 1.42 0.56 3.76 3.38 0.00 -0.16 -4.82 105.19 109.33 3d2c n GLY 46 Ca 0.06 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.53 2.42 0.20 2.61 -4.23 -1.26 -4.84 115.64 108.01 3d2c s THR 47 Ca 0.00 0.40 -0.11 0.00 -1.18 0.00 0.00 61.69 60.80 3d2c s THR 47 Cb 0.00 -3.25 0.12 0.00 1.34 0.00 0.00 72.50 70.71 3d2c s THR 47 CO 0.00 0.08 1.82 0.78 -0.54 0.00 0.00 174.62 176.77 3d2c h ASN 48 N 3.86 0.59 -0.86 3.99 2.35 -1.94 -1.04 115.58 122.52 3d2c h ASN 48 Ca -0.49 0.01 0.15 0.00 -0.55 0.00 0.00 56.30 55.42 3d2c h ASN 48 Cb 1.23 -0.11 -0.09 0.00 0.05 0.00 0.00 38.32 39.39 3d2c h ASN 48 CO 0.70 0.40 0.45 0.22 -1.65 0.00 0.00 177.43 177.55 3d2c h TYR 49 N 0.72 0.79 0.09 1.19 3.20 -2.00 0.46 116.97 121.42 3d2c h TYR 49 Ca 0.26 0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.96 3d2c h TYR 49 Cb 0.08 -0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 3d2c h TYR 49 CO -0.06 0.19 -1.03 -0.91 -1.64 0.00 0.00 178.16 174.71 3d2c h ASN 50 N 0.64 0.29 0.13 -2.11 2.35 -1.88 -3.39 115.58 111.60 3d2c h ASN 50 Ca 0.47 -0.85 -0.18 0.00 -0.55 0.00 0.00 56.30 55.19 3d2c h ASN 50 Cb 0.66 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.93 3d2c h ASN 50 CO -0.36 1.45 -0.65 0.78 -1.65 0.00 0.00 177.43 177.00 3d2c h ASN 51 N -0.52 0.57 -0.25 5.81 -0.26 -1.05 -3.31 115.58 116.57 3d2c h ASN 51 Ca -0.23 -0.34 0.04 0.00 -0.56 0.00 0.00 56.30 55.21 3d2c h ASN 51 Cb 1.55 -0.17 -0.07 0.00 -1.06 0.00 0.00 38.32 38.57 3d2c h ASN 51 CO 0.03 1.07 -0.55 1.23 -1.06 0.00 0.00 177.43 178.16 3d2c h GLY 52 N 1.13 -1.07 1.04 2.83 0.00 -0.27 -0.14 103.07 106.59 3d2c h GLY 52 Ca -0.02 0.70 0.03 0.00 0.00 0.00 0.00 47.33 48.05 3d2c h GLY 52 CO 0.12 -0.17 0.56 -2.55 0.00 0.00 0.00 176.54 174.50 3d2c h PRO 53 N -0.50 1.04 -0.29 4.80 0.11 -1.76 -0.27 132.00 135.12 3d2c h PRO 53 Ca 0.05 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.09 3d2c h PRO 53 Cb 0.64 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 3d2c h PRO 53 CO -0.50 0.69 0.16 0.28 -0.21 0.00 0.00 178.00 178.41 3d2c h VAL 54 N 1.07 1.13 -0.78 3.15 2.07 -1.48 -2.05 116.25 119.35 3d2c h VAL 54 Ca 0.34 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 3d2c h VAL 54 Cb 0.02 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 3d2c h VAL 54 CO -0.10 0.13 0.32 0.25 0.02 0.00 0.00 177.57 178.19 3d2c h LEU 55 N 0.35 1.07 -0.16 2.57 5.85 -0.53 -1.35 115.31 123.10 3d2c h LEU 55 Ca 0.10 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.70 3d2c h LEU 55 Cb 0.07 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 40.78 3d2c h LEU 55 CO -0.02 0.95 -0.11 -1.28 -0.34 0.00 0.00 178.44 177.64 3d2c h SER 56 N 1.14 -0.37 0.27 1.25 0.87 -0.62 -0.52 113.55 115.56 3d2c h SER 56 Ca 0.26 0.08 -0.15 0.00 -1.23 0.00 0.00 61.79 60.76 3d2c h SER 56 Cb 0.21 0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 3d2c h SER 56 CO -0.02 -0.15 -0.58 -0.09 -0.53 0.00 0.00 176.83 175.46 3d2c h ARG 57 N -0.12 0.32 -0.80 2.24 9.65 -1.23 -2.18 114.38 122.27 3d2c h ARG 57 Ca 0.10 -0.21 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 3d2c h ARG 57 Cb 0.26 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.83 3d2c h ARG 57 CO -0.24 0.81 0.52 0.35 2.80 0.00 0.00 179.97 184.22 3d2c h PHE 58 N 0.24 0.99 -0.13 2.20 3.57 -0.69 0.16 116.94 123.29 3d2c h PHE 58 Ca -0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 3d2c h PHE 58 Cb 1.08 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 3d2c h PHE 58 CO 0.03 0.61 0.02 0.28 -2.23 0.00 0.00 178.31 177.02 3d2c h VAL 59 N 1.06 1.21 -0.88 1.41 2.07 -0.93 -1.52 116.25 118.69 3d2c h VAL 59 Ca 0.30 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 67.14 3d2c h VAL 59 Cb -0.09 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 3d2c h VAL 59 CO -0.07 0.20 0.56 -0.61 0.02 0.00 0.00 177.57 177.66 3d2c h GLN 60 N -0.01 1.17 -0.35 1.57 5.75 -1.06 0.12 115.11 122.30 3d2c h GLN 60 Ca 0.04 -0.09 -0.00 0.00 -0.15 0.00 0.00 58.65 58.45 3d2c h GLN 60 Cb 0.29 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 3d2c h GLN 60 CO 0.00 0.79 0.21 -0.22 -2.65 0.00 0.00 178.83 176.97 3d2c h LYS 61 N 1.20 0.47 -0.57 1.69 3.64 -0.49 0.10 116.57 122.61 3d2c h LYS 61 Ca 0.32 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 3d2c h LYS 61 Cb -0.10 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 3d2c h LYS 61 CO -0.06 0.35 0.26 0.28 -2.27 0.00 0.00 179.45 178.01 3d2c h VAL 62 N 0.45 1.21 -0.28 2.00 2.07 -0.39 -1.15 116.25 120.16 3d2c h VAL 62 Ca 0.12 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 3d2c h VAL 62 Cb 0.01 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 3d2c h VAL 62 CO -0.02 0.24 0.12 -0.07 0.02 0.00 0.00 177.57 177.86 3d2c h LEU 63 N 0.77 0.39 -0.51 2.57 3.38 -0.46 -1.13 115.31 120.32 3d2c h LEU 63 Ca 0.19 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 58.04 3d2c h LEU 63 Cb 0.14 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3d2c h LEU 63 CO -0.02 0.43 0.29 0.44 0.09 0.00 0.00 178.44 179.67 3d2c h ASP 64 N 0.31 0.46 -0.12 -0.43 3.32 -0.57 0.45 116.42 119.84 3d2c h ASP 64 Ca 0.10 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 3d2c h ASP 64 Cb 0.16 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 3d2c h ASP 64 CO -0.01 0.32 -0.03 -0.08 -1.72 0.00 0.00 179.24 177.72 3d2c h GLU 65 N 0.58 0.23 0.00 3.56 4.81 -1.06 -3.30 114.58 119.40 3d2c h GLU 65 Ca 0.21 -0.09 -0.20 0.00 -0.13 0.00 0.00 59.36 59.15 3d2c h GLU 65 Cb 0.06 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 3d2c h GLU 65 CO -0.12 0.53 -1.08 1.79 -0.73 0.00 0.00 179.01 179.40 3d2c h THR 66 N -0.08 1.32 0.00 0.32 1.35 -1.16 -3.48 112.91 111.19 3d2c h THR 66 Ca 0.03 -2.98 0.00 0.00 -0.55 0.00 0.00 66.41 62.91 3d2c h THR 66 Cb 0.44 2.64 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 3d2c h THR 66 CO 0.01 0.75 0.00 0.61 -0.25 0.00 0.00 175.52 176.64 3d2c n GLY 67 N 1.37 0.61 3.80 5.82 0.00 0.16 -5.03 105.19 111.92 3d2c n GLY 67 Ca -0.03 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.00 2.59 -0.01 4.61 0.00 -1.20 -4.98 121.76 120.77 3d2c s ALA 68 Ca 0.00 0.26 0.06 0.00 0.00 0.00 0.00 51.96 52.28 3d2c s ALA 68 Cb 0.00 -3.23 -0.24 0.00 0.00 0.00 0.00 23.12 19.65 3d2c s ALA 68 CO 0.00 -1.21 0.79 -0.22 0.00 0.00 0.00 175.76 175.12 3d2c h LYS 69 N -0.36 0.09 -3.80 0.00 3.11 -1.96 -3.45 116.57 110.20 3d2c h LYS 69 Ca -0.45 -0.16 -0.09 0.00 -2.81 0.00 0.00 60.65 57.15 3d2c h LYS 69 Cb 1.22 0.06 -0.14 0.00 -1.00 0.00 0.00 32.23 32.37 3d2c h LYS 69 CO 0.56 0.82 -0.35 0.15 -2.81 0.00 0.00 179.45 177.81 3d2c s LYS 70 N -2.62 0.88 0.35 1.90 1.02 -1.26 -4.77 119.74 115.25 3d2c s LYS 70 Ca -0.07 -0.97 0.09 0.00 0.02 0.00 0.00 55.97 55.04 3d2c s LYS 70 Cb 0.08 0.35 -0.06 0.00 -0.52 0.00 0.00 37.83 37.68 3d2c s LYS 70 CO 0.82 -0.29 -0.03 0.14 -0.92 0.00 0.00 175.35 175.08 3d2c s VAL 71 N -3.87 2.39 0.11 3.17 -7.23 0.24 -4.22 120.40 110.99 3d2c s VAL 71 Ca 0.06 -2.07 0.06 0.00 -1.81 0.00 0.00 61.98 58.23 3d2c s VAL 71 Cb 0.05 -2.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 3d2c s VAL 71 CO -0.10 -0.17 -0.04 -1.81 -0.31 0.00 0.00 175.10 172.66 3d2c s ASP 72 N -3.68 4.70 -0.06 4.85 1.01 -0.50 -1.49 116.67 121.51 3d2c s ASP 72 Ca 0.34 -0.31 0.04 0.00 0.71 0.00 0.00 52.55 53.33 3d2c s ASP 72 Cb 0.02 -1.00 0.00 0.00 1.01 0.00 0.00 42.92 42.95 3d2c s ASP 72 CO 0.18 0.16 -0.16 -0.63 0.21 0.00 0.00 175.17 174.93 3d2c s ILE 73 N -1.35 1.38 -0.23 0.77 1.01 0.11 -1.26 121.20 121.63 3d2c s ILE 73 Ca 0.24 -0.66 -0.02 0.00 0.00 0.00 0.00 60.65 60.21 3d2c s ILE 73 Cb -0.11 -1.21 0.01 0.00 0.01 0.00 0.00 42.46 41.16 3d2c s ILE 73 CO 0.16 0.40 -0.07 -0.69 0.00 0.00 0.00 174.94 174.74 3d2c s VAL 74 N 0.27 2.98 0.03 2.92 1.01 -0.73 -0.66 120.40 126.22 3d2c s VAL 74 Ca -0.09 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.19 3d2c s VAL 74 Cb -0.13 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 3d2c s VAL 74 CO 0.03 0.36 -0.19 0.00 0.00 0.00 0.00 175.10 175.30 3d2c s ALA 75 N 1.39 1.57 -0.14 5.51 0.00 0.39 -1.18 121.76 129.31 3d2c s ALA 75 Ca 0.04 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 3d2c s ALA 75 Cb -0.15 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 3d2c s ALA 75 CO -0.05 0.35 -0.09 -1.58 0.00 0.00 0.00 175.76 174.39 3d2c s HIS 76 N -0.70 2.91 0.00 0.00 5.65 -0.08 0.11 115.29 123.19 3d2c s HIS 76 Ca 0.06 -0.44 0.00 0.00 0.25 0.00 0.00 55.06 54.93 3d2c s HIS 76 Cb -0.08 -1.88 0.00 0.00 -1.18 0.00 0.00 32.58 29.44 3d2c s HIS 76 CO 0.01 -0.10 0.00 0.45 -0.65 0.00 0.00 174.74 174.45 3d2c n SER 77 N 3.43 0.00 0.30 9.88 2.88 -0.26 -0.08 113.62 129.76 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 0.53 0.00 0.90 0.00 -0.75 0.00 0.00 64.21 64.89 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 0.37 114.93 113.84 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 0.03 -0.05 0.78 -0.40 0.00 0.00 176.91 177.27 3d2c h GLY 79 N 0.97 0.00 0.95 1.39 0.00 -0.48 -0.91 103.07 104.99 3d2c h GLY 79 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 3d2c h GLY 79 CO 0.00 0.00 -0.03 -1.33 0.00 0.00 0.00 176.54 175.18 3d2c h GLY 80 N 0.15 0.77 0.95 4.60 0.00 -1.08 -0.63 103.07 107.84 3d2c h GLY 80 Ca -0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 3d2c h GLY 80 CO 0.01 0.54 0.15 0.00 0.00 0.00 0.00 176.54 177.24 3d2c h ALA 81 N 0.87 0.57 -0.99 3.60 0.00 -1.33 -1.28 119.26 120.70 3d2c h ALA 81 Ca 0.11 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3d2c h ALA 81 Cb 0.52 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3d2c h ALA 81 CO 0.03 0.21 0.64 -0.91 0.00 0.00 0.00 179.25 179.22 3d2c h ASN 82 N 0.57 1.06 -0.26 0.00 2.35 -1.01 -0.30 115.58 117.98 3d2c h ASN 82 Ca 0.14 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.84 3d2c h ASN 82 Cb 0.24 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 3d2c h ASN 82 CO -0.01 0.71 -0.03 0.74 -1.65 0.00 0.00 177.43 177.19 3d2c h THR 83 N 1.22 1.27 -0.47 2.81 2.02 -0.80 -0.76 112.91 118.21 3d2c h THR 83 Ca 0.40 -1.01 -0.04 0.00 0.77 0.00 0.00 66.41 66.54 3d2c h THR 83 Cb 0.05 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3d2c h THR 83 CO -0.14 0.32 0.12 -0.07 0.37 0.00 0.00 175.52 176.12 3d2c h LEU 84 N 0.25 0.64 -0.43 2.58 3.38 -0.83 -1.30 115.31 119.61 3d2c h LEU 84 Ca 0.07 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 3d2c h LEU 84 Cb 0.48 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3d2c h LEU 84 CO 0.02 0.64 -0.24 0.22 0.09 0.00 0.00 178.44 179.17 3d2c h TYR 85 N 0.68 1.07 -0.23 1.13 3.20 -0.89 -0.82 116.97 121.11 3d2c h TYR 85 Ca 0.16 -0.27 -0.00 0.00 3.14 0.00 0.00 58.73 61.75 3d2c h TYR 85 Cb 0.24 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 3d2c h TYR 85 CO 0.01 1.08 0.13 -0.92 -1.64 0.00 0.00 178.16 176.82 3d2c h TYR 86 N 0.75 0.31 -0.17 -3.82 3.20 -0.67 0.29 116.97 116.86 3d2c h TYR 86 Ca 0.09 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 3d2c h TYR 86 Cb 0.81 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 3d2c h TYR 86 CO 0.06 0.27 -0.01 0.82 -1.64 0.00 0.00 178.16 177.65 3d2c h ILE 87 N 0.26 1.26 0.07 1.81 2.04 -1.18 -1.96 117.51 119.81 3d2c h ILE 87 Ca 0.08 -0.90 -0.12 0.00 1.00 0.00 0.00 64.86 64.92 3d2c h ILE 87 Cb 0.06 1.53 0.01 0.00 -0.74 0.00 0.00 36.82 37.67 3d2c h ILE 87 CO -0.01 0.27 -0.57 0.50 0.00 0.00 0.00 178.15 178.33 3d2c h LYS 88 N 0.04 0.15 0.00 2.37 3.64 -1.14 -2.63 116.57 118.99 3d2c h LYS 88 Ca 0.05 -0.25 -0.11 0.00 -1.27 0.00 0.00 60.65 59.07 3d2c h LYS 88 Cb 0.41 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 3d2c h LYS 88 CO 0.01 1.12 -1.88 0.66 -2.27 0.00 0.00 179.45 177.09 3d2c n TYR 89 N -4.33 0.27 -0.94 1.91 4.02 0.05 -4.96 117.16 113.17 3d2c n TYR 89 Ca -0.15 0.08 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 3d2c n TYR 89 Cb 0.68 -0.76 0.00 0.00 -0.02 0.00 0.00 39.34 39.24 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 -2.52 0.00 -0.58 7.72 4.77 -0.78 -5.02 117.00 120.59 3d2c n LEU 90 Ca -0.11 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.00 3d2c n LEU 90 Cb 0.74 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 42.27 3d2c n LEU 90 CO 0.44 0.00 0.82 -0.90 -1.33 0.00 0.00 177.39 176.42 3d2c n ASP 91 N 0.00 1.81 0.00 -1.43 5.75 -1.21 -4.43 116.55 117.04 3d2c n ASP 91 Ca 0.00 -1.61 0.04 0.00 -0.01 0.00 0.00 54.79 53.20 3d2c n ASP 91 Cb 0.00 -0.02 0.16 0.00 -1.03 0.00 0.00 41.12 40.24 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 1.21 -0.74 0.41 6.12 0.00 -0.95 -4.03 105.19 107.20 3d2c n GLY 92 Ca 0.18 -0.03 0.37 0.00 0.00 0.00 0.00 46.02 46.54 3d2c n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2c n GLY 93 N -0.72 -0.79 0.96 -0.02 0.00 -0.99 -1.30 105.19 102.32 3d2c n GLY 93 Ca 0.02 0.76 0.05 0.00 0.00 0.00 0.00 46.02 46.85 3d2c n GLY 93 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3d2c n ASN 94 N -4.87 1.33 -0.11 1.61 6.94 -1.26 -0.05 115.26 118.86 3d2c n ASN 94 Ca 0.39 -2.91 0.01 0.00 -0.02 0.00 0.00 54.58 52.06 3d2c n ASN 94 Cb 1.44 -0.40 0.01 0.00 -2.36 0.00 0.00 39.78 38.47 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 -0.36 -0.50 -4.69 -3.83 5.02 -0.42 -4.88 118.16 108.50 3d2c n LYS 95 Ca 0.12 -0.70 -0.25 0.00 -2.02 0.00 0.00 58.31 55.46 3d2c n LYS 95 Cb 0.89 -1.05 -0.14 0.00 -0.02 0.00 0.00 35.03 34.70 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 -0.25 1.58 -0.02 -0.18 1.01 -1.21 -0.59 120.40 120.74 3d2c s VAL 96 Ca 0.03 -1.08 -0.05 0.00 0.00 0.00 0.00 61.98 60.88 3d2c s VAL 96 Cb 0.02 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 3d2c s VAL 96 CO 0.03 0.25 -0.10 0.00 0.00 0.00 0.00 175.10 175.28 3d2c n ALA 97 N 2.05 2.41 -2.75 5.51 0.00 -0.56 -4.72 120.51 122.44 3d2c n ALA 97 Ca -0.17 -0.27 -0.32 0.00 0.00 0.00 0.00 53.44 52.68 3d2c n ALA 97 Cb 0.53 0.26 -0.15 0.00 0.00 0.00 0.00 19.45 20.09 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 -5.89 3.64 -0.05 0.00 0.01 -1.26 -1.24 114.94 110.14 3d2c s ASN 98 Ca -0.10 -0.36 0.03 0.00 -0.71 0.00 0.00 52.86 51.73 3d2c s ASN 98 Cb 0.02 -1.07 0.00 0.00 0.41 0.00 0.00 41.25 40.62 3d2c s ASN 98 CO 0.13 0.25 -0.15 -0.69 -1.51 0.00 0.00 177.10 175.14 3d2c s VAL 99 N -0.20 1.27 -0.09 1.60 1.01 0.38 -0.72 120.40 123.66 3d2c s VAL 99 Ca -0.01 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 3d2c s VAL 99 Cb -0.13 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.16 3d2c s VAL 99 CO 0.03 0.38 -0.06 -0.69 0.00 0.00 0.00 175.10 174.76 3d2c s VAL 100 N 0.27 0.86 0.01 2.92 1.01 0.17 -0.38 120.40 125.27 3d2c s VAL 100 Ca -0.08 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 61.72 3d2c s VAL 100 Cb -0.13 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 3d2c s VAL 100 CO 0.03 0.33 -0.05 0.42 0.00 0.00 0.00 175.10 175.83 3d2c s THR 101 N 1.57 3.79 -0.29 3.92 -4.23 -0.23 -0.46 115.64 119.72 3d2c s THR 101 Ca 0.01 -0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 59.77 3d2c s THR 101 Cb -0.13 -2.67 0.05 0.00 1.34 0.00 0.00 72.50 71.09 3d2c s THR 101 CO -0.06 0.37 -0.02 -0.76 -0.54 0.00 0.00 174.62 173.61 3d2c s LEU 102 N -1.52 3.82 -1.55 4.79 1.43 0.12 -1.20 118.68 124.57 3d2c s LEU 102 Ca 0.18 -1.33 -0.14 0.00 -1.03 0.00 0.00 54.13 51.81 3d2c s LEU 102 Cb -0.11 -1.67 0.09 0.00 0.03 0.00 0.00 46.19 44.53 3d2c s LEU 102 CO 0.09 -0.25 0.95 0.61 0.23 0.00 0.00 176.35 177.98 3d2c n GLY 103 N 4.57 -0.48 3.76 -3.19 0.00 0.15 -1.11 105.19 108.89 3d2c n GLY 103 Ca -0.13 0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.34 2.92 -0.43 -0.02 0.00 -1.26 -3.49 107.32 101.70 3d2c s GLY 104 Ca 0.66 1.21 -0.04 0.00 0.00 0.00 0.00 44.72 46.55 3d2c s GLY 104 CO 0.84 1.90 2.86 0.00 0.00 0.00 0.00 173.10 178.71 3d2c n ALA 105 N 1.09 6.46 -0.30 3.20 0.00 -0.34 -2.71 120.51 127.93 3d2c n ALA 105 Ca 0.01 -2.94 0.10 0.00 0.00 0.00 0.00 53.44 50.61 3d2c n ALA 105 Cb 0.42 -2.19 0.33 0.00 0.00 0.00 0.00 19.45 18.02 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 3.04 0.74 0.00 0.00 2.35 -1.71 -2.05 115.58 117.95 3d2c h ASN 106 Ca 0.38 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 3d2c h ASN 106 Cb 0.80 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.07 3d2c h ASN 106 CO 0.82 0.38 0.00 0.54 -1.65 0.00 0.00 177.43 177.52 3d2c n ARG 107 N -4.58 0.63 0.04 0.81 1.74 -0.10 -1.49 116.66 113.70 3d2c n ARG 107 Ca 0.18 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.39 3d2c n ARG 107 Cb 0.43 -1.23 0.47 0.00 -1.02 0.00 0.00 32.46 31.11 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 -0.73 0.38 -0.02 0.55 4.77 -0.77 -4.22 117.00 116.96 3d2c n LEU 108 Ca 0.07 0.44 -0.05 0.00 -0.03 0.00 0.00 56.01 56.43 3d2c n LEU 108 Cb 0.03 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.72 3d2c n LEU 108 CO 0.05 -0.05 -0.52 0.41 -1.33 0.00 0.00 177.39 175.96 3d2c n THR 109 N -1.79 0.72 -3.64 -5.08 -1.04 -0.56 -5.09 114.28 97.80 3d2c n THR 109 Ca 0.06 0.07 -0.10 0.00 -2.04 0.00 0.00 64.05 62.04 3d2c n THR 109 Cb 0.38 -1.66 -0.03 0.00 -1.82 0.00 0.00 70.33 67.19 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 -2.16 0.03 -0.51 12.58 -1.32 -0.94 -5.02 115.64 118.30 3d2c s THR 110 Ca -0.09 -0.54 0.22 0.00 -1.21 0.00 0.00 61.69 60.07 3d2c s THR 110 Cb 0.03 -1.34 -0.23 0.00 -1.51 0.00 0.00 72.50 69.45 3d2c s THR 110 CO 0.11 -0.14 0.78 0.47 -2.21 0.00 0.00 174.62 173.64 3d2c n ASP 111 N -0.32 0.52 -4.31 8.08 8.00 -1.26 -3.65 116.55 123.60 3d2c n ASP 111 Ca -0.13 -0.37 -0.28 0.00 0.71 0.00 0.00 54.79 54.72 3d2c n ASP 111 Cb 0.63 1.30 -0.14 0.00 -0.02 0.00 0.00 41.12 42.89 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 1.54 -0.13 -1.24 1.02 -1.26 -0.20 119.74 116.22 3d2c s LYS 112 Ca 0.01 -1.09 -0.29 0.00 0.02 0.00 0.00 55.97 54.62 3d2c s LYS 112 Cb 0.15 -1.75 -0.04 0.00 -0.52 0.00 0.00 37.83 35.66 3d2c s LYS 112 CO 0.86 0.44 1.70 0.00 -0.92 0.00 0.00 175.35 177.43 3d2c s ALA 113 N -0.87 3.40 0.07 5.17 0.00 -0.62 -4.86 121.76 124.06 3d2c s ALA 113 Ca 0.10 0.75 -0.31 0.00 0.00 0.00 0.00 51.96 52.51 3d2c s ALA 113 Cb -0.10 -3.82 -0.08 0.00 0.00 0.00 0.00 23.12 19.12 3d2c s ALA 113 CO 0.03 -1.74 1.65 -2.14 0.00 0.00 0.00 175.76 173.55 3d2c s PRO 114 N 4.50 4.20 0.51 0.00 0.02 -1.26 -4.83 135.00 138.14 3d2c s PRO 114 Ca 0.75 2.33 0.25 0.00 0.02 0.00 0.00 61.00 64.35 3d2c s PRO 114 Cb -0.30 -3.59 1.39 0.00 0.02 0.00 0.00 34.50 32.01 3d2c s PRO 114 CO 0.30 -0.73 2.07 -1.35 -0.33 0.00 0.00 177.00 176.96 3d2c h PRO 115 N 8.30 0.00 0.00 5.54 0.11 -1.92 -3.41 132.00 140.62 3d2c h PRO 115 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3d2c h PRO 115 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3d2c h PRO 115 CO 0.93 0.12 0.00 0.41 -0.21 0.00 0.00 178.00 179.25 3d2c n GLY 116 N -0.81 -2.75 0.46 -0.55 0.00 -1.26 -1.25 105.19 99.03 3d2c n GLY 116 Ca -0.02 -1.88 0.07 0.00 0.00 0.00 0.00 46.02 44.19 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 -0.17 2.11 -3.53 2.61 -2.24 0.93 -4.95 114.28 109.03 3d2c n THR 117 Ca 0.00 -2.43 -0.42 0.00 -2.27 0.00 0.00 64.05 58.93 3d2c n THR 117 Cb 0.00 -0.25 -0.11 0.00 -2.10 0.00 0.00 70.33 67.87 3d2c n THR 117 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d2c s ASP 118 N -2.72 5.94 0.60 3.42 -1.08 -1.26 -4.81 116.67 116.76 3d2c s ASP 118 Ca 0.37 -0.86 0.30 0.00 -0.52 0.00 0.00 52.55 51.84 3d2c s ASP 118 Cb 0.32 -2.10 1.76 0.00 -1.46 0.00 0.00 42.92 41.44 3d2c s ASP 118 CO 0.02 -0.39 2.14 -0.65 0.52 0.00 0.00 175.17 176.81 3d2c h PRO 119 N 8.53 0.00 0.07 4.34 0.11 -1.97 -3.11 132.00 139.96 3d2c h PRO 119 Ca -0.27 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.56 3d2c h PRO 119 Cb 1.12 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3d2c h PRO 119 CO 0.69 0.00 -1.51 -0.91 -0.21 0.00 0.00 178.00 176.06 3d2c h ASN 120 N 0.00 0.22 -3.21 -2.05 2.35 -2.01 -3.46 115.58 107.41 3d2c h ASN 120 Ca 0.06 -0.74 -0.67 0.00 -0.55 0.00 0.00 56.30 54.40 3d2c h ASN 120 Cb 0.36 -0.07 -0.34 0.00 0.05 0.00 0.00 38.32 38.32 3d2c h ASN 120 CO -0.00 1.63 -0.87 -1.58 -1.65 0.00 0.00 177.43 174.96 3d2c s GLN 121 N -2.45 3.01 -0.06 0.81 0.74 -1.18 -5.11 119.66 115.42 3d2c s GLN 121 Ca -0.25 -0.85 -0.19 0.00 0.05 0.00 0.00 55.36 54.13 3d2c s GLN 121 Cb 0.06 -2.42 -0.05 0.00 1.10 0.00 0.00 33.01 31.70 3d2c s GLN 121 CO 0.69 -0.01 0.52 0.21 -0.55 0.00 0.00 175.29 176.15 3d2c s LYS 122 N 0.79 4.28 0.22 1.67 2.20 -1.26 -4.33 119.74 123.31 3d2c s LYS 122 Ca -0.08 0.56 -0.32 0.00 -0.36 0.00 0.00 55.97 55.78 3d2c s LYS 122 Cb -0.16 -3.37 -0.13 0.00 -1.51 0.00 0.00 37.83 32.67 3d2c s LYS 122 CO -0.01 0.31 1.62 -0.89 -0.36 0.00 0.00 175.35 176.01 3d2c n ILE 123 N 3.08 0.32 -3.79 5.43 5.41 -0.38 -4.98 119.36 124.45 3d2c n ILE 123 Ca -0.08 -0.08 -0.36 0.00 1.00 0.00 0.00 62.75 63.23 3d2c n ILE 123 Cb 0.51 -1.80 -0.06 0.00 -0.71 0.00 0.00 39.64 37.59 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 0.63 4.40 0.01 1.39 1.43 -0.38 -4.61 118.68 121.55 3d2c s LEU 124 Ca 0.73 0.56 0.05 0.00 -1.03 0.00 0.00 54.13 54.44 3d2c s LEU 124 Cb -0.57 -2.37 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 3d2c s LEU 124 CO 0.39 0.34 -0.15 -0.31 0.23 0.00 0.00 176.35 176.85 3d2c s TYR 125 N -1.14 1.37 -0.14 0.29 1.51 -0.46 -0.47 117.35 118.30 3d2c s TYR 125 Ca 0.21 -0.29 -0.01 0.00 -1.01 0.00 0.00 57.07 55.97 3d2c s TYR 125 Cb -0.13 -0.85 0.04 0.00 -0.11 0.00 0.00 41.96 40.90 3d2c s TYR 125 CO 0.10 0.01 -0.03 0.99 -1.11 0.00 0.00 175.55 175.51 3d2c s THR 126 N -0.53 0.86 -0.36 -0.71 2.01 0.49 -1.36 115.64 116.04 3d2c s THR 126 Ca 0.05 -0.41 -0.06 0.00 0.31 0.00 0.00 61.69 61.58 3d2c s THR 126 Cb -0.07 -1.06 0.06 0.00 0.01 0.00 0.00 72.50 71.45 3d2c s THR 126 CO 0.00 0.14 0.13 -0.55 -0.69 0.00 0.00 174.62 173.66 3d2c s SER 127 N 1.75 5.30 -0.13 3.53 0.15 0.10 -1.06 113.70 123.34 3d2c s SER 127 Ca 0.02 -1.37 -0.07 0.00 0.70 0.00 0.00 55.95 55.23 3d2c s SER 127 Cb -0.14 -1.86 -0.04 0.00 -1.71 0.00 0.00 66.02 62.26 3d2c s SER 127 CO -0.07 -0.39 0.13 -0.63 1.20 0.00 0.00 173.24 173.48 3d2c s ILE 128 N 1.34 5.44 0.00 6.45 1.01 -0.34 -0.58 121.20 134.53 3d2c s ILE 128 Ca 0.00 0.19 -0.24 0.00 0.00 0.00 0.00 60.65 60.60 3d2c s ILE 128 Cb -0.21 -3.39 0.05 0.00 0.01 0.00 0.00 42.46 38.93 3d2c s ILE 128 CO 0.01 0.59 0.53 -0.72 0.00 0.00 0.00 174.94 175.34 3d2c s TYR 129 N -0.76 -0.45 -0.07 3.97 -0.85 -0.86 0.31 117.35 118.64 3d2c s TYR 129 Ca 0.14 0.64 -0.02 0.00 -0.52 0.00 0.00 57.07 57.30 3d2c s TYR 129 Cb -0.12 0.32 -0.04 0.00 0.38 0.00 0.00 41.96 42.50 3d2c s TYR 129 CO 0.03 -0.58 0.04 0.45 -1.52 0.00 0.00 175.55 173.96 3d2c s SER 130 N -1.60 5.48 0.37 -0.18 0.15 -1.26 -0.98 113.70 115.68 3d2c s SER 130 Ca -0.09 0.18 0.27 0.00 0.70 0.00 0.00 55.95 57.02 3d2c s SER 130 Cb -0.01 -1.58 1.09 0.00 -1.71 0.00 0.00 66.02 63.81 3d2c s SER 130 CO 0.03 0.35 1.81 0.77 1.20 0.00 0.00 173.24 177.41 3d2c h SER 131 N 4.85 0.00 -0.64 5.45 4.64 -1.58 -2.36 113.55 123.91 3d2c h SER 131 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3d2c h SER 131 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3d2c h SER 131 CO 0.57 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.00 3d2c n ASP 132 N -2.59 3.80 -4.66 4.97 8.00 -1.26 -4.91 116.55 119.91 3d2c n ASP 132 Ca 0.02 -2.13 -0.43 0.00 0.71 0.00 0.00 54.79 52.97 3d2c n ASP 132 Cb 0.28 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 40.88 3d2c n ASP 132 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3d2c s ASP 133 N -0.95 6.87 0.01 -2.24 -1.08 -0.89 -4.65 116.67 113.75 3d2c s ASP 133 Ca 0.45 1.80 0.23 0.00 -0.52 0.00 0.00 52.55 54.51 3d2c s ASP 133 Cb 0.25 -2.54 0.17 0.00 -1.46 0.00 0.00 42.92 39.35 3d2c s ASP 133 CO 0.28 -0.81 1.16 0.23 0.52 0.00 0.00 175.17 176.55 3d2c n MET 134 N 6.76 0.08 -0.10 4.34 2.81 -1.26 -4.53 117.12 125.21 3d2c n MET 134 Ca 0.15 -0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.85 3d2c n MET 134 Cb 0.44 -1.53 -0.08 0.00 -0.71 0.00 0.00 33.22 31.35 3d2c n MET 134 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3d2c n ILE 135 N -1.63 1.50 -3.85 2.02 2.08 -1.26 -4.90 119.36 113.32 3d2c n ILE 135 Ca 0.04 -0.04 -0.36 0.00 0.56 0.00 0.00 62.75 62.95 3d2c n ILE 135 Cb 0.36 -2.12 -0.13 0.00 -0.75 0.00 0.00 39.64 37.00 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 -2.44 3.50 0.32 1.39 1.01 -1.26 -5.08 120.40 117.83 3d2c s VAL 136 Ca -0.28 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 3d2c s VAL 136 Cb 0.07 -2.76 -0.12 0.00 0.00 0.00 0.00 36.38 33.57 3d2c s VAL 136 CO 0.46 0.18 1.44 0.23 0.00 0.00 0.00 175.10 177.42 3d2c n MET 137 N 4.79 2.40 0.17 2.72 2.81 -1.26 -4.84 117.12 123.90 3d2c n MET 137 Ca -0.16 0.85 0.16 0.00 -1.81 0.00 0.00 57.70 56.74 3d2c n MET 137 Cb 0.48 -2.53 0.76 0.00 -0.71 0.00 0.00 33.22 31.22 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 3.60 0.00 -0.71 7.83 -0.26 -1.90 0.50 115.58 124.64 3d2c h ASN 138 Ca -0.47 0.00 0.05 0.00 -0.56 0.00 0.00 56.30 55.32 3d2c h ASN 138 Cb 1.26 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.47 3d2c h ASN 138 CO 0.70 0.00 0.47 0.22 -1.06 0.00 0.00 177.43 177.76 3d2c h TYR 139 N 0.00 0.78 0.00 1.19 5.03 -1.95 -1.15 116.97 120.87 3d2c h TYR 139 Ca 0.11 0.02 -0.15 0.00 2.58 0.00 0.00 58.73 61.29 3d2c h TYR 139 Cb 0.52 -0.26 -0.02 0.00 1.55 0.00 0.00 36.73 38.52 3d2c h TYR 139 CO 0.00 0.42 -0.70 -0.07 -1.32 0.00 0.00 178.16 176.49 3d2c h LEU 140 N 0.78 0.00 0.08 2.82 3.38 -1.20 -3.31 115.31 117.86 3d2c h LEU 140 Ca 0.30 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.00 3d2c h LEU 140 Cb 0.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 3d2c h LEU 140 CO -0.10 0.70 -1.22 0.28 0.09 0.00 0.00 178.44 178.20 3d2c h SER 141 N 0.00 0.55 -2.71 -0.43 0.02 -1.07 -0.16 113.55 109.75 3d2c h SER 141 Ca -0.01 -0.55 -0.52 0.00 -0.84 0.00 0.00 61.79 59.87 3d2c h SER 141 Cb 1.31 -0.17 0.04 0.00 0.14 0.00 0.00 62.40 63.71 3d2c h SER 141 CO 0.09 1.40 0.98 -0.13 -1.14 0.00 0.00 176.83 178.03 3d2c s ARG 142 N -2.80 4.17 -0.08 3.45 0.52 -0.54 -4.77 118.95 118.91 3d2c s ARG 142 Ca -0.05 2.47 0.04 0.00 -0.52 0.00 0.00 55.73 57.66 3d2c s ARG 142 Cb 0.07 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 32.24 3d2c s ARG 142 CO 0.89 -0.71 -0.20 -0.51 0.02 0.00 0.00 175.30 174.80 3d2c s LEU 143 N 1.68 2.36 -0.01 2.53 1.43 -1.26 -4.84 118.68 120.57 3d2c s LEU 143 Ca 0.74 -0.42 -0.30 0.00 -1.03 0.00 0.00 54.13 53.12 3d2c s LEU 143 Cb -0.45 -1.47 -0.06 0.00 0.03 0.00 0.00 46.19 44.24 3d2c s LEU 143 CO 0.32 0.23 1.51 -1.81 0.23 0.00 0.00 176.35 176.84 3d2c s ASP 144 N -0.05 6.75 0.00 2.29 1.01 0.72 -2.43 116.67 124.97 3d2c s ASP 144 Ca -0.05 2.21 0.00 0.00 0.71 0.00 0.00 52.55 55.41 3d2c s ASP 144 Cb -0.14 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.23 3d2c s ASP 144 CO 0.05 -0.81 0.00 0.61 0.21 0.00 0.00 175.17 175.22 3d2c n GLY 145 N 3.84 1.25 3.99 0.21 0.00 -1.26 -1.59 105.19 111.63 3d2c n GLY 145 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 3d2c n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d2c s ALA 146 N -2.30 4.15 -0.66 4.61 0.00 -1.02 -0.82 121.76 125.73 3d2c s ALA 146 Ca 0.00 -1.56 -0.22 0.00 0.00 0.00 0.00 51.96 50.18 3d2c s ALA 146 Cb 0.00 -1.87 0.08 0.00 0.00 0.00 0.00 23.12 21.33 3d2c s ALA 146 CO 0.00 -0.70 0.92 0.50 0.00 0.00 0.00 175.76 176.48 3d2c s ARG 147 N -4.67 3.12 -0.24 0.00 3.52 -0.87 -4.91 118.95 114.89 3d2c s ARG 147 Ca 0.58 -0.97 -0.18 0.00 -0.13 0.00 0.00 55.73 55.03 3d2c s ARG 147 Cb -0.09 -4.27 -0.03 0.00 -1.56 0.00 0.00 34.95 29.00 3d2c s ARG 147 CO 0.37 -1.76 0.51 -0.80 -0.81 0.00 0.00 175.30 172.82 3d2c s ASN 148 N 3.67 6.47 -0.21 -2.12 0.01 -1.26 -0.72 114.94 120.77 3d2c s ASN 148 Ca 0.20 0.56 0.02 0.00 -0.71 0.00 0.00 52.86 52.93 3d2c s ASN 148 Cb -0.18 -2.28 0.04 0.00 0.41 0.00 0.00 41.25 39.24 3d2c s ASN 148 CO 0.08 -0.26 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.57 3d2c s VAL 149 N 2.12 2.10 -0.09 1.60 1.01 0.25 -4.96 120.40 122.43 3d2c s VAL 149 Ca 0.22 -1.22 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 3d2c s VAL 149 Cb -0.16 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 3d2c s VAL 149 CO 0.09 0.31 0.29 -1.58 0.00 0.00 0.00 175.10 174.21 3d2c s GLN 150 N 1.21 3.89 0.43 2.72 0.74 -1.26 -2.03 119.66 125.36 3d2c s GLN 150 Ca -0.01 0.15 0.03 0.00 0.05 0.00 0.00 55.36 55.58 3d2c s GLN 150 Cb -0.16 -3.28 -0.03 0.00 1.10 0.00 0.00 33.01 30.65 3d2c s GLN 150 CO -0.10 0.57 0.08 0.96 -0.55 0.00 0.00 175.29 176.25 3d2c s ILE 151 N -0.56 0.89 0.09 -2.34 -4.36 -0.15 -4.97 121.20 109.80 3d2c s ILE 151 Ca 0.19 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.59 3d2c s ILE 151 Cb -0.14 -2.36 -0.04 0.00 1.25 0.00 0.00 42.46 41.17 3d2c s ILE 151 CO 0.07 0.00 -0.06 -1.00 0.24 0.00 0.00 174.94 174.19 3d2c s HIS 152 N -3.09 0.84 -0.47 1.37 3.76 -1.26 -1.51 115.29 114.92 3d2c s HIS 152 Ca 0.20 -0.91 0.00 0.00 -0.15 0.00 0.00 55.06 54.20 3d2c s HIS 152 Cb 0.03 -0.49 0.00 0.00 1.11 0.00 0.00 32.58 33.23 3d2c s HIS 152 CO 0.11 -0.17 0.00 0.41 -0.85 0.00 0.00 174.74 174.24 3d2c n GLY 153 N 0.06 0.73 3.10 -2.22 0.00 -1.26 -4.97 105.19 100.62 3d2c n GLY 153 Ca -0.13 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 44.83 3d2c n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d2c s VAL 154 N -2.16 1.20 0.74 1.61 1.01 -1.26 -5.07 120.40 116.47 3d2c s VAL 154 Ca 0.00 -0.60 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 3d2c s VAL 154 Cb 0.00 -1.04 0.08 0.00 0.00 0.00 0.00 36.38 35.42 3d2c s VAL 154 CO 0.00 0.35 1.06 -0.83 0.00 0.00 0.00 175.10 175.69 3d2c s GLY 155 N 0.01 1.68 0.14 4.51 0.00 -1.26 -3.94 107.32 108.46 3d2c s GLY 155 Ca -0.02 -0.93 -0.20 0.00 0.00 0.00 0.00 44.72 43.58 3d2c s GLY 155 CO 0.01 -0.47 1.68 0.84 0.00 0.00 0.00 173.10 175.16 3d2c h HIS 156 N -0.75 -0.23 0.00 1.90 2.76 -1.94 -1.85 115.15 115.03 3d2c h HIS 156 Ca -0.44 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 57.64 3d2c h HIS 156 Cb 1.31 0.14 -0.02 0.00 1.55 0.00 0.00 27.41 30.40 3d2c h HIS 156 CO 0.21 -0.16 -0.55 0.52 -1.30 0.00 0.00 177.93 176.65 3d2c h MET 157 N -0.05 0.00 0.00 5.26 2.86 -2.01 -3.12 114.93 117.87 3d2c h MET 157 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3d2c h MET 157 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 3d2c h MET 157 CO -0.30 0.55 0.00 0.78 1.06 0.00 0.00 176.91 179.01 3d2c h GLY 158 N 2.95 0.00 1.60 8.32 0.00 -1.75 -2.20 103.07 111.99 3d2c h GLY 158 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.37 3d2c h GLY 158 CO 0.07 0.00 0.16 1.41 0.00 0.00 0.00 176.54 178.18 3d2c h LEU 159 N 0.00 0.08 0.00 3.11 3.38 -1.30 -0.78 115.31 119.80 3d2c h LEU 159 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3d2c h LEU 159 Cb 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3d2c h LEU 159 CO 0.00 0.05 0.00 0.18 0.09 0.00 0.00 178.44 178.76 3d2c n LEU 160 N -4.49 0.00 -0.37 1.67 4.77 -0.83 -3.47 117.00 114.29 3d2c n LEU 160 Ca 0.02 0.50 0.01 0.00 -0.03 0.00 0.00 56.01 56.51 3d2c n LEU 160 Cb 0.25 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 40.86 3d2c n LEU 160 CO 0.35 -0.22 0.30 -1.22 -1.33 0.00 0.00 177.39 175.27 3d2c n TYR 161 N -1.50 0.00 -3.05 -1.77 4.01 -0.34 -4.33 117.16 110.18 3d2c n TYR 161 Ca 0.04 -0.15 -0.40 0.00 -0.16 0.00 0.00 57.90 57.23 3d2c n TYR 161 Cb 0.19 -0.06 -0.05 0.00 -0.31 0.00 0.00 39.34 39.11 3d2c n TYR 161 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3d2c s SER 162 N -1.13 6.96 0.25 7.72 0.15 -0.93 -4.95 113.70 121.77 3d2c s SER 162 Ca 0.04 1.15 -0.04 0.00 0.70 0.00 0.00 55.95 57.81 3d2c s SER 162 Cb 0.04 -2.41 0.36 0.00 -1.71 0.00 0.00 66.02 62.30 3d2c s SER 162 CO 0.00 -0.14 1.88 0.28 1.20 0.00 0.00 173.24 176.47 3d2c h SER 163 N 6.84 1.00 -0.01 5.45 0.02 -1.93 0.13 113.55 125.05 3d2c h SER 163 Ca -0.40 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.59 3d2c h SER 163 Cb 1.19 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.48 3d2c h SER 163 CO 0.76 0.65 -0.24 1.56 -1.14 0.00 0.00 176.83 178.42 3d2c h GLN 164 N 1.14 -0.36 -0.09 3.45 4.20 -1.98 -1.28 115.11 120.21 3d2c h GLN 164 Ca 0.40 0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.14 3d2c h GLN 164 Cb 0.11 0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 3d2c h GLN 164 CO -0.16 -0.24 0.06 0.28 -0.67 0.00 0.00 178.83 178.10 3d2c h VAL 165 N -0.37 1.03 -0.46 -0.54 2.07 -1.61 -2.42 116.25 113.94 3d2c h VAL 165 Ca 0.06 -0.07 0.09 0.00 0.82 0.00 0.00 66.70 67.61 3d2c h VAL 165 Cb 0.46 0.92 -0.09 0.00 -1.52 0.00 0.00 31.29 31.07 3d2c h VAL 165 CO -0.22 0.03 -0.10 1.88 0.02 0.00 0.00 177.57 179.17 3d2c h TYR 166 N 0.11 -0.22 -0.82 1.57 -1.99 -0.53 0.15 116.97 115.23 3d2c h TYR 166 Ca 0.03 0.04 0.09 0.00 2.00 0.00 0.00 58.73 60.90 3d2c h TYR 166 Cb -0.00 0.17 -0.07 0.00 2.00 0.00 0.00 36.73 38.83 3d2c h TYR 166 CO -0.07 -0.19 0.47 1.03 -0.00 0.00 0.00 178.16 179.40 3d2c h SER 167 N 0.01 0.67 0.62 3.88 0.87 -1.05 -0.95 113.55 117.60 3d2c h SER 167 Ca 0.22 0.05 -0.15 0.00 -1.23 0.00 0.00 61.79 60.68 3d2c h SER 167 Cb 0.34 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 3d2c h SER 167 CO -0.46 0.38 -0.69 -0.07 -0.53 0.00 0.00 176.83 175.47 3d2c h LEU 168 N 0.79 0.07 -0.39 2.23 3.38 -0.63 -2.88 115.31 117.88 3d2c h LEU 168 Ca 0.39 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.27 3d2c h LEU 168 Cb 0.36 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3d2c h LEU 168 CO -0.25 0.73 0.06 0.40 0.09 0.00 0.00 178.44 179.47 3d2c h ILE 169 N 0.04 1.24 -0.56 1.22 2.04 0.24 -0.95 117.51 120.79 3d2c h ILE 169 Ca -0.01 -0.88 0.05 0.00 1.00 0.00 0.00 64.86 65.02 3d2c h ILE 169 Cb 1.22 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 38.30 3d2c h ILE 169 CO 0.09 0.30 0.28 0.50 0.00 0.00 0.00 178.15 179.33 3d2c h LYS 170 N 0.50 0.53 -0.13 2.37 3.64 -1.14 0.24 116.57 122.58 3d2c h LYS 170 Ca 0.12 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3d2c h LYS 170 Cb 0.38 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3d2c h LYS 170 CO 0.01 0.35 0.06 0.93 -2.27 0.00 0.00 179.45 178.53 3d2c h GLU 171 N 0.54 0.18 -0.49 1.90 5.08 -1.29 -1.25 114.58 119.26 3d2c h GLU 171 Ca 0.25 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.62 3d2c h GLU 171 Cb 0.16 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 3d2c h GLU 171 CO -0.17 0.23 0.26 0.78 -1.00 0.00 0.00 179.01 179.10 3d2c h GLY 172 N 0.09 0.69 2.00 -3.84 0.00 -0.68 0.25 103.07 101.57 3d2c h GLY 172 Ca 0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 47.16 3d2c h GLY 172 CO -0.01 0.13 -0.14 1.41 0.00 0.00 0.00 176.54 177.93 3d2c h LEU 173 N 0.51 0.00 -2.88 3.11 3.38 -0.80 -1.58 115.31 117.04 3d2c h LEU 173 Ca 0.21 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.97 3d2c h LEU 173 Cb 0.10 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.73 3d2c h LEU 173 CO -0.14 0.14 0.26 0.59 0.09 0.00 0.00 178.44 179.38 3d2c n ASN 174 N -3.48 3.43 -0.36 -0.43 3.02 -0.49 -4.84 115.26 112.12 3d2c n ASN 174 Ca -0.01 -2.76 -0.05 0.00 -0.03 0.00 0.00 54.58 51.73 3d2c n ASN 174 Cb 0.30 -0.66 -0.02 0.00 -0.61 0.00 0.00 39.78 38.79 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 -0.20 0.69 0.91 7.41 0.00 -0.60 -4.93 105.19 108.48 3d2c n GLY 175 Ca 0.28 -0.85 0.03 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.34 1.71 0.00 -0.02 0.00 0.77 -4.85 105.19 100.46 3d2c n GLY 176 Ca -0.05 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 0.36 -0.25 3.42 -0.02 0.00 -1.26 -4.68 105.19 102.76 3d2c n GLY 177 Ca 0.10 -1.76 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 3d2c n GLY 177 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3d2c s GLN 178 N -1.31 1.19 -0.41 1.61 0.74 -0.46 -4.74 119.66 116.27 3d2c s GLN 178 Ca 0.00 -0.34 0.06 0.00 0.05 0.00 0.00 55.36 55.13 3d2c s GLN 178 Cb 0.00 0.55 0.18 0.00 1.10 0.00 0.00 33.01 34.84 3d2c s GLN 178 CO 0.00 -0.48 0.67 1.21 -0.55 0.00 0.00 175.29 176.14 3d2c s ASN 179 N -2.39 -1.43 -0.18 6.67 3.84 -1.02 -1.36 114.94 119.07 3d2c s ASN 179 Ca -0.02 -0.82 0.06 0.00 0.21 0.00 0.00 52.86 52.30 3d2c s ASN 179 Cb -0.00 1.83 0.45 0.00 -0.55 0.00 0.00 41.25 42.97 3d2c s ASN 179 CO -0.08 -0.15 1.32 0.35 -2.79 0.00 0.00 177.10 175.76 3d2c n THR 180 N 4.22 1.82 1.50 -5.21 -2.24 0.00 -5.01 114.28 109.36 3d2c n THR 180 Ca 0.11 -0.90 0.14 0.00 -2.27 0.00 0.00 64.05 61.13 3d2c n THR 180 Cb 0.57 -0.48 0.52 0.00 -2.10 0.00 0.00 70.33 68.85 3d2c n THR 180 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09