#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h6b h PHE 10 N 0.00 0.00 -0.83 1.24 3.57 -2.03 -1.71 116.94 117.19 2h6b h PHE 10 Ca 0.00 0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.63 2h6b h PHE 10 Cb 0.00 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 38.65 2h6b h PHE 10 CO 0.00 0.00 0.43 0.00 -2.23 0.00 0.00 178.31 176.51 2h6b n GLY 12 N -1.32 -1.08 0.22 0.00 0.00 -0.64 -0.71 105.19 101.67 2h6b n GLY 12 Ca 0.16 0.14 0.06 0.00 0.00 0.00 0.00 46.02 46.38 2h6b n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6b h ALA 13 N 2.14 1.52 0.00 4.61 0.00 -1.57 -3.36 119.26 122.59 2h6b h ALA 13 Ca 0.00 -0.19 -0.34 0.00 0.00 0.00 0.00 54.91 54.37 2h6b h ALA 13 Cb 0.19 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 2h6b h ALA 13 CO 0.00 0.26 -2.31 -0.89 0.00 0.00 0.00 179.25 176.32 2h6b n ILE 14 N -4.10 1.31 -3.94 0.00 5.41 0.12 -4.95 119.36 113.22 2h6b n ILE 14 Ca -0.02 -0.54 -0.30 0.00 1.00 0.00 0.00 62.75 62.89 2h6b n ILE 14 Cb 0.28 -1.22 -0.16 0.00 -0.71 0.00 0.00 39.64 37.83 2h6b n ILE 14 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2h6b s ILE 15 N -2.46 1.47 -0.70 1.39 1.01 0.02 -5.06 121.20 116.87 2h6b s ILE 15 Ca -0.28 -1.09 -0.16 0.00 0.00 0.00 0.00 60.65 59.11 2h6b s ILE 15 Cb 0.08 -1.70 0.15 0.00 0.01 0.00 0.00 42.46 41.00 2h6b s ILE 15 CO 0.56 -0.02 0.72 -2.16 0.00 0.00 0.00 174.94 174.04 2h6b s PRO 16 N 1.44 3.29 0.20 2.79 0.04 -1.26 -3.95 135.00 137.54 2h6b s PRO 16 Ca -0.04 -1.88 -0.05 0.00 0.04 0.00 0.00 61.00 59.07 2h6b s PRO 16 Cb -0.18 -4.41 -0.03 0.00 0.04 0.00 0.00 34.50 29.93 2h6b s PRO 16 CO -0.07 -1.42 0.24 0.34 0.04 0.00 0.00 177.00 176.13 2h6b s ASP 17 N 3.11 0.08 -0.79 6.66 -1.08 -1.26 -1.12 116.67 122.28 2h6b s ASP 17 Ca 0.14 -1.16 -0.19 0.00 -0.52 0.00 0.00 52.55 50.82 2h6b s ASP 17 Cb -0.19 0.44 0.03 0.00 -1.46 0.00 0.00 42.92 41.74 2h6b s ASP 17 CO -0.02 -0.92 0.47 -3.20 0.52 0.00 0.00 175.17 172.02 2h6b n ASN 18 N -0.27 -3.02 -4.76 -0.34 5.15 -1.21 -4.91 115.26 105.90 2h6b n ASN 18 Ca -0.01 -0.87 -0.41 0.00 -0.60 0.00 0.00 54.58 52.69 2h6b n ASN 18 Cb 0.64 -1.12 -0.03 0.00 -0.53 0.00 0.00 39.78 38.74 2h6b n ASN 18 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2h6b s PHE 19 N -3.62 3.37 0.00 1.20 0.40 -1.26 -4.69 117.98 113.37 2h6b s PHE 19 Ca 0.26 1.55 0.00 0.00 -0.60 0.00 0.00 56.93 58.13 2h6b s PHE 19 Cb -0.14 -3.45 0.00 0.00 0.51 0.00 0.00 43.02 39.93 2h6b s PHE 19 CO 0.68 -1.14 0.00 0.34 0.70 0.00 0.00 175.22 175.80 2h6b n PHE 20 N 1.28 0.00 -1.77 0.36 7.35 -1.26 -4.68 117.46 118.74 2h6b n PHE 20 Ca 0.00 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.29 2h6b n PHE 20 Cb 0.44 0.00 0.02 0.00 0.35 0.00 0.00 39.48 40.28 2h6b n PHE 20 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 2h6b s PRO 21 N 0.00 3.71 -0.63 -7.13 0.02 -1.26 -4.67 135.00 125.03 2h6b s PRO 21 Ca 0.00 2.47 0.06 0.00 0.02 0.00 0.00 61.00 63.55 2h6b s PRO 21 Cb 0.00 -2.69 0.22 0.00 0.02 0.00 0.00 34.50 32.05 2h6b s PRO 21 CO 0.00 -0.82 0.63 -0.89 -0.33 0.00 0.00 177.00 175.59 2h6b n ILE 22 N -0.14 1.75 -0.31 2.83 5.41 -0.01 -4.96 119.36 123.92 2h6b n ILE 22 Ca 0.05 -4.94 0.16 0.00 1.00 0.00 0.00 62.75 59.02 2h6b n ILE 22 Cb 0.41 -2.10 0.32 0.00 -0.71 0.00 0.00 39.64 37.56 2h6b n ILE 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2h6b n GLU 23 N 1.34 -0.07 0.26 0.38 4.71 -1.26 -1.61 120.64 124.39 2h6b n GLU 23 Ca 0.26 1.36 0.15 0.00 -0.01 0.00 0.00 57.16 58.91 2h6b n GLU 23 Cb 0.40 -2.20 0.60 0.00 -1.01 0.00 0.00 31.44 29.23 2h6b n GLU 23 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 2h6b h LYS 24 N 0.00 0.00 -0.03 3.49 3.64 -1.96 -0.98 116.57 120.72 2h6b h LYS 24 Ca 0.60 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.98 2h6b h LYS 24 Cb 1.30 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2h6b h LYS 24 CO -0.84 0.08 0.09 -0.07 -2.27 0.00 0.00 179.45 176.44 2h6b h LEU 25 N 0.00 0.00 -1.43 5.20 3.38 -1.72 -0.71 115.31 120.03 2h6b h LEU 25 Ca -0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 2h6b h LEU 25 Cb 0.60 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.28 2h6b h LEU 25 CO 0.01 0.00 0.59 -0.09 0.09 0.00 0.00 178.44 179.04 2h6b h ARG 26 N 0.00 0.46 0.00 1.13 2.43 -1.34 -1.65 114.38 115.41 2h6b h ARG 26 Ca 0.01 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2h6b h ARG 26 Cb 0.20 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 2h6b h ARG 26 CO -0.00 0.31 0.00 0.09 -1.51 0.00 0.00 179.97 178.86 2h6b n ASN 27 N -4.54 0.00 -0.07 -3.80 5.03 -0.27 -3.30 115.26 108.32 2h6b n ASN 27 Ca 0.19 0.08 0.08 0.00 0.87 0.00 0.00 54.58 55.81 2h6b n ASN 27 Cb 0.65 -0.31 0.11 0.00 -1.02 0.00 0.00 39.78 39.22 2h6b n ASN 27 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2h6b n TYR 28 N -1.31 0.00 0.32 3.10 4.02 -0.62 -4.75 117.16 117.92 2h6b n TYR 28 Ca 0.08 -0.89 0.20 0.00 -0.01 0.00 0.00 57.90 57.29 2h6b n TYR 28 Cb 0.15 -0.13 1.05 0.00 -0.02 0.00 0.00 39.34 40.39 2h6b n TYR 28 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 2h6b h THR 29 N 0.15 0.08 0.00 -0.72 1.35 -1.63 -1.54 112.91 110.60 2h6b h THR 29 Ca 0.00 -0.15 -0.03 0.00 -0.55 0.00 0.00 66.41 65.68 2h6b h THR 29 Cb 0.92 1.14 -0.00 0.00 -1.73 0.00 0.00 68.15 68.47 2h6b h THR 29 CO 0.00 0.01 -0.12 1.56 -0.25 0.00 0.00 175.52 176.72 2h6b h GLN 30 N 0.00 0.00 0.00 4.72 4.20 -1.88 -1.99 115.11 120.16 2h6b h GLN 30 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2h6b h GLN 30 Cb 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 2h6b h GLN 30 CO 0.00 0.12 -0.23 -1.33 -0.67 0.00 0.00 178.83 176.72 2h6b n MET 31 N -3.28 0.02 -1.82 1.46 2.81 -0.58 -4.89 117.12 110.85 2h6b n MET 31 Ca 0.00 0.01 -0.04 0.00 -1.81 0.00 0.00 57.70 55.87 2h6b n MET 31 Cb 0.37 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 2h6b n MET 31 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2h6b n GLY 32 N 1.48 2.99 3.34 3.03 0.00 -0.75 -4.77 105.19 110.51 2h6b n GLY 32 Ca 0.06 -2.19 -0.35 0.00 0.00 0.00 0.00 46.02 43.54 2h6b n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2h6b s LEU 33 N 0.00 3.03 0.18 0.99 1.43 -0.70 -4.89 118.68 118.71 2h6b s LEU 33 Ca 0.04 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 52.48 2h6b s LEU 33 Cb -0.00 -1.78 -0.07 0.00 0.03 0.00 0.00 46.19 44.36 2h6b s LEU 33 CO 0.03 -0.03 1.04 -0.63 0.23 0.00 0.00 176.35 176.99 2h6b s ILE 34 N 1.51 4.04 -0.03 -0.59 -1.09 -1.26 -0.32 121.20 123.46 2h6b s ILE 34 Ca 0.06 1.81 -0.01 0.00 -2.23 0.00 0.00 60.65 60.27 2h6b s ILE 34 Cb -0.14 -4.15 0.03 0.00 -1.58 0.00 0.00 42.46 36.61 2h6b s ILE 34 CO -0.02 0.33 0.06 -0.13 -1.23 0.00 0.00 174.94 173.96 2h6b s ARG 35 N -0.49 0.02 -0.05 2.79 0.52 0.21 -4.96 118.95 116.99 2h6b s ARG 35 Ca 0.47 0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.89 2h6b s ARG 35 Cb -0.27 -0.17 -0.03 0.00 0.52 0.00 0.00 34.95 35.00 2h6b s ARG 35 CO 0.34 -0.13 -0.03 -0.51 0.02 0.00 0.00 175.30 174.99 2h6b s ASP 36 N 0.86 4.96 -0.07 0.23 1.01 -1.26 -0.87 116.67 121.53 2h6b s ASP 36 Ca -0.07 0.03 0.01 0.00 0.71 0.00 0.00 52.55 53.23 2h6b s ASP 36 Cb -0.10 -1.31 0.02 0.00 1.01 0.00 0.00 42.92 42.55 2h6b s ASP 36 CO -0.03 0.34 -0.08 -0.36 0.21 0.00 0.00 175.17 175.25 2h6b s PHE 37 N -0.92 1.16 0.77 4.23 0.40 0.73 -4.98 117.98 119.37 2h6b s PHE 37 Ca 0.15 -0.43 -0.12 0.00 -0.60 0.00 0.00 56.93 55.93 2h6b s PHE 37 Cb -0.11 -0.94 0.06 0.00 0.51 0.00 0.00 43.02 42.53 2h6b s PHE 37 CO 0.04 -0.29 1.11 0.00 0.70 0.00 0.00 175.22 176.78 2h6b s ALA 38 N 1.02 2.16 0.16 5.36 0.00 -1.26 -0.37 121.76 128.83 2h6b s ALA 38 Ca -0.09 0.43 -0.34 0.00 0.00 0.00 0.00 51.96 51.97 2h6b s ALA 38 Cb -0.14 -3.33 -0.15 0.00 0.00 0.00 0.00 23.12 19.49 2h6b s ALA 38 CO -0.00 -1.83 1.32 1.17 0.00 0.00 0.00 175.76 176.41 2h6b n LYS 39 N -3.33 1.45 -0.31 0.00 4.81 -1.26 -1.48 118.16 118.04 2h6b n LYS 39 Ca 0.10 0.52 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 2h6b n LYS 39 Cb 0.52 -2.13 0.00 0.00 0.02 0.00 0.00 35.03 33.45 2h6b n LYS 39 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2h6b n GLY 40 N 2.38 2.05 3.81 3.14 0.00 0.69 -4.98 105.19 112.27 2h6b n GLY 40 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2h6b n GLY 40 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2h6b s SER 41 N -3.46 5.42 -0.24 1.61 0.01 -0.55 -4.79 113.70 111.70 2h6b s SER 41 Ca 0.00 1.73 -0.18 0.00 1.31 0.00 0.00 55.95 58.82 2h6b s SER 41 Cb 0.00 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 2h6b s SER 41 CO 0.00 -1.41 0.51 0.00 0.41 0.00 0.00 173.24 172.75 2h6b s ALA 42 N -2.77 3.58 -0.03 1.44 0.00 -1.26 -0.78 121.76 121.94 2h6b s ALA 42 Ca 0.61 -0.54 -0.17 0.00 0.00 0.00 0.00 51.96 51.86 2h6b s ALA 42 Cb -0.15 -2.86 -0.33 0.00 0.00 0.00 0.00 23.12 19.79 2h6b s ALA 42 CO 0.47 -0.63 0.85 0.28 0.00 0.00 0.00 175.76 176.74 2h6b h VAL 43 N 5.30 1.27 -3.15 0.00 2.07 0.14 -3.43 116.25 118.46 2h6b h VAL 43 Ca -0.31 -2.58 -0.59 0.00 0.82 0.00 0.00 66.70 64.04 2h6b h VAL 43 Cb 1.15 3.01 -0.36 0.00 -1.52 0.00 0.00 31.29 33.57 2h6b h VAL 43 CO 0.72 0.77 -0.83 -0.63 0.02 0.00 0.00 177.57 177.63 2h6b s ILE 44 N -2.52 1.49 0.48 4.57 1.01 -0.87 -4.95 121.20 120.40 2h6b s ILE 44 Ca -0.13 -0.60 -0.17 0.00 0.00 0.00 0.00 60.65 59.74 2h6b s ILE 44 Cb 0.03 -1.42 -0.09 0.00 0.01 0.00 0.00 42.46 40.99 2h6b s ILE 44 CO 0.87 0.42 0.96 -0.04 0.00 0.00 0.00 174.94 177.15 2h6b s MET 45 N 1.52 4.02 0.23 2.79 -1.94 -1.26 -1.48 119.30 123.18 2h6b s MET 45 Ca 0.05 0.97 -0.32 0.00 -1.71 0.00 0.00 55.69 54.68 2h6b s MET 45 Cb -0.13 -2.17 -0.13 0.00 2.01 0.00 0.00 34.83 34.41 2h6b s MET 45 CO -0.10 -0.18 1.49 -2.30 -0.01 0.00 0.00 175.02 173.91 2h6b n PRO 46 N -1.29 2.20 -0.64 2.03 -0.02 -1.26 -1.27 135.00 134.76 2h6b n PRO 46 Ca 0.06 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 2h6b n PRO 46 Cb 0.54 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2h6b n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h6b n GLY 47 N 2.52 1.16 3.73 -1.23 0.00 -1.26 -4.99 105.19 105.12 2h6b n GLY 47 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2h6b n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2h6b s GLU 48 N -0.18 4.49 -0.39 1.61 2.12 -0.39 -4.98 118.70 120.98 2h6b s GLU 48 Ca 0.00 1.79 -0.23 0.00 0.36 0.00 0.00 54.97 56.89 2h6b s GLU 48 Cb 0.00 -3.30 0.01 0.00 0.26 0.00 0.00 34.13 31.11 2h6b s GLU 48 CO 0.00 -0.12 0.79 -2.00 -0.54 0.00 0.00 175.26 173.39 2h6b s GLU 49 N 0.28 3.66 -0.11 4.30 2.12 -1.26 -4.83 118.70 122.85 2h6b s GLU 49 Ca 0.54 0.21 -0.13 0.00 0.36 0.00 0.00 54.97 55.96 2h6b s GLU 49 Cb -0.30 -3.85 -0.05 0.00 0.26 0.00 0.00 34.13 30.19 2h6b s GLU 49 CO 0.33 -0.93 0.28 0.42 -0.54 0.00 0.00 175.26 174.82 2h6b s ILE 50 N 3.19 5.28 -0.39 -3.70 -1.09 -1.26 -5.02 121.20 118.21 2h6b s ILE 50 Ca 0.31 0.54 0.12 0.00 -2.23 0.00 0.00 60.65 59.40 2h6b s ILE 50 Cb -0.13 -3.60 0.40 0.00 -1.58 0.00 0.00 42.46 37.55 2h6b s ILE 50 CO 0.19 0.48 0.90 0.35 -1.23 0.00 0.00 174.94 175.63 2h6b n THR 51 N 2.82 1.08 -3.60 2.92 -2.24 -1.23 -4.18 114.28 109.86 2h6b n THR 51 Ca -0.14 -4.19 -0.16 0.00 -2.27 0.00 0.00 64.05 57.29 2h6b n THR 51 Cb 0.53 -0.21 -0.07 0.00 -2.10 0.00 0.00 70.33 68.48 2h6b n THR 51 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2h6b s SER 52 N -3.00 -0.57 0.13 3.42 0.01 -0.83 -4.48 113.70 108.39 2h6b s SER 52 Ca 0.37 0.74 -0.25 0.00 1.31 0.00 0.00 55.95 58.12 2h6b s SER 52 Cb 0.39 0.69 -0.07 0.00 0.21 0.00 0.00 66.02 67.24 2h6b s SER 52 CO -0.06 -0.47 0.77 -0.04 0.41 0.00 0.00 173.24 173.85 2h6b s MET 53 N -0.81 4.55 -0.27 12.44 -1.94 -0.20 -3.78 119.30 129.29 2h6b s MET 53 Ca -0.09 1.14 0.02 0.00 -1.71 0.00 0.00 55.69 55.05 2h6b s MET 53 Cb -0.02 -3.29 0.06 0.00 2.01 0.00 0.00 34.83 33.59 2h6b s MET 53 CO 0.06 0.50 -0.09 0.42 -0.01 0.00 0.00 175.02 175.91 2h6b s ILE 54 N -0.86 2.32 0.01 2.53 1.01 -0.03 0.02 121.20 126.21 2h6b s ILE 54 Ca 0.37 -1.61 -0.21 0.00 0.00 0.00 0.00 60.65 59.20 2h6b s ILE 54 Cb -0.22 -2.37 -0.06 0.00 0.01 0.00 0.00 42.46 39.82 2h6b s ILE 54 CO 0.25 -0.06 0.60 0.12 0.00 0.00 0.00 174.94 175.85 2h6b s PHE 55 N 1.12 3.71 -0.47 3.97 5.36 0.17 -1.58 117.98 130.26 2h6b s PHE 55 Ca -0.08 1.23 -0.13 0.00 -0.96 0.00 0.00 56.93 56.99 2h6b s PHE 55 Cb -0.20 -2.60 0.09 0.00 -0.34 0.00 0.00 43.02 39.97 2h6b s PHE 55 CO -0.04 0.38 0.37 -1.17 -1.46 0.00 0.00 175.22 173.30 2h6b s LEU 56 N -0.33 5.59 -0.06 6.12 2.96 -0.46 -1.14 118.68 131.37 2h6b s LEU 56 Ca 0.31 -1.54 -0.20 0.00 -0.22 0.00 0.00 54.13 52.48 2h6b s LEU 56 Cb -0.19 -2.11 -0.15 0.00 0.50 0.00 0.00 46.19 44.25 2h6b s LEU 56 CO 0.18 -0.66 0.80 0.58 -1.32 0.00 0.00 176.35 175.93 2h6b h VAL 57 N 5.93 0.81 -2.68 1.68 2.07 -1.57 0.93 116.25 123.42 2h6b h VAL 57 Ca -0.26 -1.16 -0.12 0.00 0.82 0.00 0.00 66.70 65.98 2h6b h VAL 57 Cb 1.10 1.38 -0.26 0.00 -1.52 0.00 0.00 31.29 31.98 2h6b h VAL 57 CO 0.87 0.22 -0.28 -0.70 0.02 0.00 0.00 177.57 177.69 2h6b s GLU 58 N -3.23 0.41 0.00 1.57 2.12 -1.04 -4.24 118.70 114.29 2h6b s GLU 58 Ca -0.12 0.73 0.00 0.00 0.36 0.00 0.00 54.97 55.94 2h6b s GLU 58 Cb 0.00 0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.43 2h6b s GLU 58 CO 0.45 -0.13 0.00 0.41 -0.54 0.00 0.00 175.26 175.44 2h6b n GLY 59 N 3.89 0.37 3.57 -1.50 0.00 -1.26 -0.21 105.19 110.05 2h6b n GLY 59 Ca -0.21 -1.91 -0.06 0.00 0.00 0.00 0.00 46.02 43.84 2h6b n GLY 59 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h6b s LYS 60 N -0.56 0.62 -0.05 1.61 2.47 -1.26 -3.70 119.74 118.88 2h6b s LYS 60 Ca 0.00 1.20 0.03 0.00 -1.56 0.00 0.00 55.97 55.65 2h6b s LYS 60 Cb 0.00 0.27 0.00 0.00 -1.46 0.00 0.00 37.83 36.64 2h6b s LYS 60 CO 0.00 -0.17 -0.14 0.42 0.16 0.00 0.00 175.35 175.62 2h6b s ILE 61 N 1.89 1.24 -0.23 5.43 1.01 0.07 -1.44 121.20 129.17 2h6b s ILE 61 Ca -0.09 -0.58 -0.10 0.00 0.00 0.00 0.00 60.65 59.88 2h6b s ILE 61 Cb -0.07 -1.09 -0.05 0.00 0.01 0.00 0.00 42.46 41.26 2h6b s ILE 61 CO -0.18 0.37 0.16 -0.75 0.00 0.00 0.00 174.94 174.53 2h6b s LYS 62 N 0.32 4.10 -0.13 2.79 2.20 -0.38 -0.16 119.74 128.47 2h6b s LYS 62 Ca -0.08 -0.25 0.02 0.00 -0.36 0.00 0.00 55.97 55.30 2h6b s LYS 62 Cb -0.13 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.69 2h6b s LYS 62 CO 0.03 0.11 -0.20 -1.17 -0.36 0.00 0.00 175.35 173.76 2h6b s LEU 63 N 0.91 1.99 0.14 5.43 0.20 0.31 -1.02 118.68 126.64 2h6b s LEU 63 Ca 0.08 -0.54 0.06 0.00 0.69 0.00 0.00 54.13 54.41 2h6b s LEU 63 Cb -0.13 -1.33 -0.04 0.00 -0.43 0.00 0.00 46.19 44.26 2h6b s LEU 63 CO 0.03 0.07 -0.13 -1.81 -0.29 0.00 0.00 176.35 174.22 2h6b s ASP 64 N 0.81 2.01 -0.06 3.68 1.11 0.34 -0.11 116.67 124.45 2h6b s ASP 64 Ca -0.08 -0.90 0.00 0.00 0.18 0.00 0.00 52.55 51.75 2h6b s ASP 64 Cb -0.16 -0.06 -0.03 0.00 1.07 0.00 0.00 42.92 43.74 2h6b s ASP 64 CO -0.01 -0.21 -0.04 -0.51 1.18 0.00 0.00 175.17 175.59 2h6b s ILE 65 N -2.61 3.93 -0.18 0.77 2.07 0.11 -0.99 121.20 124.30 2h6b s ILE 65 Ca 0.13 -0.46 -0.01 0.00 -1.41 0.00 0.00 60.65 58.90 2h6b s ILE 65 Cb -0.02 -2.65 -0.00 0.00 0.13 0.00 0.00 42.46 39.92 2h6b s ILE 65 CO 0.03 0.55 -0.11 -0.63 -1.91 0.00 0.00 174.94 172.87 2h6b s ILE 66 N -0.89 2.91 0.58 2.00 1.01 -0.44 -0.65 121.20 125.72 2h6b s ILE 66 Ca 0.14 -0.67 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 2h6b s ILE 66 Cb -0.11 -2.27 0.01 0.00 0.01 0.00 0.00 42.46 40.09 2h6b s ILE 66 CO 0.03 0.48 0.87 -0.36 0.00 0.00 0.00 174.94 175.97 2h6b s PHE 67 N 1.11 3.22 -0.29 3.97 0.40 0.64 -4.30 117.98 122.73 2h6b s PHE 67 Ca 0.01 0.56 0.25 0.00 -0.60 0.00 0.00 56.93 57.15 2h6b s PHE 67 Cb -0.14 -2.71 1.14 0.00 0.51 0.00 0.00 43.02 41.82 2h6b s PHE 67 CO -0.03 -0.79 1.77 0.93 0.70 0.00 0.00 175.22 177.79 2h6b h GLU 68 N -0.11 0.00 -0.39 0.44 3.07 -2.00 -0.86 114.58 114.74 2h6b h GLU 68 Ca -0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 2h6b h GLU 68 Cb 1.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 2h6b h GLU 68 CO 0.60 0.00 0.00 -0.40 -1.40 0.00 0.00 179.01 177.81 2h6b n ASP 69 N -2.39 2.02 0.00 1.42 5.75 -1.26 -4.91 116.55 117.18 2h6b n ASP 69 Ca 0.01 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 2h6b n ASP 69 Cb 0.19 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 2h6b n ASP 69 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2h6b n GLY 70 N 1.04 2.36 3.76 6.12 0.00 -0.33 -5.04 105.19 113.11 2h6b n GLY 70 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2h6b n GLY 70 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2h6b s SER 71 N -2.40 5.69 0.05 1.61 1.04 -1.26 -4.77 113.70 113.66 2h6b s SER 71 Ca 0.00 2.35 0.08 0.00 0.48 0.00 0.00 55.95 58.86 2h6b s SER 71 Cb 0.00 -2.60 -0.03 0.00 0.10 0.00 0.00 66.02 63.49 2h6b s SER 71 CO 0.00 -1.25 -0.21 -1.83 0.98 0.00 0.00 173.24 170.93 2h6b s GLU 72 N -3.03 1.41 0.03 4.02 -1.05 -1.26 -0.26 118.70 118.56 2h6b s GLU 72 Ca 0.70 -0.97 0.01 0.00 -0.15 0.00 0.00 54.97 54.56 2h6b s GLU 72 Cb -0.29 -1.54 -0.02 0.00 -0.44 0.00 0.00 34.13 31.83 2h6b s GLU 72 CO 0.34 0.39 -0.05 0.15 0.95 0.00 0.00 175.26 177.04 2h6b s LYS 73 N -1.23 0.43 0.24 -4.83 1.02 0.18 -4.98 119.74 110.57 2h6b s LYS 73 Ca 0.08 -0.71 -0.30 0.00 0.02 0.00 0.00 55.97 55.06 2h6b s LYS 73 Cb -0.09 -0.09 -0.09 0.00 -0.52 0.00 0.00 37.83 37.04 2h6b s LYS 73 CO 0.02 -0.00 1.33 -1.17 -0.92 0.00 0.00 175.35 174.61 2h6b s LEU 74 N -1.58 4.42 -0.21 3.17 2.96 -1.26 0.07 118.68 126.24 2h6b s LEU 74 Ca -0.12 2.51 -0.16 0.00 -0.22 0.00 0.00 54.13 56.14 2h6b s LEU 74 Cb -0.09 -3.62 -0.10 0.00 0.50 0.00 0.00 46.19 42.87 2h6b s LEU 74 CO -0.01 -0.55 -0.21 0.18 -1.32 0.00 0.00 176.35 174.45 2h6b n LEU 75 N 2.17 1.91 -3.82 -0.68 4.77 0.85 -4.78 117.00 117.42 2h6b n LEU 75 Ca 0.05 0.40 -0.05 0.00 -0.03 0.00 0.00 56.01 56.38 2h6b n LEU 75 Cb 0.42 -0.84 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2h6b n LEU 75 CO 0.58 0.11 0.67 -0.72 -1.33 0.00 0.00 177.39 176.70 2h6b s TYR 76 N -2.54 -0.04 0.03 -1.77 1.13 -0.67 -4.82 117.35 108.67 2h6b s TYR 76 Ca -0.30 -0.39 0.04 0.00 -1.41 0.00 0.00 57.07 55.01 2h6b s TYR 76 Cb 0.08 0.71 -0.04 0.00 -1.10 0.00 0.00 41.96 41.61 2h6b s TYR 76 CO 0.45 -1.06 -0.07 0.71 -2.51 0.00 0.00 175.55 173.07 2h6b s TYR 77 N -2.91 2.87 0.05 -3.49 1.51 -0.27 -0.53 117.35 114.57 2h6b s TYR 77 Ca 0.15 -0.06 0.06 0.00 -1.01 0.00 0.00 57.07 56.21 2h6b s TYR 77 Cb -0.03 -1.57 -0.02 0.00 -0.11 0.00 0.00 41.96 40.23 2h6b s TYR 77 CO 0.06 0.39 -0.16 0.00 -1.11 0.00 0.00 175.55 174.73 2h6b s ALA 78 N -1.07 1.33 0.00 3.71 0.00 0.77 -3.29 121.76 123.22 2h6b s ALA 78 Ca 0.19 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2h6b s ALA 78 Cb -0.11 -0.20 0.00 0.00 0.00 0.00 0.00 23.12 22.81 2h6b s ALA 78 CO 0.10 0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.52 2h6b n GLY 79 N 1.72 5.23 3.67 0.00 0.00 -1.26 -0.75 105.19 113.80 2h6b n GLY 79 Ca -0.18 -1.54 -0.46 0.00 0.00 0.00 0.00 46.02 43.84 2h6b n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h6b n GLY 80 N 0.62 1.05 2.75 -0.02 0.00 -1.24 -1.44 105.19 106.91 2h6b n GLY 80 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 2h6b n GLY 80 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2h6b n ASN 81 N 3.14 -0.77 -4.76 1.61 3.02 0.32 -4.94 115.26 112.88 2h6b n ASN 81 Ca 0.16 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.38 2h6b n ASN 81 Cb 0.29 -0.14 0.05 0.00 -0.61 0.00 0.00 39.78 39.37 2h6b n ASN 81 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2h6b s SER 82 N -2.74 4.94 -0.08 6.41 0.01 -0.52 -0.83 113.70 120.89 2h6b s SER 82 Ca 0.00 2.07 0.01 0.00 1.31 0.00 0.00 55.95 59.34 2h6b s SER 82 Cb 0.00 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.69 2h6b s SER 82 CO 0.00 -1.75 -0.08 -0.22 0.41 0.00 0.00 173.24 171.61 2h6b s LEU 83 N -4.89 1.29 -0.27 2.44 2.96 -1.26 -1.35 118.68 117.59 2h6b s LEU 83 Ca 0.69 -0.25 -0.18 0.00 -0.22 0.00 0.00 54.13 54.16 2h6b s LEU 83 Cb -0.22 -0.72 -0.02 0.00 0.50 0.00 0.00 46.19 45.72 2h6b s LEU 83 CO 0.42 -0.07 0.54 -0.63 -1.32 0.00 0.00 176.35 175.29 2h6b s ILE 84 N 1.28 5.04 -0.52 6.68 1.01 -0.61 -4.95 121.20 129.12 2h6b s ILE 84 Ca -0.04 0.88 0.01 0.00 0.00 0.00 0.00 60.65 61.49 2h6b s ILE 84 Cb -0.14 -3.87 0.50 0.00 0.01 0.00 0.00 42.46 38.96 2h6b s ILE 84 CO -0.03 0.03 1.95 0.61 0.00 0.00 0.00 174.94 177.51 2h6b n GLY 85 N 4.39 5.01 2.61 6.18 0.00 -1.26 -0.85 105.19 121.27 2h6b n GLY 85 Ca -0.03 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 2h6b n GLY 85 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h6b n LYS 86 N -0.83 4.52 0.21 1.61 5.02 -1.25 -4.69 118.16 122.76 2h6b n LYS 86 Ca 0.56 -3.89 0.08 0.00 -2.02 0.00 0.00 58.31 53.04 2h6b n LYS 86 Cb 1.05 -2.46 0.42 0.00 -0.02 0.00 0.00 35.03 34.02 2h6b n LYS 86 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2h6b h LEU 87 N 4.47 0.00 -8.55 -0.35 5.85 -1.82 -2.21 115.31 112.71 2h6b h LEU 87 Ca 0.58 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 59.02 2h6b h LEU 87 Cb 0.32 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.20 2h6b h LEU 87 CO 1.28 0.28 -0.71 -0.31 -0.34 0.00 0.00 178.44 178.64 2h6b s TYR 88 N -3.67 1.10 0.54 1.25 1.51 -1.26 -3.87 117.35 112.95 2h6b s TYR 88 Ca 0.00 -0.80 -0.21 0.00 -1.01 0.00 0.00 57.07 55.05 2h6b s TYR 88 Cb 0.11 -0.59 -0.06 0.00 -0.11 0.00 0.00 41.96 41.31 2h6b s TYR 88 CO 0.65 -0.01 1.07 -2.30 -1.11 0.00 0.00 175.55 173.85 2h6b n PRO 89 N -0.05 1.21 0.00 -1.71 -0.02 -1.26 -4.86 135.00 128.32 2h6b n PRO 89 Ca -0.12 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2h6b n PRO 89 Cb 0.60 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2h6b n PRO 89 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2h6b n THR 90 N -1.22 0.00 -0.15 3.45 -2.24 -1.26 -5.02 114.28 107.84 2h6b n THR 90 Ca 0.12 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2h6b n THR 90 Cb 0.44 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.24 2h6b n THR 90 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h6b n GLY 91 N 2.12 1.38 3.59 3.38 0.00 -1.26 -5.04 105.19 109.36 2h6b n GLY 91 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2h6b n GLY 91 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h6b s ASN 92 N -3.05 5.16 -0.32 1.61 0.01 -1.26 -5.06 114.94 112.04 2h6b s ASN 92 Ca 0.00 0.01 -0.29 0.00 -0.71 0.00 0.00 52.86 51.87 2h6b s ASN 92 Cb 0.00 -1.75 0.01 0.00 0.41 0.00 0.00 41.25 39.92 2h6b s ASN 92 CO 0.00 0.23 1.11 0.21 -1.51 0.00 0.00 177.10 177.14 2h6b s ASN 93 N 0.03 6.89 0.01 -1.22 2.47 -1.26 -5.02 114.94 116.83 2h6b s ASN 93 Ca 0.03 1.07 0.05 0.00 0.42 0.00 0.00 52.86 54.42 2h6b s ASN 93 Cb -0.13 -2.54 -0.03 0.00 -1.45 0.00 0.00 41.25 37.10 2h6b s ASN 93 CO 0.02 -0.92 -0.13 -0.63 -3.72 0.00 0.00 177.10 171.72 2h6b s ILE 94 N 3.77 3.18 0.02 -5.21 -1.09 -1.26 -1.33 121.20 119.27 2h6b s ILE 94 Ca 0.47 -0.94 0.01 0.00 -2.23 0.00 0.00 60.65 57.96 2h6b s ILE 94 Cb -0.13 -2.34 -0.01 0.00 -1.58 0.00 0.00 42.46 38.40 2h6b s ILE 94 CO 0.17 0.40 -0.05 -0.72 -1.23 0.00 0.00 174.94 173.51 2h6b s TYR 95 N -0.92 0.44 -0.01 3.97 1.13 -0.16 -4.24 117.35 117.56 2h6b s TYR 95 Ca 0.15 -0.33 0.01 0.00 -1.41 0.00 0.00 57.07 55.48 2h6b s TYR 95 Cb -0.11 -0.28 0.01 0.00 -1.10 0.00 0.00 41.96 40.48 2h6b s TYR 95 CO 0.05 -0.07 -0.02 0.00 -2.51 0.00 0.00 175.55 173.00 2h6b s ALA 96 N -0.88 0.22 -0.06 9.51 0.00 -0.55 -0.51 121.76 129.49 2h6b s ALA 96 Ca -0.07 -0.02 0.03 0.00 0.00 0.00 0.00 51.96 51.91 2h6b s ALA 96 Cb -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2h6b s ALA 96 CO -0.00 0.01 -0.16 0.99 0.00 0.00 0.00 175.76 176.60 2h6b s THR 97 N 0.25 1.38 -0.20 0.00 2.01 -0.19 0.87 115.64 119.77 2h6b s THR 97 Ca -0.02 -0.65 -0.29 0.00 0.31 0.00 0.00 61.69 61.03 2h6b s THR 97 Cb -0.04 -1.22 -0.02 0.00 0.01 0.00 0.00 72.50 71.23 2h6b s THR 97 CO -0.01 0.41 1.46 0.00 -0.69 0.00 0.00 174.62 175.79 2h6b s ALA 98 N 0.35 3.44 -2.12 7.40 0.00 0.04 -1.25 121.76 129.62 2h6b s ALA 98 Ca -0.11 0.46 0.26 0.00 0.00 0.00 0.00 51.96 52.56 2h6b s ALA 98 Cb -0.14 -3.76 0.57 0.00 0.00 0.00 0.00 23.12 19.78 2h6b s ALA 98 CO 0.04 -1.63 1.45 -1.33 0.00 0.00 0.00 175.76 174.29 2h6b n MET 99 N 7.24 1.27 -3.92 0.00 0.00 -0.52 -0.23 117.12 120.97 2h6b n MET 99 Ca 0.16 -0.88 -0.09 0.00 0.00 0.00 0.00 57.70 56.90 2h6b n MET 99 Cb 0.45 -1.48 -0.03 0.00 0.00 0.00 0.00 33.22 32.16 2h6b n MET 99 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 2h6b s GLU 100 N -2.33 1.78 -0.12 0.03 -1.05 -1.25 -4.77 118.70 110.99 2h6b s GLU 100 Ca 0.26 -1.20 -0.40 0.00 -0.15 0.00 0.00 54.97 53.48 2h6b s GLU 100 Cb 0.19 0.55 -0.17 0.00 -0.44 0.00 0.00 34.13 34.26 2h6b s GLU 100 CO 0.47 -0.79 1.45 -2.30 0.95 0.00 0.00 175.26 175.04 2h6b n PRO 101 N -0.45 0.80 -3.92 -4.83 -0.02 -1.26 -4.10 135.00 121.22 2h6b n PRO 101 Ca -0.03 0.29 -0.17 0.00 -2.02 0.00 0.00 63.50 61.56 2h6b n PRO 101 Cb 0.60 -1.90 -0.16 0.00 -0.02 0.00 0.00 33.50 32.02 2h6b n PRO 101 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2h6b s THR 102 N 1.66 0.18 -0.18 3.45 2.01 0.50 -4.35 115.64 118.91 2h6b s THR 102 Ca 0.92 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.96 2h6b s THR 102 Cb -1.11 -0.28 -0.03 0.00 0.01 0.00 0.00 72.50 71.08 2h6b s THR 102 CO 0.59 0.15 0.01 -0.60 -0.69 0.00 0.00 174.62 174.08 2h6b s ARG 103 N 1.07 3.75 0.29 4.92 3.52 0.71 -0.19 118.95 133.02 2h6b s ARG 103 Ca -0.09 -0.46 0.07 0.00 -0.13 0.00 0.00 55.73 55.12 2h6b s ARG 103 Cb -0.13 -3.09 -0.06 0.00 -1.56 0.00 0.00 34.95 30.11 2h6b s ARG 103 CO -0.02 0.16 -0.05 0.95 -0.81 0.00 0.00 175.30 175.52 2h6b s THR 104 N 0.64 1.69 -0.09 4.11 -4.23 -0.05 -1.44 115.64 116.27 2h6b s THR 104 Ca 0.00 -2.12 -0.01 0.00 -1.18 0.00 0.00 61.69 58.38 2h6b s THR 104 Cb -0.14 -2.51 0.03 0.00 1.34 0.00 0.00 72.50 71.22 2h6b s THR 104 CO 0.02 -0.26 -0.01 0.00 -0.54 0.00 0.00 174.62 173.83 2h6b s TRP 106 N 1.92 3.40 -0.25 0.00 0.52 0.57 -0.66 118.94 124.44 2h6b s TRP 106 Ca 0.05 0.51 -0.01 0.00 0.02 0.00 0.00 56.10 56.66 2h6b s TRP 106 Cb -0.13 -2.37 0.03 0.00 -1.15 0.00 0.00 33.47 29.85 2h6b s TRP 106 CO -0.06 0.13 -0.06 -0.06 0.02 0.00 0.00 176.95 176.92 2h6b s PHE 107 N 0.84 3.08 0.78 -1.98 0.40 0.10 -1.72 117.98 119.49 2h6b s PHE 107 Ca 0.15 -1.61 -0.12 0.00 -0.60 0.00 0.00 56.93 54.76 2h6b s PHE 107 Cb -0.13 -2.06 0.06 0.00 0.51 0.00 0.00 43.02 41.40 2h6b s PHE 107 CO 0.05 -0.74 1.11 -1.54 0.70 0.00 0.00 175.22 174.79 2h6b s SER 108 N 1.31 4.70 0.15 1.36 1.04 -1.26 -1.03 113.70 119.97 2h6b s SER 108 Ca -0.01 1.18 -0.18 0.00 0.48 0.00 0.00 55.95 57.43 2h6b s SER 108 Cb -0.17 -1.90 0.05 0.00 0.10 0.00 0.00 66.02 64.10 2h6b s SER 108 CO -0.04 -1.82 1.69 -0.08 0.98 0.00 0.00 173.24 173.97 2h6b h GLU 109 N -0.99 0.04 -0.57 4.02 4.81 -1.91 -0.04 114.58 119.94 2h6b h GLU 109 Ca -0.47 -0.00 0.12 0.00 -0.13 0.00 0.00 59.36 58.88 2h6b h GLU 109 Cb 1.27 -0.01 -0.11 0.00 0.63 0.00 0.00 28.75 30.54 2h6b h GLU 109 CO 0.61 0.03 -0.10 -0.22 -0.73 0.00 0.00 179.01 178.60 2h6b h LYS 110 N 0.04 0.03 -0.68 1.92 3.64 -1.98 -1.64 116.57 117.90 2h6b h LYS 110 Ca 0.16 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2h6b h LYS 110 Cb 0.23 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2h6b h LYS 110 CO -0.30 0.02 0.29 0.66 -2.27 0.00 0.00 179.45 177.84 2h6b h SER 111 N 0.03 0.91 -0.88 4.20 4.64 -1.75 -2.65 113.55 118.07 2h6b h SER 111 Ca 0.28 -0.16 0.05 0.00 -0.47 0.00 0.00 61.79 61.49 2h6b h SER 111 Cb 0.44 -0.24 -0.05 0.00 -0.31 0.00 0.00 62.40 62.24 2h6b h SER 111 CO -0.56 0.82 0.57 -0.07 -0.87 0.00 0.00 176.83 176.72 2h6b h LEU 112 N 0.95 0.91 -0.71 5.97 3.38 -0.45 -1.65 115.31 123.72 2h6b h LEU 112 Ca 0.23 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.24 2h6b h LEU 112 Cb 0.18 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 2h6b h LEU 112 CO -0.02 0.61 0.43 0.03 0.09 0.00 0.00 178.44 179.58 2h6b h ARG 113 N 1.05 0.79 -0.79 1.13 3.08 -0.97 -0.47 114.38 118.21 2h6b h ARG 113 Ca 0.36 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.36 2h6b h ARG 113 Cb 0.09 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 29.93 2h6b h ARG 113 CO -0.12 0.52 0.49 1.15 -1.07 0.00 0.00 179.97 180.94 2h6b h THR 114 N 0.81 1.22 -0.28 2.04 2.02 -1.19 0.46 112.91 118.00 2h6b h THR 114 Ca 0.30 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 2h6b h THR 114 Cb 0.09 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.58 2h6b h THR 114 CO -0.14 0.22 0.09 0.58 0.37 0.00 0.00 175.52 176.65 2h6b h VAL 115 N 1.08 1.19 0.00 3.16 2.07 -0.57 -2.80 116.25 120.39 2h6b h VAL 115 Ca 0.29 -0.61 -0.14 0.00 0.82 0.00 0.00 66.70 67.05 2h6b h VAL 115 Cb -0.06 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 2h6b h VAL 115 CO -0.06 0.20 -0.68 -0.26 0.02 0.00 0.00 177.57 176.80 2h6b h PHE 116 N 0.29 0.00 -0.47 1.57 0.04 -0.76 0.57 116.94 118.18 2h6b h PHE 116 Ca 0.09 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 2h6b h PHE 116 Cb 0.23 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 2h6b h PHE 116 CO 0.00 0.68 0.25 0.00 -0.60 0.00 0.00 178.31 178.64 2h6b h ARG 117 N 0.00 0.64 0.19 1.51 3.08 -0.90 -2.49 114.38 116.41 2h6b h ARG 117 Ca -0.01 -0.06 -0.33 0.00 0.07 0.00 0.00 59.98 59.65 2h6b h ARG 117 Cb 1.21 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 31.14 2h6b h ARG 117 CO 0.09 0.48 -1.58 1.15 -1.07 0.00 0.00 179.97 179.04 2h6b h THR 118 N 0.65 1.14 -2.39 2.04 2.02 -1.14 -3.45 112.91 111.79 2h6b h THR 118 Ca 0.17 -2.68 -0.47 0.00 0.77 0.00 0.00 66.41 64.20 2h6b h THR 118 Cb 0.03 2.86 -0.36 0.00 -1.74 0.00 0.00 68.15 68.94 2h6b h THR 118 CO -0.03 0.84 -0.75 -0.62 0.37 0.00 0.00 175.52 175.33 2h6b s ASP 119 N -7.30 2.40 0.31 4.18 -1.08 0.19 -5.00 116.67 110.37 2h6b s ASP 119 Ca -0.11 -1.54 0.07 0.00 -0.52 0.00 0.00 52.55 50.45 2h6b s ASP 119 Cb 0.05 0.03 0.79 0.00 -1.46 0.00 0.00 42.92 42.33 2h6b s ASP 119 CO 0.88 -0.34 1.76 -0.08 0.52 0.00 0.00 175.17 177.91 2h6b h GLU 120 N 7.61 0.69 -1.01 4.34 4.81 -1.69 -2.39 114.58 126.93 2h6b h GLU 120 Ca -0.04 -0.04 0.27 0.00 -0.13 0.00 0.00 59.36 59.42 2h6b h GLU 120 Cb 1.02 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 30.18 2h6b h GLU 120 CO 0.30 0.46 0.69 -0.44 -0.73 0.00 0.00 179.01 179.29 2h6b h ASP 121 N 0.71 0.23 0.37 1.04 3.32 -1.95 -1.82 116.42 118.32 2h6b h ASP 121 Ca 0.60 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.66 2h6b h ASP 121 Cb 1.00 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.54 2h6b h ASP 121 CO -0.41 0.06 -0.14 0.24 -1.72 0.00 0.00 179.24 177.27 2h6b h MET 122 N 0.21 0.00 -0.41 3.56 2.86 -1.80 -1.65 114.93 117.70 2h6b h MET 122 Ca 0.52 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 58.21 2h6b h MET 122 Cb 1.67 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 33.28 2h6b h MET 122 CO -0.14 0.14 0.14 0.82 1.06 0.00 0.00 176.91 178.93 2h6b h ILE 123 N 0.00 0.87 0.00 -1.22 2.04 -1.51 -2.85 117.51 114.83 2h6b h ILE 123 Ca -0.00 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.64 2h6b h ILE 123 Cb 0.37 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2h6b h ILE 123 CO 0.02 0.05 -0.58 -0.26 0.00 0.00 0.00 178.15 177.39 2h6b h PHE 124 N 0.30 0.00 -0.71 1.37 -1.00 -1.45 -1.57 116.94 113.88 2h6b h PHE 124 Ca 0.19 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.90 2h6b h PHE 124 Cb 0.18 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.71 2h6b h PHE 124 CO -0.16 0.58 0.19 0.93 -1.61 0.00 0.00 178.31 178.24 2h6b h GLU 125 N 0.00 1.13 -0.29 1.51 4.39 -1.41 -1.59 114.58 118.33 2h6b h GLU 125 Ca -0.01 -0.26 -0.11 0.00 0.34 0.00 0.00 59.36 59.33 2h6b h GLU 125 Cb 1.44 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 2h6b h GLU 125 CO 0.08 0.99 -0.24 0.82 -1.16 0.00 0.00 179.01 179.49 2h6b h ILE 126 N 1.08 1.30 -0.50 3.13 2.04 -1.32 -1.65 117.51 121.59 2h6b h ILE 126 Ca 0.23 -1.39 0.08 0.00 1.00 0.00 0.00 64.86 64.77 2h6b h ILE 126 Cb 0.35 1.56 -0.07 0.00 -0.74 0.00 0.00 36.82 37.93 2h6b h ILE 126 CO -0.00 0.44 0.13 -0.26 0.00 0.00 0.00 178.15 178.46 2h6b h PHE 127 N 0.41 0.21 -0.80 1.37 0.04 -1.16 0.12 116.94 117.13 2h6b h PHE 127 Ca 0.05 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.84 2h6b h PHE 127 Cb 0.80 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.89 2h6b h PHE 127 CO 0.07 0.03 0.45 0.87 -0.60 0.00 0.00 178.31 179.13 2h6b h LYS 128 N 0.27 1.10 0.22 1.51 1.57 -1.03 0.97 116.57 121.18 2h6b h LYS 128 Ca 0.25 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2h6b h LYS 128 Cb 0.31 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.40 2h6b h LYS 128 CO -0.30 0.80 -0.10 -0.97 -0.57 0.00 0.00 179.45 178.31 2h6b h ASN 129 N 1.11 -0.24 -0.17 0.86 -0.73 -0.57 -0.63 115.58 115.21 2h6b h ASN 129 Ca 0.28 -0.03 0.02 0.00 1.87 0.00 0.00 56.30 58.45 2h6b h ASN 129 Cb 0.01 0.06 -0.02 0.00 0.27 0.00 0.00 38.32 38.64 2h6b h ASN 129 CO -0.05 -0.13 0.04 1.88 -0.37 0.00 0.00 177.43 178.80 2h6b h TYR 130 N -0.34 0.07 -0.79 0.67 0.99 -0.39 -2.69 116.97 114.50 2h6b h TYR 130 Ca -0.03 0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.76 2h6b h TYR 130 Cb 0.26 -0.01 -0.05 0.00 1.00 0.00 0.00 36.73 37.93 2h6b h TYR 130 CO -0.05 0.03 0.49 1.25 -0.00 0.00 0.00 178.16 179.88 2h6b h LEU 131 N 0.11 0.77 -0.87 3.88 5.85 -0.80 -1.56 115.31 122.69 2h6b h LEU 131 Ca 0.07 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.89 2h6b h LEU 131 Cb 0.06 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.87 2h6b h LEU 131 CO -0.09 0.51 0.53 0.74 -0.34 0.00 0.00 178.44 179.78 2h6b h THR 132 N 0.91 0.97 -0.09 1.05 2.02 -0.88 0.12 112.91 117.02 2h6b h THR 132 Ca 0.33 -0.31 -0.03 0.00 0.77 0.00 0.00 66.41 67.17 2h6b h THR 132 Cb 0.11 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.50 2h6b h THR 132 CO -0.15 0.17 -0.06 0.11 0.37 0.00 0.00 175.52 175.95 2h6b h LYS 133 N 0.91 0.19 -0.14 6.66 1.57 -1.04 -2.22 116.57 122.50 2h6b h LYS 133 Ca 0.40 -0.09 0.04 0.00 -1.87 0.00 0.00 60.65 59.13 2h6b h LYS 133 Cb 0.30 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 2h6b h LYS 133 CO -0.22 0.59 -0.10 0.28 -0.57 0.00 0.00 179.45 179.44 2h6b h VAL 134 N -0.21 0.71 -0.82 0.50 2.07 -1.19 -0.72 116.25 116.59 2h6b h VAL 134 Ca 0.02 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.60 2h6b h VAL 134 Cb 0.55 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 2h6b h VAL 134 CO 0.02 0.00 0.50 0.00 0.02 0.00 0.00 177.57 178.11 2h6b h ALA 135 N 1.02 1.12 -0.01 1.67 0.00 -0.78 -0.41 119.26 121.88 2h6b h ALA 135 Ca 0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2h6b h ALA 135 Cb 0.23 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2h6b h ALA 135 CO -0.21 0.23 -0.01 -0.92 0.00 0.00 0.00 179.25 178.35 2h6b h TYR 136 N 0.92 0.02 -0.06 0.00 3.20 -1.10 -2.38 116.97 117.56 2h6b h TYR 136 Ca 0.36 -0.01 -0.21 0.00 3.14 0.00 0.00 58.73 62.02 2h6b h TYR 136 Cb 0.17 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.44 2h6b h TYR 136 CO -0.04 0.48 -0.82 1.88 -1.64 0.00 0.00 178.16 178.02 2h6b h TYR 137 N -0.44 0.65 -0.72 -3.82 -1.99 -1.01 -1.62 116.97 108.02 2h6b h TYR 137 Ca 0.00 -0.31 -0.03 0.00 2.00 0.00 0.00 58.73 60.39 2h6b h TYR 137 Cb 0.48 -0.09 -0.03 0.00 2.00 0.00 0.00 36.73 39.08 2h6b h TYR 137 CO 0.09 1.10 0.32 0.00 -0.00 0.00 0.00 178.16 179.67 2h6b h ALA 138 N 0.80 0.94 -0.57 3.88 0.00 -1.18 -0.57 119.26 122.56 2h6b h ALA 138 Ca -0.05 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2h6b h ALA 138 Cb 1.42 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2h6b h ALA 138 CO 0.14 0.53 0.15 -0.09 0.00 0.00 0.00 179.25 179.99 2h6b h ARG 139 N 1.02 0.87 -0.24 0.00 2.43 -1.28 -2.54 114.38 114.63 2h6b h ARG 139 Ca 0.25 -0.17 -0.10 0.00 -0.81 0.00 0.00 59.98 59.14 2h6b h ARG 139 Cb 0.16 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2h6b h ARG 139 CO -0.03 0.77 -0.25 1.96 -1.51 0.00 0.00 179.97 180.91 2h6b h GLN 140 N 0.84 0.60 -0.46 0.20 1.08 -0.68 -1.94 115.11 114.75 2h6b h GLN 140 Ca 0.19 -0.32 0.06 0.00 -1.45 0.00 0.00 58.65 57.13 2h6b h GLN 140 Cb 0.28 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.67 2h6b h GLN 140 CO -0.00 0.91 0.16 0.28 -0.95 0.00 0.00 178.83 179.23 2h6b h VAL 141 N 0.31 0.84 -0.34 -0.54 2.07 -1.02 -0.87 116.25 116.69 2h6b h VAL 141 Ca 0.04 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 2h6b h VAL 141 Cb 0.81 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2h6b h VAL 141 CO 0.06 0.06 0.05 0.00 0.02 0.00 0.00 177.57 177.76 2h6b h ALA 142 N 1.31 0.46 -0.24 1.67 0.00 -1.39 -0.59 119.26 120.47 2h6b h ALA 142 Ca 0.22 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2h6b h ALA 142 Cb 0.23 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2h6b h ALA 142 CO -0.23 0.17 0.03 0.93 0.00 0.00 0.00 179.25 180.15 2h6b h GLU 143 N 0.41 0.12 0.00 0.00 5.08 -1.23 -1.88 114.58 117.07 2h6b h GLU 143 Ca 0.10 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2h6b h GLU 143 Cb 0.37 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2h6b h GLU 143 CO 0.01 0.08 0.00 0.52 -1.00 0.00 0.00 179.01 178.61 2h6b h MET 144 N 0.12 0.00 -0.39 2.33 2.86 -0.87 -2.69 114.93 116.29 2h6b h MET 144 Ca 0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2h6b h MET 144 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 2h6b h MET 144 CO -0.16 0.00 0.00 0.09 1.06 0.00 0.00 176.91 177.90 2h6b n ASN 145 N -2.58 3.53 -0.33 1.22 3.02 -0.25 -4.60 115.26 115.27 2h6b n ASN 145 Ca 0.03 -2.35 0.11 0.00 -0.03 0.00 0.00 54.58 52.35 2h6b n ASN 145 Cb 0.34 -0.38 0.29 0.00 -0.61 0.00 0.00 39.78 39.42 2h6b n ASN 145 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2h6b h THR 146 N 2.40 0.68 -0.48 3.41 2.02 -0.98 -1.64 112.91 118.32 2h6b h THR 146 Ca 0.00 -0.23 -0.29 0.00 0.77 0.00 0.00 66.41 66.66 2h6b h THR 146 Cb 1.05 -0.06 -0.18 0.00 -1.74 0.00 0.00 68.15 67.23 2h6b h THR 146 CO 0.10 0.12 -0.11 -1.22 0.37 0.00 0.00 175.52 174.79 2h6b n TYR 147 N -4.83 1.55 -1.48 3.16 0.53 -1.26 -5.04 117.16 109.79 2h6b n TYR 147 Ca 0.22 -1.84 -0.58 0.00 -1.02 0.00 0.00 57.90 54.68 2h6b n TYR 147 Cb 0.55 -0.56 -0.08 0.00 -1.03 0.00 0.00 39.34 38.21 2h6b n TYR 147 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 2h6b n ASN 148 N -1.05 0.76 -0.12 7.72 5.15 -0.62 -4.88 115.26 122.22 2h6b n ASN 148 Ca 0.38 1.04 -0.12 0.00 -0.60 0.00 0.00 54.58 55.28 2h6b n ASN 148 Cb 1.00 -0.79 -0.03 0.00 -0.53 0.00 0.00 39.78 39.44 2h6b n ASN 148 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2h6b h PRO 149 N 3.90 0.71 -0.43 1.20 0.11 -1.96 -2.50 132.00 133.04 2h6b h PRO 149 Ca -0.41 -0.30 0.08 0.00 0.11 0.00 0.00 66.00 65.49 2h6b h PRO 149 Cb 1.22 -0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 2h6b h PRO 149 CO 0.78 0.90 -0.04 1.15 -0.21 0.00 0.00 178.00 180.58 2h6b h THR 150 N 0.49 0.63 -0.11 -1.15 2.02 -1.96 -2.35 112.91 110.48 2h6b h THR 150 Ca 0.08 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 2h6b h THR 150 Cb 0.68 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 2h6b h THR 150 CO 0.05 0.01 -0.08 0.40 0.37 0.00 0.00 175.52 176.27 2h6b h ILE 151 N 0.06 1.13 -0.07 3.11 2.04 -1.88 -1.04 117.51 120.86 2h6b h ILE 151 Ca 0.21 -0.54 0.02 0.00 1.00 0.00 0.00 64.86 65.55 2h6b h ILE 151 Cb 0.31 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2h6b h ILE 151 CO -0.39 0.17 -0.02 0.03 0.00 0.00 0.00 178.15 177.93 2h6b h ARG 152 N 0.16 -0.01 -0.34 2.37 3.08 -0.98 0.19 114.38 118.85 2h6b h ARG 152 Ca 0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 2h6b h ARG 152 Cb 0.24 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2h6b h ARG 152 CO 0.01 -0.01 0.13 0.82 -1.07 0.00 0.00 179.97 179.86 2h6b h ILE 153 N -0.01 1.19 -0.68 2.04 2.04 -0.90 -1.16 117.51 120.03 2h6b h ILE 153 Ca 0.04 -0.60 -0.06 0.00 1.00 0.00 0.00 64.86 65.24 2h6b h ILE 153 Cb 0.07 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 2h6b h ILE 153 CO -0.08 0.21 0.19 -0.07 0.00 0.00 0.00 178.15 178.40 2h6b h LEU 154 N 0.41 1.00 -0.81 1.44 3.38 -0.91 -2.10 115.31 117.71 2h6b h LEU 154 Ca 0.11 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 2h6b h LEU 154 Cb 0.20 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2h6b h LEU 154 CO -0.01 0.94 -0.19 0.03 0.09 0.00 0.00 178.44 179.30 2h6b h ARG 155 N 1.02 0.69 0.16 1.13 3.08 -0.42 -0.13 114.38 119.90 2h6b h ARG 155 Ca 0.22 -0.25 0.02 0.00 0.07 0.00 0.00 59.98 60.03 2h6b h ARG 155 Cb 0.32 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 2h6b h ARG 155 CO -0.00 0.83 -0.33 1.25 -1.07 0.00 0.00 179.97 180.64 2h6b h LEU 156 N 0.61 -0.96 -0.63 3.04 5.85 -0.95 -1.45 115.31 120.83 2h6b h LEU 156 Ca 0.09 0.11 0.08 0.00 0.84 0.00 0.00 57.88 59.00 2h6b h LEU 156 Cb 0.66 0.36 -0.06 0.00 0.37 0.00 0.00 40.66 41.98 2h6b h LEU 156 CO 0.05 -0.43 0.29 -0.26 -0.34 0.00 0.00 178.44 177.75 2h6b h PHE 157 N -0.58 0.52 -0.37 1.25 0.05 -1.16 -0.84 116.94 115.81 2h6b h PHE 157 Ca 0.02 0.03 -0.10 0.00 3.82 0.00 0.00 57.97 61.74 2h6b h PHE 157 Cb 0.60 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 38.39 2h6b h PHE 157 CO -0.28 0.20 -0.19 -0.92 -0.18 0.00 0.00 178.31 176.94 2h6b h TYR 158 N 0.53 0.79 -0.17 -0.55 3.20 -0.82 -1.50 116.97 118.45 2h6b h TYR 158 Ca 0.30 -0.16 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 2h6b h TYR 158 Cb 0.29 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.37 2h6b h TYR 158 CO -0.12 0.84 -0.31 1.49 -1.64 0.00 0.00 178.16 178.43 2h6b h GLU 159 N 0.63 0.51 -0.81 1.82 4.57 -0.76 -1.51 114.58 119.03 2h6b h GLU 159 Ca 0.10 -0.32 0.02 0.00 -1.18 0.00 0.00 59.36 57.97 2h6b h GLU 159 Cb 0.66 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.25 2h6b h GLU 159 CO 0.05 0.92 0.53 -0.07 -1.18 0.00 0.00 179.01 179.27 2h6b h LEU 160 N 0.15 0.91 -0.92 1.64 4.07 -1.07 -2.19 115.31 117.91 2h6b h LEU 160 Ca 0.01 -0.02 -0.08 0.00 0.08 0.00 0.00 57.88 57.88 2h6b h LEU 160 Cb 0.89 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.40 2h6b h LEU 160 CO 0.07 0.65 -0.04 0.00 -1.08 0.00 0.00 178.44 178.04 2h6b h SER 162 N 0.69 0.92 0.00 0.00 0.02 -1.04 0.24 113.55 114.38 2h6b h SER 162 Ca 0.13 -0.41 -0.17 0.00 -0.84 0.00 0.00 61.79 60.50 2h6b h SER 162 Cb 0.49 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 2h6b h SER 162 CO 0.02 1.19 -0.94 0.77 -1.14 0.00 0.00 176.83 176.73 2h6b h SER 163 N 0.71 0.00 -0.25 3.07 4.64 -1.35 -3.41 113.55 116.96 2h6b h SER 163 Ca 0.06 -0.57 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2h6b h SER 163 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2h6b h SER 163 CO 0.09 1.33 0.00 0.00 -0.87 0.00 0.00 176.83 177.38 2h6b n GLN 164 N -4.49 2.44 -2.36 4.77 1.13 0.95 -4.97 117.38 114.85 2h6b n GLN 164 Ca -0.26 -2.15 -0.43 0.00 -1.94 0.00 0.00 57.00 52.22 2h6b n GLN 164 Cb 0.61 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.44 2h6b n GLN 164 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2h6b s GLY 165 N -1.68 1.41 -0.27 1.08 0.00 0.83 -4.54 107.32 104.15 2h6b s GLY 165 Ca 0.35 0.25 -0.12 0.00 0.00 0.00 0.00 44.72 45.19 2h6b s GLY 165 CO 0.31 2.65 0.24 1.25 0.00 0.00 0.00 173.10 177.55 2h6b s LYS 166 N 4.12 4.00 0.21 2.90 2.47 0.28 -4.85 119.74 128.87 2h6b s LYS 166 Ca 0.59 -0.19 -0.30 0.00 -1.56 0.00 0.00 55.97 54.51 2h6b s LYS 166 Cb -0.19 -3.63 -0.08 0.00 -1.46 0.00 0.00 37.83 32.46 2h6b s LYS 166 CO 0.23 -0.16 1.15 0.50 0.16 0.00 0.00 175.35 177.23 2h6b s ARG 167 N 1.70 4.55 -0.41 4.03 3.52 -1.26 0.07 118.95 131.14 2h6b s ARG 167 Ca 0.10 1.82 0.07 0.00 -0.13 0.00 0.00 55.73 57.59 2h6b s ARG 167 Cb -0.15 -3.23 0.23 0.00 -1.56 0.00 0.00 34.95 30.23 2h6b s ARG 167 CO 0.09 0.03 0.55 0.28 -0.81 0.00 0.00 175.30 175.44 2h6b n VAL 168 N 2.09 -0.67 0.00 7.11 0.31 0.02 -4.90 118.33 122.29 2h6b n VAL 168 Ca 0.02 -3.38 0.00 0.00 -0.01 0.00 0.00 64.34 60.97 2h6b n VAL 168 Cb 0.45 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.13 2h6b n VAL 168 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2h6b n GLY 169 N 1.80 1.47 0.07 2.92 0.00 -1.26 -2.60 105.19 107.60 2h6b n GLY 169 Ca 0.21 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.62 2h6b n GLY 169 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2h6b h ASP 170 N 0.00 0.00 -3.59 1.61 5.19 -1.97 -3.48 116.42 114.19 2h6b h ASP 170 Ca 0.00 0.00 -0.46 0.00 -0.62 0.00 0.00 57.03 55.95 2h6b h ASP 170 Cb 0.00 0.00 0.06 0.00 0.18 0.00 0.00 39.33 39.57 2h6b h ASP 170 CO 0.00 0.99 0.18 0.42 -3.12 0.00 0.00 179.24 177.70 2h6b s THR 171 N -2.66 2.95 -0.03 0.35 -4.23 -1.07 -4.89 115.64 106.07 2h6b s THR 171 Ca -0.02 -0.19 0.07 0.00 -1.18 0.00 0.00 61.69 60.37 2h6b s THR 171 Cb 0.09 -3.21 -0.02 0.00 1.34 0.00 0.00 72.50 70.70 2h6b s THR 171 CO 0.82 -0.21 -0.23 -0.31 -0.54 0.00 0.00 174.62 174.15 2h6b s TYR 172 N -3.08 2.44 -0.06 3.99 1.51 -0.61 -0.80 117.35 120.74 2h6b s TYR 172 Ca 0.57 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 56.30 2h6b s TYR 172 Cb -0.11 -1.54 -0.03 0.00 -0.11 0.00 0.00 41.96 40.18 2h6b s TYR 172 CO 0.44 0.03 -0.11 -1.21 -1.11 0.00 0.00 175.55 173.60 2h6b s GLU 173 N -0.66 2.62 -0.22 -0.62 2.02 0.11 -0.60 118.70 121.35 2h6b s GLU 173 Ca 0.10 -0.63 0.01 0.00 0.02 0.00 0.00 54.97 54.48 2h6b s GLU 173 Cb -0.10 -2.48 0.05 0.00 0.10 0.00 0.00 34.13 31.70 2h6b s GLU 173 CO -0.00 0.64 -0.09 0.42 0.02 0.00 0.00 175.26 176.25 2h6b s ILE 174 N -0.77 1.69 -0.90 -1.63 1.01 -0.16 0.10 121.20 120.55 2h6b s ILE 174 Ca 0.12 -1.15 -0.18 0.00 0.00 0.00 0.00 60.65 59.43 2h6b s ILE 174 Cb -0.11 -1.82 0.14 0.00 0.01 0.00 0.00 42.46 40.68 2h6b s ILE 174 CO 0.01 0.07 1.06 -0.89 0.00 0.00 0.00 174.94 175.19 2h6b s THR 175 N 1.35 4.84 -0.04 2.92 2.01 -1.26 0.31 115.64 125.76 2h6b s THR 175 Ca -0.03 -1.63 -0.30 0.00 0.31 0.00 0.00 61.69 60.04 2h6b s THR 175 Cb -0.17 -4.73 0.08 0.00 0.01 0.00 0.00 72.50 67.69 2h6b s THR 175 CO -0.07 -1.43 0.74 0.00 -0.69 0.00 0.00 174.62 173.17 2h6b s MET 176 N 2.40 0.99 -1.05 4.92 0.23 -1.01 -4.98 119.30 120.80 2h6b s MET 176 Ca 0.30 0.10 -0.16 0.00 -1.03 0.00 0.00 55.69 54.89 2h6b s MET 176 Cb -0.07 0.46 0.15 0.00 -1.53 0.00 0.00 34.83 33.85 2h6b s MET 176 CO -0.08 -0.34 1.26 -1.25 -2.03 0.00 0.00 175.02 172.58 2h6b s PRO 177 N -1.66 3.83 -0.45 3.16 0.04 -1.26 -3.19 135.00 135.47 2h6b s PRO 177 Ca -0.07 -2.16 -0.18 0.00 0.04 0.00 0.00 61.00 58.64 2h6b s PRO 177 Cb -0.00 -4.97 0.04 0.00 0.04 0.00 0.00 34.50 29.60 2h6b s PRO 177 CO 0.04 -1.76 0.52 -1.17 0.04 0.00 0.00 177.00 174.67 2h6b s LEU 178 N 2.11 4.92 0.59 -3.56 2.96 -1.26 -4.99 118.68 119.45 2h6b s LEU 178 Ca 0.37 -0.76 -0.15 0.00 -0.22 0.00 0.00 54.13 53.36 2h6b s LEU 178 Cb -0.04 -2.43 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 2h6b s LEU 178 CO -0.05 -0.71 1.04 -0.94 -1.32 0.00 0.00 176.35 174.37 2h6b s SER 179 N 2.18 5.92 0.27 3.68 1.04 -1.26 -4.89 113.70 120.64 2h6b s SER 179 Ca 0.14 1.74 -0.01 0.00 0.48 0.00 0.00 55.95 58.30 2h6b s SER 179 Cb -0.18 -2.52 0.50 0.00 0.10 0.00 0.00 66.02 63.91 2h6b s SER 179 CO 0.13 -1.07 1.83 1.56 0.98 0.00 0.00 173.24 176.67 2h6b h GLN 180 N 0.40 0.91 -0.47 4.02 4.20 -1.98 0.11 115.11 122.31 2h6b h GLN 180 Ca -0.46 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.24 2h6b h GLN 180 Cb 1.21 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 28.74 2h6b h GLN 180 CO 0.58 0.60 0.20 -0.22 -0.67 0.00 0.00 178.83 179.33 2h6b h LYS 181 N 0.94 0.39 -0.12 1.46 3.64 -1.99 -1.40 116.57 119.49 2h6b h LYS 181 Ca 0.46 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.80 2h6b h LYS 181 Cb 0.43 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2h6b h LYS 181 CO -0.26 0.26 0.02 0.77 -2.27 0.00 0.00 179.45 177.97 2h6b h SER 182 N 0.41 0.19 -0.65 4.20 0.02 -1.70 -0.69 113.55 115.33 2h6b h SER 182 Ca 0.21 -0.26 0.13 0.00 -0.84 0.00 0.00 61.79 61.04 2h6b h SER 182 Cb 0.17 -0.05 -0.10 0.00 0.14 0.00 0.00 62.40 62.56 2h6b h SER 182 CO -0.18 0.40 0.11 0.40 -1.14 0.00 0.00 176.83 176.42 2h6b h ILE 183 N -0.03 0.55 -0.19 3.27 2.04 -0.67 0.02 117.51 122.49 2h6b h ILE 183 Ca 0.04 -0.08 -0.14 0.00 1.00 0.00 0.00 64.86 65.68 2h6b h ILE 183 Cb 0.29 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2h6b h ILE 183 CO 0.00 0.04 -0.46 1.23 0.00 0.00 0.00 178.15 178.96 2h6b h GLY 184 N 0.22 0.52 1.10 5.37 0.00 -0.86 -1.17 103.07 108.25 2h6b h GLY 184 Ca 0.35 -0.55 -0.15 0.00 0.00 0.00 0.00 47.33 46.98 2h6b h GLY 184 CO -0.48 0.50 -0.36 0.83 0.00 0.00 0.00 176.54 177.03 2h6b h GLU 185 N 0.39 0.90 -0.04 4.80 5.08 -0.39 0.71 114.58 126.02 2h6b h GLU 185 Ca 0.02 -0.47 -0.01 0.00 -1.00 0.00 0.00 59.36 57.90 2h6b h GLU 185 Cb 0.96 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 2h6b h GLU 185 CO 0.08 1.12 -0.02 0.82 -1.00 0.00 0.00 179.01 180.01 2h6b h ILE 186 N 0.71 1.34 0.00 3.13 2.04 -0.99 -3.34 117.51 120.40 2h6b h ILE 186 Ca 0.06 -1.06 -0.12 0.00 1.00 0.00 0.00 64.86 64.74 2h6b h ILE 186 Cb 0.95 1.96 -0.02 0.00 -0.74 0.00 0.00 36.82 38.97 2h6b h ILE 186 CO 0.09 0.29 -0.62 0.71 0.00 0.00 0.00 178.15 178.62 2h6b h THR 187 N -0.32 0.96 0.00 -0.27 1.35 -1.26 -3.48 112.91 109.90 2h6b h THR 187 Ca 0.01 -2.38 0.00 0.00 -0.55 0.00 0.00 66.41 63.49 2h6b h THR 187 Cb 0.47 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 2h6b h THR 187 CO 0.01 0.55 0.00 0.61 -0.25 0.00 0.00 175.52 176.44 2h6b n GLY 188 N 1.25 0.53 3.61 5.82 0.00 0.19 -5.01 105.19 111.58 2h6b n GLY 188 Ca 0.01 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 44.85 2h6b n GLY 188 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2h6b s VAL 189 N -2.00 3.78 0.63 1.61 -7.23 -0.87 -5.02 120.40 111.29 2h6b s VAL 189 Ca 0.00 -0.61 -0.18 0.00 -1.81 0.00 0.00 61.98 59.37 2h6b s VAL 189 Cb 0.00 -2.61 -0.02 0.00 0.56 0.00 0.00 36.38 34.31 2h6b s VAL 189 CO 0.00 0.47 1.27 -2.28 -0.31 0.00 0.00 175.10 174.26 2h6b s HIS 190 N -0.94 2.17 0.49 2.82 2.46 -1.26 -4.48 115.29 116.55 2h6b s HIS 190 Ca 0.16 1.49 0.18 0.00 0.47 0.00 0.00 55.06 57.36 2h6b s HIS 190 Cb -0.11 -3.64 1.21 0.00 -0.13 0.00 0.00 32.58 29.91 2h6b s HIS 190 CO 0.05 -2.72 2.03 1.12 -2.47 0.00 0.00 174.74 172.75 2h6b h HIS 191 N 0.67 0.18 -0.26 3.88 2.07 -1.95 -2.48 115.15 117.27 2h6b h HIS 191 Ca -0.51 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 56.98 2h6b h HIS 191 Cb 1.33 -0.06 -0.01 0.00 2.57 0.00 0.00 27.41 31.24 2h6b h HIS 191 CO 0.43 0.09 0.03 0.28 -3.07 0.00 0.00 177.93 175.69 2h6b h VAL 192 N 0.18 1.24 -0.59 6.12 2.07 -2.00 -1.88 116.25 121.39 2h6b h VAL 192 Ca 0.20 -0.82 -0.05 0.00 0.82 0.00 0.00 66.70 66.85 2h6b h VAL 192 Cb 0.57 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2h6b h VAL 192 CO -0.03 0.26 0.15 0.74 0.02 0.00 0.00 177.57 178.71 2h6b h THR 193 N 0.23 1.23 0.33 2.57 2.02 -1.82 -2.17 112.91 115.30 2h6b h THR 193 Ca 0.08 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 2h6b h THR 193 Cb 0.36 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 2h6b h THR 193 CO 0.01 0.32 -0.17 0.58 0.37 0.00 0.00 175.52 176.62 2h6b h VAL 194 N 0.87 0.64 -0.18 3.16 2.07 -1.16 -0.54 116.25 121.10 2h6b h VAL 194 Ca 0.19 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.75 2h6b h VAL 194 Cb 0.30 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2h6b h VAL 194 CO -0.00 0.00 -0.04 0.28 0.02 0.00 0.00 177.57 177.83 2h6b h SER 195 N -0.46 -0.15 -0.25 0.57 0.02 -1.31 0.62 113.55 112.58 2h6b h SER 195 Ca -0.04 0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.02 2h6b h SER 195 Cb 0.37 0.10 -0.06 0.00 0.14 0.00 0.00 62.40 62.96 2h6b h SER 195 CO 0.06 -0.05 -0.11 -0.09 -1.14 0.00 0.00 176.83 175.50 2h6b h ARG 196 N 0.01 -0.06 -0.57 3.45 2.43 -1.07 0.16 114.38 118.73 2h6b h ARG 196 Ca 0.09 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2h6b h ARG 196 Cb 0.13 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.67 2h6b h ARG 196 CO -0.18 -0.04 0.24 0.28 -1.51 0.00 0.00 179.97 178.76 2h6b h VAL 197 N -0.07 1.22 -0.69 0.20 2.07 -0.95 0.42 116.25 118.46 2h6b h VAL 197 Ca 0.13 -0.67 -0.07 0.00 0.82 0.00 0.00 66.70 66.91 2h6b h VAL 197 Cb 0.26 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 2h6b h VAL 197 CO -0.30 0.26 0.15 -0.07 0.02 0.00 0.00 177.57 177.63 2h6b h LEU 198 N 0.78 1.07 -0.70 2.57 4.07 -0.11 -0.45 115.31 122.53 2h6b h LEU 198 Ca 0.19 -0.24 -0.01 0.00 0.08 0.00 0.00 57.88 57.90 2h6b h LEU 198 Cb 0.18 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 41.60 2h6b h LEU 198 CO -0.02 1.04 0.40 0.00 -1.08 0.00 0.00 178.44 178.78 2h6b h ALA 199 N 1.07 0.89 0.15 1.53 0.00 -0.23 -1.90 119.26 120.77 2h6b h ALA 199 Ca 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2h6b h ALA 199 Cb 0.40 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2h6b h ALA 199 CO 0.01 0.38 -0.07 0.00 0.00 0.00 0.00 179.25 179.57 2h6b h LEU 201 N -0.21 0.77 0.19 0.00 3.38 -0.79 -2.21 115.31 116.44 2h6b h LEU 201 Ca -0.02 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2h6b h LEU 201 Cb 0.16 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2h6b h LEU 201 CO 0.03 0.45 -0.09 0.50 0.09 0.00 0.00 178.44 179.42 2h6b h LYS 202 N 0.89 -0.25 0.00 1.13 3.64 -0.87 -1.86 116.57 119.25 2h6b h LYS 202 Ca 0.41 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 2h6b h LYS 202 Cb 0.34 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2h6b h LYS 202 CO -0.23 0.15 0.00 0.07 -2.27 0.00 0.00 179.45 177.16 2h6b h ARG 203 N -0.74 0.00 -0.07 1.90 0.11 -1.20 -0.85 114.38 113.53 2h6b h ARG 203 Ca -0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2h6b h ARG 203 Cb 0.50 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.58 2h6b h ARG 203 CO 0.04 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.50 2h6b n GLU 204 N -2.91 2.02 -3.15 0.08 -0.58 -0.84 -4.97 120.64 110.30 2h6b n GLU 204 Ca -0.01 -1.50 -0.14 0.00 -0.42 0.00 0.00 57.16 55.09 2h6b n GLU 204 Cb 0.17 -1.47 0.05 0.00 -0.57 0.00 0.00 31.44 29.63 2h6b n GLU 204 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2h6b n ASN 205 N 0.80 -4.42 -0.10 1.62 3.02 -0.32 -4.94 115.26 110.92 2h6b n ASN 205 Ca 0.17 -0.34 -0.18 0.00 -0.03 0.00 0.00 54.58 54.20 2h6b n ASN 205 Cb 0.48 -3.30 -0.07 0.00 -0.61 0.00 0.00 39.78 36.27 2h6b n ASN 205 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2h6b n ILE 206 N -3.93 1.05 -3.64 2.41 5.41 -0.72 -4.00 119.36 115.96 2h6b n ILE 206 Ca -0.01 -0.31 -0.10 0.00 1.00 0.00 0.00 62.75 63.32 2h6b n ILE 206 Cb 0.54 -1.57 -0.07 0.00 -0.71 0.00 0.00 39.64 37.84 2h6b n ILE 206 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 2h6b s LEU 207 N -6.74 -0.71 -0.17 1.39 0.20 -1.09 0.00 118.68 111.56 2h6b s LEU 207 Ca -0.26 1.29 0.01 0.00 0.69 0.00 0.00 54.13 55.85 2h6b s LEU 207 Cb 0.09 2.26 0.02 0.00 -0.43 0.00 0.00 46.19 48.14 2h6b s LEU 207 CO 0.36 -0.22 -0.17 -0.62 -0.29 0.00 0.00 176.35 175.42 2h6b s ASP 208 N 0.72 2.95 -0.79 3.68 -1.08 0.66 -2.21 116.67 120.59 2h6b s ASP 208 Ca -0.02 -0.59 -0.15 0.00 -0.52 0.00 0.00 52.55 51.26 2h6b s ASP 208 Cb -0.05 -1.33 0.19 0.00 -1.46 0.00 0.00 42.92 40.26 2h6b s ASP 208 CO -0.07 -0.03 0.79 -0.75 0.52 0.00 0.00 175.17 175.63 2h6b s LYS 209 N 1.38 3.49 0.82 4.34 2.36 -1.26 -0.99 119.74 129.89 2h6b s LYS 209 Ca 0.05 -2.18 -0.12 0.00 -2.55 0.00 0.00 55.97 51.17 2h6b s LYS 209 Cb -0.13 -4.48 0.19 0.00 -1.05 0.00 0.00 37.83 32.35 2h6b s LYS 209 CO -0.12 -1.39 1.12 1.63 1.55 0.00 0.00 175.35 178.14 2h6b n LYS 210 N 4.71 -0.94 0.08 4.03 5.02 -0.41 -4.99 118.16 125.65 2h6b n LYS 210 Ca 0.11 -1.93 -0.05 0.00 -2.02 0.00 0.00 58.31 54.42 2h6b n LYS 210 Cb 0.46 -1.09 0.15 0.00 -0.02 0.00 0.00 35.03 34.52 2h6b n LYS 210 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2h6b h LYS 211 N 0.00 0.27 0.00 1.97 2.10 -1.92 -3.34 116.57 115.65 2h6b h LYS 211 Ca -0.36 -0.17 0.00 0.00 -2.00 0.00 0.00 60.65 58.12 2h6b h LYS 211 Cb 1.05 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 2h6b h LYS 211 CO 0.28 0.74 0.00 0.09 -2.00 0.00 0.00 179.45 178.56 2h6b n ASN 212 N -3.93 0.46 -3.81 7.07 3.02 -1.26 -4.14 115.26 112.67 2h6b n ASN 212 Ca -0.02 -1.14 -0.13 0.00 -0.03 0.00 0.00 54.58 53.26 2h6b n ASN 212 Cb 0.57 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.61 2h6b n ASN 212 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2h6b s LYS 213 N -0.14 0.14 -0.21 3.52 2.20 -1.19 -2.39 119.74 121.65 2h6b s LYS 213 Ca 0.00 0.21 -0.05 0.00 -0.36 0.00 0.00 55.97 55.77 2h6b s LYS 213 Cb 0.00 0.02 -0.02 0.00 -1.51 0.00 0.00 37.83 36.32 2h6b s LYS 213 CO 0.00 -0.04 0.00 0.42 -0.36 0.00 0.00 175.35 175.37 2h6b s ILE 214 N 0.27 3.86 -0.15 5.43 1.01 0.15 -1.29 121.20 130.47 2h6b s ILE 214 Ca -0.02 -0.34 -0.04 0.00 0.00 0.00 0.00 60.65 60.25 2h6b s ILE 214 Cb -0.03 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 2h6b s ILE 214 CO -0.01 0.41 -0.01 -0.63 0.00 0.00 0.00 174.94 174.70 2h6b s ILE 215 N 1.23 4.15 -0.32 2.92 1.01 -0.16 -0.99 121.20 129.03 2h6b s ILE 215 Ca 0.03 -0.27 -0.07 0.00 0.00 0.00 0.00 60.65 60.35 2h6b s ILE 215 Cb -0.15 -2.83 0.03 0.00 0.01 0.00 0.00 42.46 39.53 2h6b s ILE 215 CO 0.01 0.50 0.10 -0.69 0.00 0.00 0.00 174.94 174.86 2h6b s VAL 216 N 0.24 3.88 0.03 2.92 1.01 0.23 -0.25 120.40 128.46 2h6b s VAL 216 Ca -0.01 -0.96 0.09 0.00 0.00 0.00 0.00 61.98 61.10 2h6b s VAL 216 Cb -0.13 -3.12 -0.23 0.00 0.00 0.00 0.00 36.38 32.90 2h6b s VAL 216 CO 0.02 -0.09 0.93 1.88 0.00 0.00 0.00 175.10 177.84 2h6b h TYR 217 N 8.24 0.04 -2.38 5.22 -1.99 -0.67 -1.62 116.97 123.81 2h6b h TYR 217 Ca -0.26 -0.03 -0.59 0.00 2.00 0.00 0.00 58.73 59.85 2h6b h TYR 217 Cb 1.10 -0.00 -0.38 0.00 2.00 0.00 0.00 36.73 39.45 2h6b h TYR 217 CO 0.60 1.04 -0.97 -1.71 -0.00 0.00 0.00 178.16 177.12 2h6b n ASN 218 N -3.21 -0.33 -0.34 3.88 2.85 -0.61 -4.71 115.26 112.80 2h6b n ASN 218 Ca -0.10 -2.41 -0.00 0.00 -0.11 0.00 0.00 54.58 51.95 2h6b n ASN 218 Cb 1.01 -0.56 0.13 0.00 1.24 0.00 0.00 39.78 41.59 2h6b n ASN 218 CO 0.00 0.00 0.00 0.25 -2.11 0.00 0.00 177.26 175.40 2h6b h LEU 219 N 5.58 0.97 -0.65 1.20 5.85 -1.82 -1.60 115.31 124.85 2h6b h LEU 219 Ca 0.26 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 59.01 2h6b h LEU 219 Cb 0.90 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 2h6b h LEU 219 CO 0.39 0.66 0.39 1.23 -0.34 0.00 0.00 178.44 180.76 2h6b h GLY 220 N 1.13 0.93 0.77 3.75 0.00 -1.97 -0.04 103.07 107.64 2h6b h GLY 220 Ca 0.37 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.38 2h6b h GLY 220 CO -0.13 0.23 -0.03 -2.09 0.00 0.00 0.00 176.54 174.52 2h6b h GLU 221 N 0.75 0.30 -0.58 4.80 4.57 -1.92 -1.35 114.58 121.15 2h6b h GLU 221 Ca 0.27 -0.11 0.10 0.00 -1.18 0.00 0.00 59.36 58.44 2h6b h GLU 221 Cb 0.06 -0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 28.55 2h6b h GLU 221 CO -0.12 0.56 0.16 1.25 -1.18 0.00 0.00 179.01 179.68 2h6b h LEU 222 N 0.00 0.09 -0.20 1.64 5.85 -1.07 0.16 115.31 121.78 2h6b h LEU 222 Ca 0.04 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.88 2h6b h LEU 222 Cb 0.45 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 2h6b h LEU 222 CO 0.01 0.06 0.04 0.50 -0.34 0.00 0.00 178.44 178.71 2h6b h LYS 223 N 0.31 0.11 -0.51 1.25 3.64 -0.97 -1.27 116.57 119.14 2h6b h LYS 223 Ca 0.30 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.76 2h6b h LYS 223 Cb 0.41 -0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.10 2h6b h LYS 223 CO -0.35 0.07 -0.37 1.25 -2.27 0.00 0.00 179.45 177.79 2h6b h HIS 224 N 0.12 -1.03 0.00 1.91 2.76 -0.22 -2.72 115.15 115.96 2h6b h HIS 224 Ca 0.09 0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 58.30 2h6b h HIS 224 Cb 0.09 0.53 -0.00 0.00 1.55 0.00 0.00 27.41 29.57 2h6b h HIS 224 CO -0.14 -0.40 -0.17 -0.07 -1.30 0.00 0.00 177.93 175.85 2h6b h LEU 225 N -0.22 0.00 -0.28 0.26 3.38 -0.60 -2.97 115.31 114.88 2h6b h LEU 225 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2h6b h LEU 225 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2h6b h LEU 225 CO -0.63 0.17 0.00 -1.54 0.09 0.00 0.00 178.44 176.53 2h6b n SER 226 N -3.27 0.60 -2.89 -0.43 3.41 -0.49 -4.91 113.62 105.63 2h6b n SER 226 Ca 0.01 0.60 -0.12 0.00 -0.26 0.00 0.00 58.87 59.09 2h6b n SER 226 Cb 0.43 -0.74 0.06 0.00 -0.26 0.00 0.00 64.21 63.70 2h6b n SER 226 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2h6b n GLU 227 N -2.11 -2.45 -2.00 4.33 1.02 -1.12 -4.67 120.64 113.63 2h6b n GLU 227 Ca 0.04 0.68 -0.41 0.00 -0.02 0.00 0.00 57.16 57.46 2h6b n GLU 227 Cb 0.32 -4.98 -0.01 0.00 -0.02 0.00 0.00 31.44 26.75 2h6b n GLU 227 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2h6b s GLN 228 N -4.29 4.27 0.07 3.49 -1.52 -1.26 -5.03 119.66 115.39 2h6b s GLN 228 Ca 0.29 2.34 0.06 0.00 -1.95 0.00 0.00 55.36 56.11 2h6b s GLN 228 Cb -0.04 -3.04 -0.03 0.00 -0.22 0.00 0.00 33.01 29.69 2h6b s GLN 228 CO 0.58 -0.31 -0.17 0.95 -0.25 0.00 0.00 175.29 176.09 2h6b s THR 229 N -1.10 1.40 0.00 -0.19 -4.23 -1.26 -5.07 115.64 105.19 2h6b s THR 229 Ca 0.50 -1.31 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 2h6b s THR 229 Cb -0.42 -1.28 0.00 0.00 1.34 0.00 0.00 72.50 72.14 2h6b s THR 229 CO 0.56 -0.06 0.32 -1.54 -0.54 0.00 0.00 174.62 173.36 2h6b n SER 230 N 1.42 0.00 -0.32 3.99 3.41 -1.26 -4.98 113.62 115.88 2h6b n SER 230 Ca -0.19 -1.03 0.03 0.00 -0.26 0.00 0.00 58.87 57.42 2h6b n SER 230 Cb 0.54 -0.01 0.10 0.00 -0.26 0.00 0.00 64.21 64.58 2h6b n SER 230 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2h6b h TYR 231 N 0.00 -0.59 0.00 7.33 3.20 -1.97 0.17 116.97 125.10 2h6b h TYR 231 Ca 0.00 0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 2h6b h TYR 231 Cb 1.01 0.40 -0.01 0.00 1.54 0.00 0.00 36.73 39.67 2h6b h TYR 231 CO -0.16 -0.39 -0.24 1.88 -1.64 0.00 0.00 178.16 177.61 2h6b h TYR 232 N -0.01 0.00 0.03 -3.82 -1.99 -1.97 -3.13 116.97 106.09 2h6b h TYR 232 Ca 0.41 0.00 -0.33 0.00 2.00 0.00 0.00 58.73 60.81 2h6b h TYR 232 Cb 0.64 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.33 2h6b h TYR 232 CO -0.72 0.24 -1.92 -1.13 -0.00 0.00 0.00 178.16 174.63 2h6b n SER 233 N -3.45 1.18 -4.70 3.88 3.41 -0.62 -4.94 113.62 108.37 2h6b n SER 233 Ca -0.00 0.27 -0.41 0.00 -0.26 0.00 0.00 58.87 58.48 2h6b n SER 233 Cb 0.42 -0.17 0.02 0.00 -0.26 0.00 0.00 64.21 64.21 2h6b n SER 233 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2h6b n ASP 234 N -3.14 2.40 0.28 4.04 -0.08 0.49 -4.90 116.55 115.65 2h6b n ASP 234 Ca -0.25 1.08 0.19 0.00 -1.51 0.00 0.00 54.79 54.30 2h6b n ASP 234 Cb 1.06 -1.49 1.00 0.00 2.34 0.00 0.00 41.12 44.03 2h6b n ASP 234 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2h6b h PRO 235 N 1.92 0.00 -0.72 -0.67 0.13 -1.90 -2.10 132.00 128.65 2h6b h PRO 235 Ca -0.48 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.77 2h6b h PRO 235 Cb 1.30 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.38 2h6b h PRO 235 CO 0.59 0.00 0.48 -0.91 -0.23 0.00 0.00 178.00 177.93 2h6b h ASN 236 N 0.00 0.47 -0.00 1.44 2.35 -1.90 -0.55 115.58 117.38 2h6b h ASN 236 Ca 0.00 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2h6b h ASN 236 Cb 0.04 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.33 2h6b h ASN 236 CO 0.00 0.27 0.00 -1.54 -1.65 0.00 0.00 177.43 174.51 2h6b n SER 237 N -4.49 0.30 0.24 5.81 3.41 -0.79 -3.97 113.62 114.13 2h6b n SER 237 Ca 0.13 -1.11 0.17 0.00 -0.26 0.00 0.00 58.87 57.79 2h6b n SER 237 Cb 0.41 -0.00 0.73 0.00 -0.26 0.00 0.00 64.21 65.09 2h6b n SER 237 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2h6b h SER 238 N 0.46 0.00 -4.60 4.04 4.64 -1.24 -3.43 113.55 113.42 2h6b h SER 238 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2h6b h SER 238 Cb 0.10 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.02 2h6b h SER 238 CO 0.00 0.00 -0.71 -0.94 -0.87 0.00 0.00 176.83 174.31 2h6b s SER 239 N -5.10 1.13 0.32 4.97 1.04 -1.25 -5.05 113.70 109.75 2h6b s SER 239 Ca 0.00 -0.85 0.01 0.00 0.48 0.00 0.00 55.95 55.59 2h6b s SER 239 Cb 0.10 0.06 0.53 0.00 0.10 0.00 0.00 66.02 66.81 2h6b s SER 239 CO 0.45 -0.36 1.92 0.58 0.98 0.00 0.00 173.24 176.82 2h6b h VAL 240 N 3.48 1.19 -1.79 5.02 2.07 -1.89 -3.45 116.25 120.89 2h6b h VAL 240 Ca -0.36 -0.55 -0.55 0.00 0.82 0.00 0.00 66.70 66.06 2h6b h VAL 240 Cb 1.18 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.34 2h6b h VAL 240 CO 0.56 0.23 -0.52 1.51 0.02 0.00 0.00 177.57 179.37 2h6b s ASP 241 N -6.53 4.63 0.66 0.57 1.47 -1.26 -5.11 116.67 111.10 2h6b s ASP 241 Ca -0.10 -0.84 -0.17 0.00 1.18 0.00 0.00 52.55 52.62 2h6b s ASP 241 Cb 0.17 -0.66 -0.01 0.00 -0.34 0.00 0.00 42.92 42.08 2h6b s ASP 241 CO 0.78 -0.38 1.09 0.29 0.68 0.00 0.00 175.17 177.63 2h6b n LYS 242 N -1.19 0.83 0.00 2.11 5.02 -1.26 -5.03 118.16 118.64 2h6b n LYS 242 Ca -0.02 0.34 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 2h6b n LYS 242 Cb 0.62 -2.32 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 2h6b n LYS 242 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77