#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d2b s ASN 4 N 0.00 5.25 0.68 0.41 0.01 -1.26 -4.98 114.94 115.05 3d2b s ASN 4 Ca 0.00 1.79 -0.16 0.00 -0.71 0.00 0.00 52.86 53.77 3d2b s ASN 4 Cb 0.00 -2.52 0.01 0.00 0.41 0.00 0.00 41.25 39.15 3d2b s ASN 4 CO 0.00 -1.53 1.22 -2.84 -1.51 0.00 0.00 177.10 172.44 3d2b s PRO 5 N -4.57 2.44 -0.13 -0.60 0.02 -1.26 -4.65 135.00 126.26 3d2b s PRO 5 Ca 0.62 1.81 0.00 0.00 0.02 0.00 0.00 61.00 63.45 3d2b s PRO 5 Cb -0.16 -1.86 -0.01 0.00 0.02 0.00 0.00 34.50 32.48 3d2b s PRO 5 CO 0.48 -1.61 -0.14 0.08 -0.33 0.00 0.00 177.00 175.48 3d2b s VAL 6 N -1.81 3.01 -0.22 3.83 1.01 -0.30 -0.93 120.40 124.99 3d2b s VAL 6 Ca 0.76 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 62.02 3d2b s VAL 6 Cb -0.30 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 3d2b s VAL 6 CO 0.41 0.53 -0.02 -0.69 0.00 0.00 0.00 175.10 175.33 3d2b s VAL 7 N 0.33 3.62 -0.16 2.92 1.01 -0.06 0.12 120.40 128.18 3d2b s VAL 7 Ca -0.11 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 3d2b s VAL 7 Cb -0.16 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 3d2b s VAL 7 CO 0.06 0.41 0.05 -0.04 0.00 0.00 0.00 175.10 175.58 3d2b s MET 8 N 1.41 3.81 -0.24 2.72 -1.94 0.13 -1.80 119.30 123.39 3d2b s MET 8 Ca 0.05 -0.35 -0.00 0.00 -1.71 0.00 0.00 55.69 53.68 3d2b s MET 8 Cb -0.14 -3.14 0.03 0.00 2.01 0.00 0.00 34.83 33.58 3d2b s MET 8 CO -0.01 0.36 -0.09 0.08 -0.01 0.00 0.00 175.02 175.35 3d2b s VAL 9 N 0.12 2.62 0.81 -6.03 1.01 0.03 -1.94 120.40 117.02 3d2b s VAL 9 Ca 0.05 -1.09 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 3d2b s VAL 9 Cb -0.12 -2.32 0.08 0.00 0.00 0.00 0.00 36.38 34.01 3d2b s VAL 9 CO 0.01 0.23 1.15 -1.38 0.00 0.00 0.00 175.10 175.11 3d2b s HIS 10 N 1.29 2.93 0.00 5.22 -3.43 -1.26 -1.18 115.29 118.85 3d2b s HIS 10 Ca -0.00 0.86 0.00 0.00 -0.80 0.00 0.00 55.06 55.12 3d2b s HIS 10 Cb -0.16 -3.37 0.00 0.00 -1.43 0.00 0.00 32.58 27.62 3d2b s HIS 10 CO -0.06 -1.78 0.00 0.41 -2.00 0.00 0.00 174.74 171.31 3d2b n GLY 11 N -2.95 1.60 3.68 -1.38 0.00 -1.19 -3.33 105.19 101.62 3d2b n GLY 11 Ca 0.07 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 3d2b n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d2b s ILE 12 N 1.16 2.74 0.00 -0.61 1.01 -1.26 -1.30 121.20 122.94 3d2b s ILE 12 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.79 3d2b s ILE 12 Cb 0.00 -3.09 0.00 0.00 0.01 0.00 0.00 42.46 39.38 3d2b s ILE 12 CO 0.00 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.55 3d2b n GLY 13 N 4.24 0.77 0.01 6.18 0.00 -1.26 -5.01 105.19 110.13 3d2b n GLY 13 Ca 0.18 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.20 3d2b n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2b n GLY 14 N -2.10 -0.16 3.62 -0.02 0.00 -0.42 -5.13 105.19 100.98 3d2b n GLY 14 Ca 0.00 -1.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.11 3d2b n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d2b s ALA 15 N -3.37 -1.32 0.57 4.61 0.00 -1.26 -4.88 121.76 116.11 3d2b s ALA 15 Ca 0.00 0.03 0.26 0.00 0.00 0.00 0.00 51.96 52.25 3d2b s ALA 15 Cb -0.00 0.87 1.57 0.00 0.00 0.00 0.00 23.12 25.56 3d2b s ALA 15 CO 0.00 -0.89 2.12 0.66 0.00 0.00 0.00 175.76 177.66 3d2b h SER 16 N 2.04 0.00 0.12 0.00 4.64 -1.89 -0.56 113.55 117.90 3d2b h SER 16 Ca -0.27 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3d2b h SER 16 Cb 1.28 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3d2b h SER 16 CO 0.32 0.00 -0.00 0.77 -0.87 0.00 0.00 176.83 177.04 3d2b h SER 17 N 0.00 0.00 0.33 4.97 4.64 -1.95 -2.07 113.55 119.46 3d2b h SER 17 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 3d2b h SER 17 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3d2b h SER 17 CO -0.00 0.00 0.00 0.78 -0.87 0.00 0.00 176.83 176.74 3d2b h ASN 18 N 0.00 0.00 -0.52 4.97 2.35 -1.51 -2.44 115.58 118.43 3d2b h ASN 18 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3d2b h ASN 18 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 3d2b h ASN 18 CO 0.00 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.27 3d2b n PHE 19 N -2.69 0.69 -0.14 1.19 3.72 -0.78 -4.52 117.46 114.93 3d2b n PHE 19 Ca -0.01 -0.39 0.05 0.00 -0.05 0.00 0.00 57.45 57.05 3d2b n PHE 19 Cb 0.13 -0.00 0.35 0.00 -0.94 0.00 0.00 39.48 39.02 3d2b n PHE 19 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3d2b h ALA 20 N 3.94 1.66 -0.10 4.37 0.00 -1.60 0.12 119.26 127.65 3d2b h ALA 20 Ca 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3d2b h ALA 20 Cb 0.93 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3d2b h ALA 20 CO 0.00 0.27 -0.14 0.78 0.00 0.00 0.00 179.25 180.16 3d2b h GLY 21 N 0.75 0.30 0.91 0.00 0.00 -1.83 -1.92 103.07 101.28 3d2b h GLY 21 Ca 0.26 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.28 3d2b h GLY 21 CO -0.07 0.30 0.42 -2.22 0.00 0.00 0.00 176.54 174.97 3d2b h ILE 22 N -0.14 1.11 -0.32 2.60 2.04 -1.58 -0.80 117.51 120.41 3d2b h ILE 22 Ca 0.01 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 3d2b h ILE 22 Cb 0.68 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 3d2b h ILE 22 CO 0.03 0.15 0.17 0.11 0.00 0.00 0.00 178.15 178.62 3d2b h LYS 23 N 0.84 0.44 -0.84 2.37 1.57 -0.77 -0.56 116.57 119.62 3d2b h LYS 23 Ca 0.26 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.00 3d2b h LYS 23 Cb -0.01 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 3d2b h LYS 23 CO -0.09 0.37 0.56 1.03 -0.57 0.00 0.00 179.45 180.75 3d2b h SER 24 N 0.39 0.96 0.13 0.86 0.87 -0.98 -0.46 113.55 115.32 3d2b h SER 24 Ca 0.11 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 3d2b h SER 24 Cb 0.06 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 3d2b h SER 24 CO -0.02 0.69 -0.06 0.22 -0.53 0.00 0.00 176.83 177.13 3d2b h TYR 25 N 1.13 -0.16 -0.88 2.24 3.20 -0.80 -2.08 116.97 119.62 3d2b h TYR 25 Ca 0.31 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.22 3d2b h TYR 25 Cb -0.12 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.15 3d2b h TYR 25 CO -0.01 0.02 0.56 -0.07 -1.64 0.00 0.00 178.16 177.02 3d2b h LEU 26 N -0.32 0.90 -1.01 2.82 3.38 -0.79 -0.85 115.31 119.44 3d2b h LEU 26 Ca -0.02 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.98 3d2b h LEU 26 Cb 0.26 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 3d2b h LEU 26 CO 0.03 0.60 0.66 0.58 0.09 0.00 0.00 178.44 180.40 3d2b h VAL 27 N 1.05 1.21 0.00 1.22 2.07 -0.96 0.11 116.25 120.95 3d2b h VAL 27 Ca 0.37 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3d2b h VAL 27 Cb 0.09 -0.22 0.00 0.00 -1.52 0.00 0.00 31.29 29.64 3d2b h VAL 27 CO -0.14 0.24 0.00 0.77 0.02 0.00 0.00 177.57 178.45 3d2b h SER 28 N 1.31 0.00 -0.50 0.57 4.64 -0.45 -2.45 113.55 116.67 3d2b h SER 28 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3d2b h SER 28 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3d2b h SER 28 CO -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.85 3d2b n GLN 29 N -2.90 2.58 0.00 4.77 1.13 -0.09 -4.95 117.38 117.91 3d2b n GLN 29 Ca 0.00 -2.40 0.00 0.00 -1.94 0.00 0.00 57.00 52.66 3d2b n GLN 29 Cb 0.24 -1.54 0.00 0.00 0.11 0.00 0.00 30.24 29.05 3d2b n GLN 29 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3d2b n GLY 30 N 1.56 1.01 3.78 1.08 0.00 -0.92 -5.06 105.19 106.63 3d2b n GLY 30 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 3d2b n GLY 30 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3d2b s TRP 31 N -2.00 3.30 -0.14 1.61 0.51 -0.52 -4.98 118.94 116.72 3d2b s TRP 31 Ca 0.00 1.65 -0.27 0.00 -2.12 0.00 0.00 56.10 55.36 3d2b s TRP 31 Cb 0.00 -3.18 -0.01 0.00 -0.81 0.00 0.00 33.47 29.47 3d2b s TRP 31 CO 0.00 -0.67 0.91 -1.12 -0.51 0.00 0.00 176.95 175.56 3d2b s SER 32 N -1.41 7.09 0.29 2.95 0.01 -1.26 -4.14 113.70 117.23 3d2b s SER 32 Ca 0.55 1.34 0.03 0.00 1.31 0.00 0.00 55.95 59.19 3d2b s SER 32 Cb -0.25 -2.50 0.68 0.00 0.21 0.00 0.00 66.02 64.17 3d2b s SER 32 CO 0.31 -0.42 1.73 -0.09 0.41 0.00 0.00 173.24 175.19 3d2b h ARG 33 N 7.20 0.53 0.00 12.44 9.65 -1.94 0.11 114.38 142.37 3d2b h ARG 33 Ca -0.30 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.55 3d2b h ARG 33 Cb 1.14 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.60 3d2b h ARG 33 CO 0.85 0.35 0.00 -0.40 2.80 0.00 0.00 179.97 183.57 3d2b n ASP 34 N -4.93 0.00 -0.58 -3.80 5.75 -1.26 -2.46 116.55 109.27 3d2b n ASP 34 Ca 0.21 -1.25 0.06 0.00 -0.01 0.00 0.00 54.79 53.80 3d2b n ASP 34 Cb 0.58 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.83 3d2b n ASP 34 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3d2b n LYS 35 N -0.81 2.78 -4.03 0.11 4.76 0.37 -4.92 118.16 116.42 3d2b n LYS 35 Ca 0.13 -2.26 -0.34 0.00 -2.87 0.00 0.00 58.31 52.97 3d2b n LYS 35 Cb 0.06 -1.43 -0.15 0.00 -1.84 0.00 0.00 35.03 31.67 3d2b n LYS 35 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3d2b s LEU 36 N -1.72 2.63 0.13 -0.35 1.43 -1.03 -1.15 118.68 118.61 3d2b s LEU 36 Ca 0.27 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 52.98 3d2b s LEU 36 Cb 0.19 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.72 3d2b s LEU 36 CO 0.10 -0.00 -0.22 -0.31 0.23 0.00 0.00 176.35 176.15 3d2b s TYR 37 N 1.35 1.95 -0.05 0.29 1.51 0.12 -4.97 117.35 117.55 3d2b s TYR 37 Ca 0.04 -0.41 -0.01 0.00 -1.01 0.00 0.00 57.07 55.69 3d2b s TYR 37 Cb -0.14 -1.04 0.03 0.00 -0.11 0.00 0.00 41.96 40.70 3d2b s TYR 37 CO -0.06 0.28 0.00 0.00 -1.11 0.00 0.00 175.55 174.67 3d2b s ALA 38 N -1.33 0.50 0.68 3.71 0.00 -1.26 0.20 121.76 124.26 3d2b s ALA 38 Ca 0.11 0.03 -0.10 0.00 0.00 0.00 0.00 51.96 52.00 3d2b s ALA 38 Cb -0.09 -0.54 0.02 0.00 0.00 0.00 0.00 23.12 22.51 3d2b s ALA 38 CO 0.05 -0.27 1.05 0.54 0.00 0.00 0.00 175.76 177.13 3d2b s VAL 39 N 1.53 3.46 -0.08 0.00 0.11 -0.82 -4.85 120.40 119.74 3d2b s VAL 39 Ca -0.02 0.33 -0.01 0.00 -2.93 0.00 0.00 61.98 59.35 3d2b s VAL 39 Cb -0.13 -3.45 0.03 0.00 -1.53 0.00 0.00 36.38 31.30 3d2b s VAL 39 CO -0.03 -0.55 -0.02 -1.81 -3.33 0.00 0.00 175.10 169.35 3d2b s ASP 40 N -4.36 1.77 -0.01 3.54 1.01 -1.26 -3.89 116.67 113.46 3d2b s ASP 40 Ca 0.57 -0.15 -0.12 0.00 0.71 0.00 0.00 52.55 53.56 3d2b s ASP 40 Cb -0.11 -0.57 -0.05 0.00 1.01 0.00 0.00 42.92 43.20 3d2b s ASP 40 CO 0.50 -0.17 0.34 -0.36 0.21 0.00 0.00 175.17 175.69 3d2b s PHE 41 N 1.87 3.68 -0.07 4.23 0.08 -1.26 -4.99 117.98 121.51 3d2b s PHE 41 Ca 0.05 0.85 0.13 0.00 0.12 0.00 0.00 56.93 58.08 3d2b s PHE 41 Cb -0.12 -2.18 -0.09 0.00 -0.57 0.00 0.00 43.02 40.05 3d2b s PHE 41 CO -0.06 0.65 1.13 0.11 -0.10 0.00 0.00 175.22 176.95 3d2b h TRP 42 N 4.60 0.00 -2.58 0.36 5.08 -1.99 -3.44 115.95 117.98 3d2b h TRP 42 Ca -0.52 0.00 -0.55 0.00 1.08 0.00 0.00 58.89 58.91 3d2b h TRP 42 Cb 1.22 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 27.34 3d2b h TRP 42 CO 0.71 0.69 1.24 0.34 -1.28 0.00 0.00 178.44 180.14 3d2b s ASP 43 N -6.26 5.81 0.00 0.11 2.15 -1.26 -4.85 116.67 112.37 3d2b s ASP 43 Ca 0.00 0.74 0.09 0.00 0.43 0.00 0.00 52.55 53.81 3d2b s ASP 43 Cb 0.08 -2.53 0.41 0.00 -0.30 0.00 0.00 42.92 40.58 3d2b s ASP 43 CO 0.79 -1.87 1.26 0.29 -0.17 0.00 0.00 175.17 175.47 3d2b n LYS 44 N 8.65 0.04 0.00 4.34 4.76 -1.26 -1.48 118.16 133.21 3d2b n LYS 44 Ca 0.19 0.30 0.09 0.00 -2.87 0.00 0.00 58.31 56.03 3d2b n LYS 44 Cb 0.49 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 32.17 3d2b n LYS 44 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3d2b n THR 45 N -1.44 0.00 -4.05 -0.18 -2.24 -1.26 -4.09 114.28 101.02 3d2b n THR 45 Ca 0.03 -0.30 -0.33 0.00 -2.27 0.00 0.00 64.05 61.17 3d2b n THR 45 Cb 0.10 1.21 -0.00 0.00 -2.10 0.00 0.00 70.33 69.53 3d2b n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d2b n GLY 46 N 1.25 -0.47 3.78 3.38 0.00 -0.55 -4.95 105.19 107.63 3d2b n GLY 46 Ca 0.07 0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 3d2b n GLY 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d2b s THR 47 N -3.26 3.49 0.17 2.61 -4.23 -1.26 -4.86 115.64 108.30 3d2b s THR 47 Ca 0.70 0.56 -0.08 0.00 -1.18 0.00 0.00 61.69 61.70 3d2b s THR 47 Cb -0.37 -3.11 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 3d2b s THR 47 CO 0.86 -0.56 1.50 0.78 -0.54 0.00 0.00 174.62 176.67 3d2b h ASN 48 N -0.56 0.88 0.55 3.99 2.35 -1.93 -1.02 115.58 119.82 3d2b h ASN 48 Ca -0.45 -0.41 -0.02 0.00 -0.55 0.00 0.00 56.30 54.87 3d2b h ASN 48 Cb 1.23 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 39.35 3d2b h ASN 48 CO 0.54 1.17 -0.10 0.10 -1.65 0.00 0.00 177.43 177.49 3d2b h TYR 49 N 0.66 0.00 0.02 1.19 -0.00 -1.99 0.34 116.97 117.19 3d2b h TYR 49 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 58.73 58.46 3d2b h TYR 49 Cb 0.98 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.67 3d2b h TYR 49 CO 0.06 0.10 -1.74 0.09 -0.00 0.00 0.00 178.16 176.66 3d2b n ASN 50 N -3.41 1.93 0.09 0.10 3.02 -1.16 -4.51 115.26 111.31 3d2b n ASN 50 Ca -0.01 0.34 -0.08 0.00 -0.03 0.00 0.00 54.58 54.80 3d2b n ASN 50 Cb 0.26 -0.89 0.01 0.00 -0.61 0.00 0.00 39.78 38.55 3d2b n ASN 50 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 3d2b h ASN 51 N -0.79 0.22 -0.08 6.41 -0.26 -1.17 -3.32 115.58 116.58 3d2b h ASN 51 Ca -0.46 -0.17 0.04 0.00 -0.56 0.00 0.00 56.30 55.15 3d2b h ASN 51 Cb 1.52 -0.07 -0.06 0.00 -1.06 0.00 0.00 38.32 38.65 3d2b h ASN 51 CO -0.21 0.96 -0.42 1.23 -1.06 0.00 0.00 177.43 177.93 3d2b h GLY 52 N 1.91 -0.73 1.34 2.83 0.00 -0.50 0.58 103.07 108.49 3d2b h GLY 52 Ca -0.04 0.52 0.02 0.00 0.00 0.00 0.00 47.33 47.82 3d2b h GLY 52 CO 0.13 -0.23 0.42 -2.55 0.00 0.00 0.00 176.54 174.31 3d2b h PRO 53 N -0.52 0.81 -0.30 4.80 0.11 -1.77 0.09 132.00 135.22 3d2b h PRO 53 Ca 0.06 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.09 3d2b h PRO 53 Cb 0.63 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 3d2b h PRO 53 CO -0.37 0.53 0.05 0.28 -0.21 0.00 0.00 178.00 178.29 3d2b h VAL 54 N 0.83 1.23 -0.65 3.15 2.07 -1.49 -1.40 116.25 119.99 3d2b h VAL 54 Ca 0.24 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 3d2b h VAL 54 Cb -0.04 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 3d2b h VAL 54 CO -0.06 0.26 0.31 0.25 0.02 0.00 0.00 177.57 178.35 3d2b h LEU 55 N 0.31 0.85 -0.17 2.57 5.85 -0.39 -1.30 115.31 123.03 3d2b h LEU 55 Ca 0.09 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.72 3d2b h LEU 55 Cb 0.33 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 3d2b h LEU 55 CO 0.01 0.74 -0.09 -1.28 -0.34 0.00 0.00 178.44 177.48 3d2b h SER 56 N 0.89 -0.30 -0.37 1.25 0.87 -0.71 0.66 113.55 115.84 3d2b h SER 56 Ca 0.22 0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.77 3d2b h SER 56 Cb 0.12 0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 3d2b h SER 56 CO -0.03 -0.12 -0.07 0.03 -0.53 0.00 0.00 176.83 176.11 3d2b h ARG 57 N -0.08 0.79 -0.14 2.24 3.08 -1.07 -1.89 114.38 117.31 3d2b h ARG 57 Ca 0.10 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 3d2b h ARG 57 Cb 0.22 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 3d2b h ARG 57 CO -0.22 0.84 0.05 0.35 -1.07 0.00 0.00 179.97 179.93 3d2b h PHE 58 N 0.72 0.23 -0.55 3.04 3.57 -0.74 -1.76 116.94 121.45 3d2b h PHE 58 Ca 0.13 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 3d2b h PHE 58 Cb 0.54 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 3d2b h PHE 58 CO 0.03 0.33 0.34 0.28 -2.23 0.00 0.00 178.31 177.05 3d2b h VAL 59 N 0.06 1.16 -0.95 1.41 2.07 -0.77 -1.09 116.25 118.15 3d2b h VAL 59 Ca 0.05 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.22 3d2b h VAL 59 Cb 0.20 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.32 3d2b h VAL 59 CO -0.00 0.16 0.60 -0.61 0.02 0.00 0.00 177.57 177.75 3d2b h GLN 60 N 0.74 1.26 -0.66 1.57 5.75 -1.21 -0.36 115.11 122.21 3d2b h GLN 60 Ca 0.20 -0.09 -0.03 0.00 -0.15 0.00 0.00 58.65 58.57 3d2b h GLN 60 Cb -0.03 -0.28 -0.03 0.00 1.07 0.00 0.00 27.48 28.22 3d2b h GLN 60 CO -0.04 0.86 0.28 -0.22 -2.65 0.00 0.00 178.83 177.06 3d2b h LYS 61 N 1.29 0.97 -0.58 1.69 3.64 -0.90 -1.02 116.57 121.66 3d2b h LYS 61 Ca 0.34 -0.17 -0.04 0.00 -1.27 0.00 0.00 60.65 59.52 3d2b h LYS 61 Cb -0.11 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.52 3d2b h LYS 61 CO -0.07 0.80 0.20 0.28 -2.27 0.00 0.00 179.45 178.40 3d2b h VAL 62 N 0.92 1.24 -0.46 2.00 2.07 -0.41 0.01 116.25 121.62 3d2b h VAL 62 Ca 0.22 -0.77 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 3d2b h VAL 62 Cb 0.18 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 3d2b h VAL 62 CO -0.02 0.29 0.16 -0.07 0.02 0.00 0.00 177.57 177.95 3d2b h LEU 63 N 0.82 0.66 -0.70 2.57 3.38 -0.81 -0.82 115.31 120.41 3d2b h LEU 63 Ca 0.19 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 3d2b h LEU 63 Cb 0.25 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 3d2b h LEU 63 CO -0.01 0.68 0.26 0.44 0.09 0.00 0.00 178.44 179.90 3d2b h ASP 64 N 0.61 0.98 -0.15 -0.43 3.32 -0.95 0.15 116.42 119.95 3d2b h ASP 64 Ca 0.15 -0.18 -0.19 0.00 0.02 0.00 0.00 57.03 56.83 3d2b h ASP 64 Cb 0.24 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3d2b h ASP 64 CO -0.01 0.90 -0.63 -0.08 -1.72 0.00 0.00 179.24 177.71 3d2b h GLU 65 N 1.01 0.76 0.00 3.56 4.81 -0.84 -3.32 114.58 120.55 3d2b h GLU 65 Ca 0.23 -0.53 -0.20 0.00 -0.13 0.00 0.00 59.36 58.73 3d2b h GLU 65 Cb 0.24 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 3d2b h GLU 65 CO -0.02 1.15 -1.41 1.79 -0.73 0.00 0.00 179.01 179.79 3d2b h THR 66 N 0.56 0.70 0.00 0.32 1.35 -1.10 -3.48 112.91 111.26 3d2b h THR 66 Ca -0.01 -2.31 0.00 0.00 -0.55 0.00 0.00 66.41 63.54 3d2b h THR 66 Cb 1.23 2.23 0.00 0.00 -1.73 0.00 0.00 68.15 69.87 3d2b h THR 66 CO 0.13 0.40 0.00 0.61 -0.25 0.00 0.00 175.52 176.41 3d2b n GLY 67 N 1.43 0.57 3.85 5.82 0.00 0.50 -5.04 105.19 112.33 3d2b n GLY 67 Ca -0.10 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 3d2b n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d2b s ALA 68 N -2.00 3.04 0.04 4.61 0.00 -1.22 -4.99 121.76 121.24 3d2b s ALA 68 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.01 3d2b s ALA 68 Cb 0.00 -3.11 -0.26 0.00 0.00 0.00 0.00 23.12 19.76 3d2b s ALA 68 CO 0.00 -0.57 0.99 -0.22 0.00 0.00 0.00 175.76 175.96 3d2b h LYS 69 N 0.13 0.17 -3.86 0.00 3.64 -1.96 -3.46 116.57 111.23 3d2b h LYS 69 Ca -0.45 -0.29 -0.09 0.00 -1.27 0.00 0.00 60.65 58.55 3d2b h LYS 69 Cb 1.19 0.11 -0.14 0.00 -0.41 0.00 0.00 32.23 32.98 3d2b h LYS 69 CO 0.61 1.04 -0.38 0.15 -2.27 0.00 0.00 179.45 178.60 3d2b s LYS 70 N -2.64 0.90 0.31 1.90 1.02 -1.26 -4.78 119.74 115.18 3d2b s LYS 70 Ca -0.05 -1.03 0.10 0.00 0.02 0.00 0.00 55.97 55.01 3d2b s LYS 70 Cb 0.08 0.34 -0.05 0.00 -0.52 0.00 0.00 37.83 37.68 3d2b s LYS 70 CO 0.85 -0.29 -0.01 0.14 -0.92 0.00 0.00 175.35 175.11 3d2b s VAL 71 N -3.89 2.89 0.18 3.17 -7.23 -0.43 -4.24 120.40 110.85 3d2b s VAL 71 Ca 0.08 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.32 3d2b s VAL 71 Cb 0.05 -2.75 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 3d2b s VAL 71 CO -0.08 -0.28 0.08 -1.81 -0.31 0.00 0.00 175.10 172.70 3d2b s ASP 72 N -3.68 5.19 -0.02 4.85 1.01 -0.10 -1.47 116.67 122.44 3d2b s ASP 72 Ca 0.33 -0.26 0.04 0.00 0.71 0.00 0.00 52.55 53.37 3d2b s ASP 72 Cb -0.03 -1.25 -0.01 0.00 1.01 0.00 0.00 42.92 42.65 3d2b s ASP 72 CO 0.19 0.07 -0.13 -0.63 0.21 0.00 0.00 175.17 174.87 3d2b s ILE 73 N -1.80 1.07 -0.19 0.77 1.01 0.35 -0.88 121.20 121.54 3d2b s ILE 73 Ca 0.30 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.41 3d2b s ILE 73 Cb -0.09 -0.91 0.03 0.00 0.01 0.00 0.00 42.46 41.49 3d2b s ILE 73 CO 0.21 0.31 -0.18 -0.69 0.00 0.00 0.00 174.94 174.60 3d2b s VAL 74 N -0.13 2.00 0.05 2.92 1.01 -0.75 -0.44 120.40 125.06 3d2b s VAL 74 Ca 0.02 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.07 3d2b s VAL 74 Cb -0.07 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 3d2b s VAL 74 CO 0.00 0.45 -0.19 0.00 0.00 0.00 0.00 175.10 175.36 3d2b s ALA 75 N 1.29 1.61 -0.02 5.51 0.00 0.60 -0.79 121.76 129.97 3d2b s ALA 75 Ca 0.03 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.06 3d2b s ALA 75 Cb -0.14 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 3d2b s ALA 75 CO -0.12 0.35 -0.24 -1.58 0.00 0.00 0.00 175.76 174.17 3d2b s HIS 76 N -0.83 2.40 0.00 0.00 5.65 -0.33 -0.04 115.29 122.14 3d2b s HIS 76 Ca 0.06 -0.39 0.00 0.00 0.25 0.00 0.00 55.06 54.98 3d2b s HIS 76 Cb -0.09 -1.52 0.00 0.00 -1.18 0.00 0.00 32.58 29.80 3d2b s HIS 76 CO 0.02 0.01 0.00 0.45 -0.65 0.00 0.00 174.74 174.57 3d2b n SER 77 N 2.37 0.00 0.33 9.88 2.88 -0.63 -0.13 113.62 128.32 3d2b n SER 77 Ca -0.16 0.00 0.21 0.00 -1.33 0.00 0.00 58.87 57.59 3d2b n SER 77 Cb 0.51 0.00 1.11 0.00 -0.75 0.00 0.00 64.21 65.08 3d2b n SER 77 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 3d2b h MET 78 N 0.00 0.00 0.00 -1.46 1.85 -1.85 -0.06 114.93 113.41 3d2b h MET 78 Ca 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.07 3d2b h MET 78 Cb 0.00 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 32.03 3d2b h MET 78 CO 0.00 0.00 -0.08 0.78 -0.40 0.00 0.00 176.91 177.21 3d2b h GLY 79 N 0.36 0.00 0.91 1.39 0.00 -0.53 -0.82 103.07 104.38 3d2b h GLY 79 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3d2b h GLY 79 CO 0.00 0.00 0.03 -1.33 0.00 0.00 0.00 176.54 175.24 3d2b h GLY 80 N 0.37 0.63 1.20 4.60 0.00 -1.12 0.60 103.07 109.35 3d2b h GLY 80 Ca -0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 3d2b h GLY 80 CO 0.01 0.41 -0.05 0.00 0.00 0.00 0.00 176.54 176.91 3d2b h ALA 81 N 0.88 0.91 -0.50 3.60 0.00 -1.41 -1.71 119.26 121.02 3d2b h ALA 81 Ca 0.10 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3d2b h ALA 81 Cb 0.40 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3d2b h ALA 81 CO 0.01 0.64 0.15 -0.91 0.00 0.00 0.00 179.25 179.15 3d2b h ASN 82 N 0.87 0.73 -0.36 0.00 2.35 -0.97 -1.22 115.58 116.97 3d2b h ASN 82 Ca 0.15 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 3d2b h ASN 82 Cb 0.57 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 3d2b h ASN 82 CO 0.03 0.74 0.19 0.74 -1.65 0.00 0.00 177.43 177.49 3d2b h THR 83 N 0.68 1.15 -0.49 2.81 2.02 -0.69 -0.95 112.91 117.43 3d2b h THR 83 Ca 0.16 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 66.88 3d2b h THR 83 Cb 0.28 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.41 3d2b h THR 83 CO -0.00 0.15 0.02 -0.07 0.37 0.00 0.00 175.52 175.98 3d2b h LEU 84 N 0.46 0.78 -0.35 2.58 3.38 -1.18 -1.22 115.31 119.75 3d2b h LEU 84 Ca 0.13 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3d2b h LEU 84 Cb 0.07 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3d2b h LEU 84 CO -0.02 0.83 0.11 0.22 0.09 0.00 0.00 178.44 179.67 3d2b h TYR 85 N 0.76 0.57 -0.62 1.13 3.20 -0.97 0.11 116.97 121.14 3d2b h TYR 85 Ca 0.15 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.98 3d2b h TYR 85 Cb 0.44 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 3d2b h TYR 85 CO 0.02 0.55 0.39 -0.92 -1.64 0.00 0.00 178.16 176.57 3d2b h TYR 86 N 0.42 0.74 -0.11 -3.82 3.20 -0.88 0.18 116.97 116.70 3d2b h TYR 86 Ca 0.11 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 3d2b h TYR 86 Cb 0.25 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.27 3d2b h TYR 86 CO 0.01 0.44 -0.11 0.82 -1.64 0.00 0.00 178.16 177.68 3d2b h ILE 87 N 0.79 1.36 0.12 1.81 2.04 -0.98 -1.37 117.51 121.29 3d2b h ILE 87 Ca 0.24 -1.27 -0.21 0.00 1.00 0.00 0.00 64.86 64.62 3d2b h ILE 87 Cb -0.03 1.94 0.01 0.00 -0.74 0.00 0.00 36.82 38.00 3d2b h ILE 87 CO -0.08 0.36 -0.97 0.50 0.00 0.00 0.00 178.15 177.97 3d2b h LYS 88 N -0.12 0.26 0.00 2.37 3.64 -0.72 -2.62 116.57 119.37 3d2b h LYS 88 Ca 0.02 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 3d2b h LYS 88 Cb 0.63 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 3d2b h LYS 88 CO 0.03 1.21 -1.85 0.66 -2.27 0.00 0.00 179.45 177.23 3d2b n TYR 89 N -4.10 0.00 -0.73 1.91 4.02 0.60 -4.98 117.16 113.89 3d2b n TYR 89 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 3d2b n TYR 89 Cb 0.83 -0.43 0.00 0.00 -0.02 0.00 0.00 39.34 39.72 3d2b n TYR 89 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 3d2b n LEU 90 N -2.15 0.00 -1.63 7.72 4.77 -1.01 -5.02 117.00 119.68 3d2b n LEU 90 Ca -0.03 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.03 3d2b n LEU 90 Cb 0.53 0.00 0.36 0.00 -2.33 0.00 0.00 43.42 41.98 3d2b n LEU 90 CO 0.45 0.00 0.82 -0.90 -1.33 0.00 0.00 177.39 176.42 3d2b n ASP 91 N 0.00 4.87 0.07 -1.43 5.75 -1.21 -4.48 116.55 120.12 3d2b n ASP 91 Ca 0.00 -2.55 0.13 0.00 -0.01 0.00 0.00 54.79 52.35 3d2b n ASP 91 Cb 0.00 -0.60 0.47 0.00 -1.03 0.00 0.00 41.12 39.96 3d2b n ASP 91 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3d2b n GLY 92 N 0.98 -1.52 0.51 6.12 0.00 -0.55 -4.17 105.19 106.57 3d2b n GLY 92 Ca 0.25 -0.03 0.34 0.00 0.00 0.00 0.00 46.02 46.58 3d2b n GLY 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3d2b h GLY 93 N 4.10 0.32 -0.23 -0.02 0.00 -1.66 -1.63 103.07 103.95 3d2b h GLY 93 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3d2b h GLY 93 CO 0.00 -0.05 0.00 1.16 0.00 0.00 0.00 176.54 177.65 3d2b n ASN 94 N -4.29 2.45 -0.02 0.19 6.94 -1.26 -0.77 115.26 118.50 3d2b n ASN 94 Ca 0.27 -2.76 0.00 0.00 -0.02 0.00 0.00 54.58 52.07 3d2b n ASN 94 Cb 1.21 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 38.31 3d2b n ASN 94 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3d2b n LYS 95 N -1.02 0.29 -4.88 -3.83 5.02 -0.62 -4.90 118.16 108.23 3d2b n LYS 95 Ca 0.12 -0.84 -0.27 0.00 -2.02 0.00 0.00 58.31 55.31 3d2b n LYS 95 Cb 0.56 -1.01 -0.16 0.00 -0.02 0.00 0.00 35.03 34.40 3d2b n LYS 95 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3d2b s VAL 96 N -0.34 1.49 -0.13 -0.18 1.01 -1.21 -1.31 120.40 119.73 3d2b s VAL 96 Ca 0.01 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.09 3d2b s VAL 96 Cb 0.00 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 3d2b s VAL 96 CO 0.01 0.43 -0.28 0.00 0.00 0.00 0.00 175.10 175.25 3d2b n ALA 97 N 3.09 1.30 -2.75 5.51 0.00 -0.54 -4.72 120.51 122.40 3d2b n ALA 97 Ca -0.18 -0.66 -0.32 0.00 0.00 0.00 0.00 53.44 52.28 3d2b n ALA 97 Cb 0.53 0.07 -0.16 0.00 0.00 0.00 0.00 19.45 19.90 3d2b n ALA 97 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3d2b s ASN 98 N -5.94 3.40 -0.06 0.00 0.01 -1.26 -1.94 114.94 109.14 3d2b s ASN 98 Ca -0.23 -0.43 0.04 0.00 -0.71 0.00 0.00 52.86 51.53 3d2b s ASN 98 Cb 0.03 -0.98 -0.00 0.00 0.41 0.00 0.00 41.25 40.72 3d2b s ASN 98 CO 0.35 0.25 -0.18 -0.69 -1.51 0.00 0.00 177.10 175.31 3d2b s VAL 99 N -0.17 1.54 -0.09 1.60 1.01 0.03 -0.49 120.40 123.83 3d2b s VAL 99 Ca -0.02 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3d2b s VAL 99 Cb -0.14 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 34.93 3d2b s VAL 99 CO 0.04 0.44 -0.09 -0.69 0.00 0.00 0.00 175.10 174.80 3d2b s VAL 100 N 0.19 0.99 0.07 2.92 1.01 0.42 -0.91 120.40 125.10 3d2b s VAL 100 Ca -0.08 -0.33 0.07 0.00 0.00 0.00 0.00 61.98 61.64 3d2b s VAL 100 Cb -0.14 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 3d2b s VAL 100 CO 0.04 0.35 -0.13 0.42 0.00 0.00 0.00 175.10 175.77 3d2b s THR 101 N 1.26 3.14 -0.22 3.92 -4.23 -0.44 -0.29 115.64 118.78 3d2b s THR 101 Ca -0.04 -1.22 0.02 0.00 -1.18 0.00 0.00 61.69 59.27 3d2b s THR 101 Cb -0.14 -2.41 0.05 0.00 1.34 0.00 0.00 72.50 71.34 3d2b s THR 101 CO -0.03 0.22 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.39 3d2b s LEU 102 N -1.85 2.66 -1.45 4.79 1.43 0.94 -0.77 118.68 124.43 3d2b s LEU 102 Ca 0.18 -1.04 -0.11 0.00 -1.03 0.00 0.00 54.13 52.14 3d2b s LEU 102 Cb -0.11 -1.38 0.07 0.00 0.03 0.00 0.00 46.19 44.80 3d2b s LEU 102 CO 0.10 -0.14 0.73 0.61 0.23 0.00 0.00 176.35 177.88 3d2b n GLY 103 N 4.59 -0.50 3.76 -3.19 0.00 0.87 -1.60 105.19 109.11 3d2b n GLY 103 Ca -0.15 0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3d2b n GLY 103 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d2b s GLY 104 N -2.98 2.85 -0.62 -0.02 0.00 -1.26 -3.14 107.32 102.14 3d2b s GLY 104 Ca 0.51 1.10 -0.05 0.00 0.00 0.00 0.00 44.72 46.28 3d2b s GLY 104 CO 0.63 1.84 2.84 0.00 0.00 0.00 0.00 173.10 178.41 3d2b n ALA 105 N 1.52 6.58 -0.26 3.20 0.00 -0.60 -3.17 120.51 127.78 3d2b n ALA 105 Ca 0.02 -3.10 0.03 0.00 0.00 0.00 0.00 53.44 50.39 3d2b n ALA 105 Cb 0.43 -2.37 0.16 0.00 0.00 0.00 0.00 19.45 17.67 3d2b n ALA 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3d2b h ASN 106 N 3.44 0.44 0.06 0.00 2.35 -1.71 -2.40 115.58 117.75 3d2b h ASN 106 Ca 0.45 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 3d2b h ASN 106 Cb 0.74 0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.11 3d2b h ASN 106 CO 0.94 0.23 0.00 0.54 -1.65 0.00 0.00 177.43 177.49 3d2b n ARG 107 N -4.89 0.43 0.13 0.81 1.74 -0.18 -1.51 116.66 113.20 3d2b n ARG 107 Ca 0.13 0.03 0.13 0.00 -0.77 0.00 0.00 57.85 57.36 3d2b n ARG 107 Cb 0.33 -1.50 0.46 0.00 -1.02 0.00 0.00 32.46 30.73 3d2b n ARG 107 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3d2b h LEU 108 N 0.00 0.00 0.00 0.55 3.38 -1.71 -3.33 115.31 114.20 3d2b h LEU 108 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 3d2b h LEU 108 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3d2b h LEU 108 CO 0.00 0.00 -1.19 0.41 0.09 0.00 0.00 178.44 177.75 3d2b n THR 109 N -2.30 0.85 -3.44 0.22 -1.04 -0.57 -5.10 114.28 102.89 3d2b n THR 109 Ca 0.03 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.93 3d2b n THR 109 Cb 0.31 -1.73 -0.02 0.00 -1.82 0.00 0.00 70.33 67.07 3d2b n THR 109 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3d2b s THR 110 N -2.25 0.00 -2.03 12.58 -1.32 -0.93 -5.02 115.64 116.68 3d2b s THR 110 Ca -0.14 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.52 3d2b s THR 110 Cb 0.04 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.13 3d2b s THR 110 CO 0.18 0.00 1.01 0.61 -2.21 0.00 0.00 174.62 174.21 3d2b n GLY 111 N -0.22 0.25 3.26 6.08 0.00 -1.26 -3.40 105.19 109.89 3d2b n GLY 111 Ca -0.16 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 3d2b n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d2b s LYS 112 N -1.66 3.07 -0.20 1.61 3.01 -1.26 -0.73 119.74 123.58 3d2b s LYS 112 Ca 0.19 -0.84 -0.28 0.00 -1.01 0.00 0.00 55.97 54.03 3d2b s LYS 112 Cb 0.15 -2.36 -0.05 0.00 -1.01 0.00 0.00 37.83 34.55 3d2b s LYS 112 CO 0.29 0.21 2.21 0.00 0.51 0.00 0.00 175.35 178.57 3d2b n ALA 113 N 3.45 1.77 -1.68 5.17 0.00 -0.76 -4.88 120.51 123.59 3d2b n ALA 113 Ca -0.19 -0.22 -0.48 0.00 0.00 0.00 0.00 53.44 52.55 3d2b n ALA 113 Cb 0.53 -2.90 -0.05 0.00 0.00 0.00 0.00 19.45 17.03 3d2b n ALA 113 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3d2b n PRO 114 N 8.67 2.16 0.23 0.00 -0.02 -1.26 -4.87 135.00 139.91 3d2b n PRO 114 Ca 0.29 0.79 0.06 0.00 -2.02 0.00 0.00 63.50 62.63 3d2b n PRO 114 Cb 0.44 -2.63 0.52 0.00 -0.02 0.00 0.00 33.50 31.82 3d2b n PRO 114 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3d2b h PRO 115 N 8.82 0.00 0.00 0.52 0.11 -1.89 -3.41 132.00 136.14 3d2b h PRO 115 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3d2b h PRO 115 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3d2b h PRO 115 CO 0.94 0.20 0.00 0.41 -0.21 0.00 0.00 178.00 179.34 3d2b n GLY 116 N -0.89 -3.71 0.31 -0.55 0.00 -1.26 -1.68 105.19 97.42 3d2b n GLY 116 Ca -0.02 -2.02 0.04 0.00 0.00 0.00 0.00 46.02 44.02 3d2b n GLY 116 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d2b n THR 117 N -0.13 0.00 -2.16 2.61 -2.24 0.06 -4.96 114.28 107.46 3d2b n THR 117 Ca 0.00 -0.50 -0.43 0.00 -2.27 0.00 0.00 64.05 60.86 3d2b n THR 117 Cb 0.00 1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 69.37 3d2b n THR 117 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3d2b s ASP 118 N -0.68 6.47 0.27 3.42 -1.08 -1.24 -4.89 116.67 118.93 3d2b s ASP 118 Ca 0.09 1.62 -0.05 0.00 -0.52 0.00 0.00 52.55 53.70 3d2b s ASP 118 Cb 0.07 -2.53 0.52 0.00 -1.46 0.00 0.00 42.92 39.52 3d2b s ASP 118 CO 0.10 -1.18 1.60 -0.65 0.52 0.00 0.00 175.17 175.56 3d2b h PRO 119 N 10.32 0.05 -0.01 4.34 0.11 -1.97 -2.97 132.00 141.87 3d2b h PRO 119 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3d2b h PRO 119 Cb 1.15 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3d2b h PRO 119 CO 1.00 0.03 -0.07 0.09 -0.21 0.00 0.00 178.00 178.84 3d2b n ASN 120 N -5.44 1.73 -3.91 -2.05 3.02 -1.26 -4.89 115.26 102.46 3d2b n ASN 120 Ca 0.17 -1.37 -0.31 0.00 -0.03 0.00 0.00 54.58 53.04 3d2b n ASN 120 Cb 0.55 0.15 -0.15 0.00 -0.61 0.00 0.00 39.78 39.72 3d2b n ASN 120 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3d2b s GLN 121 N -1.10 1.19 0.28 3.52 0.74 -1.12 -5.10 119.66 118.08 3d2b s GLN 121 Ca 0.12 -1.54 -0.29 0.00 0.05 0.00 0.00 55.36 53.69 3d2b s GLN 121 Cb 0.09 -2.72 -0.09 0.00 1.10 0.00 0.00 33.01 31.39 3d2b s GLN 121 CO 0.18 -0.95 1.07 0.21 -0.55 0.00 0.00 175.29 175.26 3d2b s LYS 122 N 1.19 4.63 0.17 1.67 2.20 -1.26 -4.45 119.74 123.89 3d2b s LYS 122 Ca 0.10 1.74 -0.30 0.00 -0.36 0.00 0.00 55.97 57.15 3d2b s LYS 122 Cb -0.18 -3.15 -0.08 0.00 -1.51 0.00 0.00 37.83 32.91 3d2b s LYS 122 CO -0.15 0.23 1.18 0.42 -0.36 0.00 0.00 175.35 176.67 3d2b s ILE 123 N -1.20 3.66 -0.10 5.43 1.01 -0.68 -5.01 121.20 124.31 3d2b s ILE 123 Ca 0.45 1.38 -0.06 0.00 0.00 0.00 0.00 60.65 62.42 3d2b s ILE 123 Cb -0.30 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 3d2b s ILE 123 CO 0.39 0.21 0.13 -0.76 0.00 0.00 0.00 174.94 174.91 3d2b s LEU 124 N -0.11 4.31 0.04 2.97 1.43 -0.82 -4.64 118.68 121.87 3d2b s LEU 124 Ca 0.53 0.42 0.06 0.00 -1.03 0.00 0.00 54.13 54.11 3d2b s LEU 124 Cb -0.32 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.76 3d2b s LEU 124 CO 0.35 0.39 -0.17 -0.31 0.23 0.00 0.00 176.35 176.84 3d2b s TYR 125 N -1.06 1.51 -0.10 0.29 1.51 0.27 -0.79 117.35 118.98 3d2b s TYR 125 Ca 0.17 -0.36 -0.01 0.00 -1.01 0.00 0.00 57.07 55.85 3d2b s TYR 125 Cb -0.12 -0.90 0.03 0.00 -0.11 0.00 0.00 41.96 40.86 3d2b s TYR 125 CO 0.06 0.07 -0.03 0.99 -1.11 0.00 0.00 175.55 175.52 3d2b s THR 126 N -0.83 0.71 -0.29 -0.71 2.01 -0.09 -1.06 115.64 115.38 3d2b s THR 126 Ca 0.04 -0.14 -0.05 0.00 0.31 0.00 0.00 61.69 61.86 3d2b s THR 126 Cb -0.08 -0.83 0.03 0.00 0.01 0.00 0.00 72.50 71.63 3d2b s THR 126 CO 0.02 0.27 0.04 -0.55 -0.69 0.00 0.00 174.62 173.70 3d2b s SER 127 N 1.83 4.92 -0.16 3.53 0.15 -0.06 -1.33 113.70 122.58 3d2b s SER 127 Ca 0.04 -0.92 -0.07 0.00 0.70 0.00 0.00 55.95 55.71 3d2b s SER 127 Cb -0.13 -1.80 -0.04 0.00 -1.71 0.00 0.00 66.02 62.34 3d2b s SER 127 CO -0.07 -0.21 0.07 -0.63 1.20 0.00 0.00 173.24 173.60 3d2b s ILE 128 N 1.40 4.85 -0.01 6.45 1.01 0.05 -0.53 121.20 134.42 3d2b s ILE 128 Ca -0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 60.65 60.46 3d2b s ILE 128 Cb -0.18 -3.16 0.03 0.00 0.01 0.00 0.00 42.46 39.16 3d2b s ILE 128 CO 0.00 0.50 0.38 -0.72 0.00 0.00 0.00 174.94 175.10 3d2b s TYR 129 N 0.00 -0.26 -0.11 3.97 -0.85 -0.70 -0.09 117.35 119.31 3d2b s TYR 129 Ca 0.06 0.37 -0.00 0.00 -0.52 0.00 0.00 57.07 56.98 3d2b s TYR 129 Cb -0.12 0.16 -0.02 0.00 0.38 0.00 0.00 41.96 42.35 3d2b s TYR 129 CO 0.01 -0.45 -0.08 0.45 -1.52 0.00 0.00 175.55 173.95 3d2b s SER 130 N -1.43 4.46 0.00 -0.18 0.15 -1.26 -1.01 113.70 114.43 3d2b s SER 130 Ca -0.12 -0.15 0.10 0.00 0.70 0.00 0.00 55.95 56.48 3d2b s SER 130 Cb -0.04 -1.43 0.47 0.00 -1.71 0.00 0.00 66.02 63.31 3d2b s SER 130 CO 0.04 0.25 1.21 -1.54 1.20 0.00 0.00 173.24 174.40 3d2b n SER 131 N 2.96 0.00 -1.38 5.45 3.41 -0.45 -1.16 113.62 122.45 3d2b n SER 131 Ca -0.18 0.22 0.09 0.00 -0.26 0.00 0.00 58.87 58.74 3d2b n SER 131 Cb 0.53 -0.33 0.32 0.00 -0.26 0.00 0.00 64.21 64.47 3d2b n SER 131 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d2b n ASP 132 N -1.33 4.48 -4.61 4.04 8.00 -1.26 -4.91 116.55 120.96 3d2b n ASP 132 Ca 0.04 -2.53 -0.43 0.00 0.71 0.00 0.00 54.79 52.58 3d2b n ASP 132 Cb 0.08 -0.54 -0.02 0.00 -0.02 0.00 0.00 41.12 40.62 3d2b n ASP 132 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3d2b s ASP 133 N -1.09 6.75 0.00 -2.24 -1.08 -0.31 -4.56 116.67 114.14 3d2b s ASP 133 Ca 0.46 0.70 0.27 0.00 -0.52 0.00 0.00 52.55 53.46 3d2b s ASP 133 Cb 0.31 -2.53 0.88 0.00 -1.46 0.00 0.00 42.92 40.12 3d2b s ASP 133 CO 0.20 -1.04 1.65 0.23 0.52 0.00 0.00 175.17 176.73 3d2b n MET 134 N 7.28 1.80 -0.11 4.34 2.81 -1.26 -4.38 117.12 127.60 3d2b n MET 134 Ca 0.11 -1.16 -0.21 0.00 -1.81 0.00 0.00 57.70 54.63 3d2b n MET 134 Cb 0.48 -1.47 -0.08 0.00 -0.71 0.00 0.00 33.22 31.43 3d2b n MET 134 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3d2b n ILE 135 N 0.41 1.19 -4.01 2.02 5.41 -1.26 -4.93 119.36 118.20 3d2b n ILE 135 Ca 0.18 -0.35 -0.34 0.00 1.00 0.00 0.00 62.75 63.25 3d2b n ILE 135 Cb 0.40 -1.63 -0.15 0.00 -0.71 0.00 0.00 39.64 37.56 3d2b n ILE 135 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3d2b s VAL 136 N -2.40 2.62 0.36 1.39 1.01 -1.26 -5.09 120.40 117.02 3d2b s VAL 136 Ca -0.30 -1.09 -0.28 0.00 0.00 0.00 0.00 61.98 60.31 3d2b s VAL 136 Cb 0.10 -2.32 -0.11 0.00 0.00 0.00 0.00 36.38 34.06 3d2b s VAL 136 CO 0.41 0.23 1.43 -0.04 0.00 0.00 0.00 175.10 177.13 3d2b s MET 137 N 1.29 4.19 0.37 2.72 -1.94 -1.26 -4.82 119.30 119.85 3d2b s MET 137 Ca -0.00 2.45 0.11 0.00 -1.71 0.00 0.00 55.69 56.54 3d2b s MET 137 Cb -0.16 -3.01 0.88 0.00 2.01 0.00 0.00 34.83 34.55 3d2b s MET 137 CO -0.06 -0.42 1.86 -0.91 -0.01 0.00 0.00 175.02 175.48 3d2b h ASN 138 N 3.23 0.60 0.30 3.03 -0.26 -1.88 -1.29 115.58 119.32 3d2b h ASN 138 Ca -0.50 0.05 -0.02 0.00 -0.56 0.00 0.00 56.30 55.27 3d2b h ASN 138 Cb 1.23 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 38.42 3d2b h ASN 138 CO 0.65 0.28 -0.09 0.10 -1.06 0.00 0.00 177.43 177.32 3d2b h TYR 139 N 0.63 0.00 0.00 1.19 -0.00 -1.95 -0.66 116.97 116.18 3d2b h TYR 139 Ca 0.46 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 59.12 3d2b h TYR 139 Cb 0.84 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.56 3d2b h TYR 139 CO -0.00 0.09 -0.36 -0.07 -0.00 0.00 0.00 178.16 177.82 3d2b h LEU 140 N 0.00 0.00 0.06 0.10 3.38 -1.56 -3.25 115.31 114.04 3d2b h LEU 140 Ca -0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 3d2b h LEU 140 Cb 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3d2b h LEU 140 CO 0.01 0.36 -1.42 0.28 0.09 0.00 0.00 178.44 177.76 3d2b h SER 141 N 0.00 0.19 -2.89 -0.43 0.02 -1.10 -0.33 113.55 109.00 3d2b h SER 141 Ca -0.00 -0.26 -0.52 0.00 -0.84 0.00 0.00 61.79 60.16 3d2b h SER 141 Cb 1.14 -0.06 0.06 0.00 0.14 0.00 0.00 62.40 63.68 3d2b h SER 141 CO 0.05 1.22 0.96 -0.13 -1.14 0.00 0.00 176.83 177.78 3d2b s ARG 142 N -2.64 4.14 -0.12 3.45 0.52 -0.75 -4.74 118.95 118.80 3d2b s ARG 142 Ca -0.05 2.56 0.03 0.00 -0.52 0.00 0.00 55.73 57.75 3d2b s ARG 142 Cb 0.08 -3.07 0.01 0.00 0.52 0.00 0.00 34.95 32.49 3d2b s ARG 142 CO 0.84 -0.69 -0.23 -0.51 0.02 0.00 0.00 175.30 174.73 3d2b s LEU 143 N 0.66 2.09 0.14 2.53 1.43 -1.26 -4.79 118.68 119.48 3d2b s LEU 143 Ca 0.71 -0.58 -0.31 0.00 -1.03 0.00 0.00 54.13 52.91 3d2b s LEU 143 Cb -0.48 -1.42 -0.11 0.00 0.03 0.00 0.00 46.19 44.21 3d2b s LEU 143 CO 0.37 0.11 1.81 -1.81 0.23 0.00 0.00 176.35 177.06 3d2b s ASP 144 N 0.63 6.41 0.00 2.29 1.01 0.09 -1.78 116.67 125.32 3d2b s ASP 144 Ca -0.12 2.78 0.00 0.00 0.71 0.00 0.00 52.55 55.93 3d2b s ASP 144 Cb -0.16 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.19 3d2b s ASP 144 CO 0.02 -1.00 0.00 0.61 0.21 0.00 0.00 175.17 175.01 3d2b n GLY 145 N 4.19 3.31 3.90 0.21 0.00 -1.26 -1.82 105.19 113.73 3d2b n GLY 145 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 3d2b n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d2b s ALA 146 N -2.46 2.85 -0.63 4.61 0.00 -0.73 -0.52 121.76 124.86 3d2b s ALA 146 Ca 0.00 -0.66 -0.23 0.00 0.00 0.00 0.00 51.96 51.07 3d2b s ALA 146 Cb 0.00 -2.87 0.06 0.00 0.00 0.00 0.00 23.12 20.31 3d2b s ALA 146 CO 0.00 -1.44 0.97 0.50 0.00 0.00 0.00 175.76 175.79 3d2b s ARG 147 N -5.43 3.17 -0.30 0.00 3.52 -0.23 -4.85 118.95 114.83 3d2b s ARG 147 Ca 0.60 -0.65 -0.21 0.00 -0.13 0.00 0.00 55.73 55.35 3d2b s ARG 147 Cb -0.11 -4.18 -0.01 0.00 -1.56 0.00 0.00 34.95 29.10 3d2b s ARG 147 CO 0.48 -1.74 0.66 -0.80 -0.81 0.00 0.00 175.30 173.09 3d2b s ASN 148 N 3.45 6.53 -0.19 -2.12 0.01 -1.26 -0.88 114.94 120.48 3d2b s ASN 148 Ca 0.25 0.48 -0.01 0.00 -0.71 0.00 0.00 52.86 52.87 3d2b s ASN 148 Cb -0.15 -2.34 0.01 0.00 0.41 0.00 0.00 41.25 39.17 3d2b s ASN 148 CO 0.13 -0.50 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.39 3d2b s VAL 149 N 2.66 2.59 -0.15 1.60 1.01 0.30 -4.97 120.40 123.46 3d2b s VAL 149 Ca 0.26 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 3d2b s VAL 149 Cb -0.15 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.06 3d2b s VAL 149 CO 0.12 0.50 0.07 -1.58 0.00 0.00 0.00 175.10 174.21 3d2b s GLN 150 N 1.29 3.63 0.41 2.72 0.74 -1.26 -1.71 119.66 125.49 3d2b s GLN 150 Ca 0.04 -0.29 0.04 0.00 0.05 0.00 0.00 55.36 55.20 3d2b s GLN 150 Cb -0.14 -3.13 -0.02 0.00 1.10 0.00 0.00 33.01 30.82 3d2b s GLN 150 CO -0.08 0.51 0.16 0.96 -0.55 0.00 0.00 175.29 176.29 3d2b s ILE 151 N -0.28 0.46 0.28 -2.34 -4.36 -0.18 -4.98 121.20 109.79 3d2b s ILE 151 Ca 0.09 -2.00 -0.06 0.00 -0.26 0.00 0.00 60.65 58.42 3d2b s ILE 151 Cb -0.12 -2.31 -0.01 0.00 1.25 0.00 0.00 42.46 41.27 3d2b s ILE 151 CO 0.01 0.00 0.40 -1.38 0.24 0.00 0.00 174.94 174.21 3d2b s HIS 152 N -3.20 0.84 -0.07 1.37 -3.43 -1.26 -1.34 115.29 108.20 3d2b s HIS 152 Ca 0.24 -1.11 0.00 0.00 -0.80 0.00 0.00 55.06 53.39 3d2b s HIS 152 Cb 0.02 -0.10 0.00 0.00 -1.43 0.00 0.00 32.58 31.06 3d2b s HIS 152 CO 0.16 -0.97 0.00 0.41 -2.00 0.00 0.00 174.74 172.35 3d2b n GLY 153 N -0.43 0.47 2.97 -1.38 0.00 -1.26 -4.99 105.19 100.58 3d2b n GLY 153 Ca 0.00 -0.25 -0.18 0.00 0.00 0.00 0.00 46.02 45.59 3d2b n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d2b s VAL 154 N -1.94 0.59 0.82 1.61 1.01 -1.26 -5.11 120.40 116.12 3d2b s VAL 154 Ca 0.00 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.61 3d2b s VAL 154 Cb 0.00 -0.52 0.13 0.00 0.00 0.00 0.00 36.38 35.99 3d2b s VAL 154 CO 0.00 0.18 1.15 -0.83 0.00 0.00 0.00 175.10 175.60 3d2b s GLY 155 N 0.08 1.73 0.10 4.51 0.00 -1.26 -4.15 107.32 108.33 3d2b s GLY 155 Ca -0.01 -1.17 -0.29 0.00 0.00 0.00 0.00 44.72 43.25 3d2b s GLY 155 CO -0.00 -0.58 1.63 0.84 0.00 0.00 0.00 173.10 174.98 3d2b h HIS 156 N -1.04 -0.83 0.00 1.90 2.76 -1.93 -2.26 115.15 113.75 3d2b h HIS 156 Ca -0.43 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 57.70 3d2b h HIS 156 Cb 1.28 0.33 -0.01 0.00 1.55 0.00 0.00 27.41 30.56 3d2b h HIS 156 CO -0.36 -0.43 -0.26 0.52 -1.30 0.00 0.00 177.93 176.10 3d2b h MET 157 N -0.60 0.00 0.00 5.26 2.86 -2.00 -3.01 114.93 117.45 3d2b h MET 157 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3d2b h MET 157 Cb 0.57 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 3d2b h MET 157 CO -0.11 0.26 -0.00 0.78 1.06 0.00 0.00 176.91 178.90 3d2b h GLY 158 N 2.48 0.00 1.73 8.32 0.00 -1.79 -2.57 103.07 111.24 3d2b h GLY 158 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 3d2b h GLY 158 CO 0.03 0.00 0.14 1.41 0.00 0.00 0.00 176.54 178.12 3d2b h LEU 159 N 0.00 0.15 -1.82 3.11 3.38 -1.31 -1.92 115.31 116.90 3d2b h LEU 159 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3d2b h LEU 159 Cb 0.28 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 3d2b h LEU 159 CO 0.00 0.11 -0.12 -0.07 0.09 0.00 0.00 178.44 178.45 3d2b h LEU 160 N 0.18 0.00 -2.73 1.67 3.38 -1.68 -3.19 115.31 112.95 3d2b h LEU 160 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 3d2b h LEU 160 Cb 0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3d2b h LEU 160 CO -0.01 0.12 -0.17 -1.22 0.09 0.00 0.00 178.44 177.25 3d2b n TYR 161 N -3.52 0.00 -3.01 1.13 4.01 -0.77 -4.10 117.16 110.90 3d2b n TYR 161 Ca -0.01 -0.74 -0.40 0.00 -0.16 0.00 0.00 57.90 56.59 3d2b n TYR 161 Cb 0.26 -0.13 -0.05 0.00 -0.31 0.00 0.00 39.34 39.12 3d2b n TYR 161 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3d2b s SER 162 N -2.36 6.89 0.40 7.72 0.15 -0.93 -4.95 113.70 120.61 3d2b s SER 162 Ca 0.23 1.08 0.07 0.00 0.70 0.00 0.00 55.95 58.04 3d2b s SER 162 Cb 0.21 -2.41 0.81 0.00 -1.71 0.00 0.00 66.02 62.92 3d2b s SER 162 CO 0.02 -0.27 2.00 0.77 1.20 0.00 0.00 173.24 176.96 3d2b h SER 163 N 7.19 0.42 -0.38 5.45 4.64 -1.92 0.15 113.55 129.11 3d2b h SER 163 Ca -0.34 -0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 60.86 3d2b h SER 163 Cb 1.16 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 3d2b h SER 163 CO 0.79 0.38 -0.10 -0.61 -0.87 0.00 0.00 176.83 176.42 3d2b h GLN 164 N 0.48 0.74 -0.55 4.77 4.15 -1.97 -2.49 115.11 120.23 3d2b h GLN 164 Ca 0.12 -0.29 -0.04 0.00 0.77 0.00 0.00 58.65 59.22 3d2b h GLN 164 Cb 0.09 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 3d2b h GLN 164 CO -0.01 0.89 0.20 0.28 -1.93 0.00 0.00 178.83 178.25 3d2b h VAL 165 N 0.54 1.23 -0.56 2.39 2.07 -1.62 -2.66 116.25 117.64 3d2b h VAL 165 Ca 0.09 -0.74 0.11 0.00 0.82 0.00 0.00 66.70 66.99 3d2b h VAL 165 Cb 0.62 0.68 -0.09 0.00 -1.52 0.00 0.00 31.29 30.98 3d2b h VAL 165 CO 0.04 0.28 0.00 1.88 0.02 0.00 0.00 177.57 179.79 3d2b h TYR 166 N 0.75 -0.04 -0.91 1.57 0.05 -0.56 0.07 116.97 117.90 3d2b h TYR 166 Ca 0.18 0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 3d2b h TYR 166 Cb 0.24 0.10 -0.04 0.00 1.01 0.00 0.00 36.73 38.04 3d2b h TYR 166 CO 0.01 -0.14 0.55 0.77 -1.05 0.00 0.00 178.16 178.31 3d2b h SER 167 N 0.12 1.10 0.20 3.88 0.02 -1.15 -1.97 113.55 115.75 3d2b h SER 167 Ca 0.29 -0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 61.03 3d2b h SER 167 Cb 0.44 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 3d2b h SER 167 CO -0.47 0.84 -0.51 -0.07 -1.14 0.00 0.00 176.83 175.48 3d2b h LEU 168 N 1.26 0.38 -0.38 5.07 3.38 -0.91 -2.41 115.31 121.70 3d2b h LEU 168 Ca 0.33 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3d2b h LEU 168 Cb -0.05 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3d2b h LEU 168 CO -0.06 0.82 0.11 0.40 0.09 0.00 0.00 178.44 179.81 3d2b h ILE 169 N 0.27 1.22 -0.56 1.22 2.04 -0.60 -1.65 117.51 119.45 3d2b h ILE 169 Ca 0.01 -0.71 0.05 0.00 1.00 0.00 0.00 64.86 65.20 3d2b h ILE 169 Cb 0.99 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 3d2b h ILE 169 CO 0.08 0.25 0.29 0.50 0.00 0.00 0.00 178.15 179.28 3d2b h LYS 170 N 0.47 0.55 -0.71 2.37 3.64 -1.20 0.70 116.57 122.39 3d2b h LYS 170 Ca 0.12 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3d2b h LYS 170 Cb 0.27 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 3d2b h LYS 170 CO -0.00 0.36 0.43 0.93 -2.27 0.00 0.00 179.45 178.90 3d2b h GLU 171 N 0.57 0.96 -0.31 1.90 5.08 -1.13 -1.57 114.58 120.09 3d2b h GLU 171 Ca 0.24 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3d2b h GLU 171 Cb 0.13 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3d2b h GLU 171 CO -0.16 0.68 0.05 0.78 -1.00 0.00 0.00 179.01 179.37 3d2b h GLY 172 N 0.96 0.54 2.00 -3.84 0.00 -0.61 0.13 103.07 102.25 3d2b h GLY 172 Ca 0.25 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 3d2b h GLY 172 CO -0.05 0.33 -0.00 1.41 0.00 0.00 0.00 176.54 178.23 3d2b h LEU 173 N 0.33 0.00 -2.38 3.11 3.38 -0.66 -0.77 115.31 118.32 3d2b h LEU 173 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3d2b h LEU 173 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 3d2b h LEU 173 CO 0.01 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.13 3d2b n ASN 174 N -3.10 3.60 0.00 -0.43 3.02 -0.61 -4.88 115.26 112.86 3d2b n ASN 174 Ca -0.01 -2.40 0.00 0.00 -0.03 0.00 0.00 54.58 52.14 3d2b n ASN 174 Cb 0.21 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 3d2b n ASN 174 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d2b n GLY 175 N 0.71 0.59 0.30 7.41 0.00 -0.30 -4.97 105.19 108.94 3d2b n GLY 175 Ca 0.18 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.54 3d2b n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2b n GLY 176 N -2.62 -0.29 1.66 -0.02 0.00 0.41 -4.90 105.19 99.44 3d2b n GLY 176 Ca 0.00 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.63 3d2b n GLY 176 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d2b n GLY 177 N 0.94 -1.65 3.44 -0.02 0.00 -1.26 -4.81 105.19 101.82 3d2b n GLY 177 Ca 0.14 -1.63 -0.11 0.00 0.00 0.00 0.00 46.02 44.42 3d2b n GLY 177 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d2b s GLN 178 N -4.23 1.48 -0.45 1.61 -1.52 -0.57 -4.72 119.66 111.26 3d2b s GLN 178 Ca 0.33 -1.46 0.04 0.00 -1.95 0.00 0.00 55.36 52.32 3d2b s GLN 178 Cb -0.01 0.40 0.25 0.00 -0.22 0.00 0.00 33.01 33.42 3d2b s GLN 178 CO 0.24 -0.58 0.98 -1.71 -0.25 0.00 0.00 175.29 173.96 3d2b n ASN 179 N -0.50 -2.50 0.00 5.90 2.85 -0.56 -0.56 115.26 119.89 3d2b n ASN 179 Ca 0.00 -2.90 0.02 0.00 -0.11 0.00 0.00 54.58 51.59 3d2b n ASN 179 Cb 0.63 1.54 0.12 0.00 1.24 0.00 0.00 39.78 43.32 3d2b n ASN 179 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 3d2b n THR 180 N 1.64 0.00 1.53 -0.44 -2.24 0.32 -4.97 114.28 110.12 3d2b n THR 180 Ca 0.07 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.97 3d2b n THR 180 Cb 0.65 -0.09 0.73 0.00 -2.10 0.00 0.00 70.33 69.51 3d2b n THR 180 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30