#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktm n LEU 29 N 0.00 1.41 -3.52 -1.96 4.32 -0.61 -4.89 117.00 111.75 3ktm n LEU 29 Ca 0.00 -0.70 -0.14 0.00 -0.02 0.00 0.00 56.01 55.15 3ktm n LEU 29 Cb 0.00 -0.17 -0.04 0.00 -1.62 0.00 0.00 43.42 41.58 3ktm n LEU 29 CO 0.00 0.35 0.33 0.00 -1.22 0.00 0.00 177.39 176.85 3ktm s ALA 30 N -1.65 -1.45 -0.12 -1.18 0.00 -1.11 -4.78 121.76 111.48 3ktm s ALA 30 Ca 0.18 0.62 -0.25 0.00 0.00 0.00 0.00 51.96 52.51 3ktm s ALA 30 Cb 0.10 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.70 3ktm s ALA 30 CO 0.13 -0.58 0.81 -2.00 0.00 0.00 0.00 175.76 174.12 3ktm s GLU 31 N -2.77 4.37 0.28 0.00 2.12 -1.26 -4.75 118.70 116.70 3ktm s GLU 31 Ca -0.04 1.03 -0.30 0.00 0.36 0.00 0.00 54.97 56.03 3ktm s GLU 31 Cb -0.00 -3.52 -0.10 0.00 0.26 0.00 0.00 34.13 30.76 3ktm s GLU 31 CO -0.04 -0.18 1.45 -1.25 -0.54 0.00 0.00 175.26 174.70 3ktm s PRO 32 N 1.60 4.24 0.05 4.30 0.04 -1.26 -4.81 135.00 139.16 3ktm s PRO 32 Ca 0.40 2.36 -0.27 0.00 0.04 0.00 0.00 61.00 63.53 3ktm s PRO 32 Cb -0.17 -3.07 0.09 0.00 0.04 0.00 0.00 34.50 31.38 3ktm s PRO 32 CO 0.16 -0.43 0.78 1.14 0.04 0.00 0.00 177.00 178.70 3ktm s GLN 33 N -0.81 0.99 0.11 4.56 -2.07 -1.26 -1.68 119.66 119.50 3ktm s GLN 33 Ca 0.57 -0.35 0.10 0.00 -1.82 0.00 0.00 55.36 53.86 3ktm s GLN 33 Cb -0.43 0.45 -0.04 0.00 -1.09 0.00 0.00 33.01 31.91 3ktm s GLN 33 CO 0.48 -0.43 -0.24 0.96 -1.32 0.00 0.00 175.29 174.74 3ktm s ILE 34 N -3.30 1.99 -0.01 3.63 -5.25 -0.51 -0.67 121.20 117.08 3ktm s ILE 34 Ca 0.03 -1.62 0.03 0.00 -0.99 0.00 0.00 60.65 58.11 3ktm s ILE 34 Cb -0.01 -1.77 -0.01 0.00 2.95 0.00 0.00 42.46 43.62 3ktm s ILE 34 CO -0.10 0.05 -0.10 0.00 -1.79 0.00 0.00 174.94 173.00 3ktm s ALA 35 N -1.08 0.84 0.19 2.27 0.00 0.11 -0.51 121.76 123.58 3ktm s ALA 35 Ca 0.10 -0.42 0.07 0.00 0.00 0.00 0.00 51.96 51.72 3ktm s ALA 35 Cb -0.10 -0.23 -0.05 0.00 0.00 0.00 0.00 23.12 22.75 3ktm s ALA 35 CO 0.05 0.20 -0.14 -1.64 0.00 0.00 0.00 175.76 174.22 3ktm s MET 36 N -0.17 1.27 -0.31 0.00 -1.94 -1.26 -0.53 119.30 116.35 3ktm s MET 36 Ca 0.03 -1.53 0.04 0.00 -1.71 0.00 0.00 55.69 52.52 3ktm s MET 36 Cb -0.05 -1.05 0.18 0.00 2.01 0.00 0.00 34.83 35.92 3ktm s MET 36 CO -0.00 0.18 0.51 0.12 -0.01 0.00 0.00 175.02 175.81 3ktm s PHE 37 N -2.89 -1.41 0.06 -0.03 2.19 -1.26 -4.87 117.98 109.77 3ktm s PHE 37 Ca 0.20 0.56 -0.37 0.00 0.33 0.00 0.00 56.93 57.65 3ktm s PHE 37 Cb -0.01 0.08 -0.17 0.00 -1.31 0.00 0.00 43.02 41.61 3ktm s PHE 37 CO 0.06 -1.05 1.37 0.00 1.83 0.00 0.00 175.22 177.42 3ktm n GLY 39 N 2.63 2.61 3.44 0.00 0.00 -1.26 -5.03 105.19 107.57 3ktm n GLY 39 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 3ktm n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ktm s ARG 40 N -0.46 1.58 0.28 1.61 1.81 0.05 -4.68 118.95 119.14 3ktm s ARG 40 Ca 0.00 -1.83 -0.29 0.00 -1.72 0.00 0.00 55.73 51.89 3ktm s ARG 40 Cb 0.00 -1.09 -0.10 0.00 -0.45 0.00 0.00 34.95 33.31 3ktm s ARG 40 CO 0.00 -0.02 1.09 -0.51 -0.68 0.00 0.00 175.30 175.18 3ktm s LEU 41 N -3.46 4.56 0.55 2.53 1.43 0.00 -4.12 118.68 120.17 3ktm s LEU 41 Ca 0.31 2.26 -0.21 0.00 -1.03 0.00 0.00 54.13 55.46 3ktm s LEU 41 Cb 0.05 -3.63 -0.06 0.00 0.03 0.00 0.00 46.19 42.59 3ktm s LEU 41 CO 0.13 -0.13 1.09 0.59 0.23 0.00 0.00 176.35 178.26 3ktm n ASN 42 N 1.21 1.44 -4.63 2.29 3.02 -0.58 -4.67 115.26 113.34 3ktm n ASN 42 Ca -0.01 0.91 -0.26 0.00 -0.03 0.00 0.00 54.58 55.18 3ktm n ASN 42 Cb 0.45 -1.44 -0.08 0.00 -0.61 0.00 0.00 39.78 38.10 3ktm n ASN 42 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3ktm s MET 43 N -2.63 2.26 -0.01 3.52 -1.94 0.31 -0.39 119.30 120.42 3ktm s MET 43 Ca 0.72 -1.21 -0.11 0.00 -1.71 0.00 0.00 55.69 53.37 3ktm s MET 43 Cb -0.45 -2.25 0.01 0.00 2.01 0.00 0.00 34.83 34.15 3ktm s MET 43 CO 0.50 0.43 0.23 -3.38 -0.01 0.00 0.00 175.02 172.79 3ktm s HIS 44 N -1.81 -0.08 0.04 -0.03 -3.43 -0.63 0.05 115.29 109.40 3ktm s HIS 44 Ca 0.27 0.10 -0.31 0.00 -0.80 0.00 0.00 55.06 54.33 3ktm s HIS 44 Cb -0.09 0.03 -0.06 0.00 -1.43 0.00 0.00 32.58 31.03 3ktm s HIS 44 CO 0.17 -0.33 1.28 1.41 -2.00 0.00 0.00 174.74 175.28 3ktm s MET 45 N -1.27 4.37 -0.43 -0.38 1.75 0.16 -1.44 119.30 122.06 3ktm s MET 45 Ca -0.13 1.86 -0.29 0.00 -1.25 0.00 0.00 55.69 55.88 3ktm s MET 45 Cb -0.06 -3.40 0.02 0.00 2.84 0.00 0.00 34.83 34.23 3ktm s MET 45 CO 0.03 -0.38 1.19 1.21 -0.65 0.00 0.00 175.02 176.42 3ktm s ASN 46 N 1.28 6.62 0.00 1.11 3.84 0.10 -4.57 114.94 123.33 3ktm s ASN 46 Ca 0.61 0.67 0.15 0.00 0.21 0.00 0.00 52.86 54.50 3ktm s ASN 46 Cb -0.31 -2.55 0.74 0.00 -0.55 0.00 0.00 41.25 38.59 3ktm s ASN 46 CO 0.28 -1.22 1.46 1.33 -2.79 0.00 0.00 177.10 176.16 3ktm n VAL 47 N 6.70 0.70 -0.09 -5.21 0.24 -1.26 -1.35 118.33 118.06 3ktm n VAL 47 Ca 0.13 0.17 -0.14 0.00 -2.04 0.00 0.00 64.34 62.46 3ktm n VAL 47 Cb 0.48 -0.91 -0.08 0.00 -1.47 0.00 0.00 33.84 31.86 3ktm n VAL 47 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 3ktm h GLN 48 N 0.00 0.00 0.08 7.34 4.20 -1.91 -1.57 115.11 123.26 3ktm h GLN 48 Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 3ktm h GLN 48 Cb 0.19 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 3ktm h GLN 48 CO 0.00 0.60 -2.11 0.27 -0.67 0.00 0.00 178.83 176.92 3ktm n ASN 49 N -4.53 1.96 0.00 1.46 0.23 -1.23 -4.52 115.26 108.62 3ktm n ASN 49 Ca -0.20 0.13 0.00 0.00 -0.53 0.00 0.00 54.58 53.98 3ktm n ASN 49 Cb 0.49 -0.65 0.00 0.00 -2.08 0.00 0.00 39.78 37.54 3ktm n ASN 49 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ktm n GLY 50 N 2.03 1.44 3.63 4.83 0.00 -0.46 -4.97 105.19 111.70 3ktm n GLY 50 Ca -0.35 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 3ktm n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ktm s LYS 51 N -0.07 2.14 0.11 1.61 -0.14 -1.25 -4.84 119.74 117.30 3ktm s LYS 51 Ca 0.00 -1.64 -0.26 0.00 -1.36 0.00 0.00 55.97 52.72 3ktm s LYS 51 Cb 0.00 -2.01 -0.07 0.00 -1.68 0.00 0.00 37.83 34.07 3ktm s LYS 51 CO 0.00 0.21 0.79 -1.58 -0.76 0.00 0.00 175.35 174.01 3ktm s TRP 52 N -2.45 3.83 0.33 3.18 0.52 -1.26 0.03 118.94 123.11 3ktm s TRP 52 Ca 0.34 1.58 0.07 0.00 0.02 0.00 0.00 56.10 58.11 3ktm s TRP 52 Cb -0.03 -2.82 -0.06 0.00 -1.15 0.00 0.00 33.47 29.41 3ktm s TRP 52 CO 0.20 0.38 -0.04 -0.51 0.02 0.00 0.00 176.95 177.00 3ktm s ASP 53 N -0.57 3.15 0.35 2.95 1.01 -0.52 -4.91 116.67 118.13 3ktm s ASP 53 Ca 0.38 -1.26 0.04 0.00 0.71 0.00 0.00 52.55 52.43 3ktm s ASP 53 Cb -0.22 -0.24 -0.01 0.00 1.01 0.00 0.00 42.92 43.45 3ktm s ASP 53 CO 0.25 -0.37 0.51 -0.55 0.21 0.00 0.00 175.17 175.22 3ktm s SER 54 N -3.54 6.01 -0.36 0.27 0.15 -1.26 -1.61 113.70 113.35 3ktm s SER 54 Ca 0.32 0.00 -0.42 0.00 0.70 0.00 0.00 55.95 56.55 3ktm s SER 54 Cb 0.05 -1.44 -0.17 0.00 -1.71 0.00 0.00 66.02 62.75 3ktm s SER 54 CO 0.15 -0.44 1.72 -0.67 1.20 0.00 0.00 173.24 175.20 3ktm n ASP 55 N -1.72 1.99 -0.38 5.45 2.03 0.48 -4.82 116.55 119.58 3ktm n ASP 55 Ca -0.01 1.09 0.30 0.00 0.52 0.00 0.00 54.79 56.69 3ktm n ASP 55 Cb 0.58 -1.06 0.60 0.00 -0.72 0.00 0.00 41.12 40.52 3ktm n ASP 55 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3ktm h PRO 56 N 6.69 0.22 -0.01 -0.67 0.11 -1.94 0.84 132.00 137.23 3ktm h PRO 56 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3ktm h PRO 56 Cb 1.34 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3ktm h PRO 56 CO 0.97 0.14 -0.40 -1.13 -0.21 0.00 0.00 178.00 177.38 3ktm n SER 57 N -4.59 1.70 -2.28 -2.05 3.41 -1.26 -4.96 113.62 103.60 3ktm n SER 57 Ca 0.30 -1.31 -0.19 0.00 -0.26 0.00 0.00 58.87 57.40 3ktm n SER 57 Cb 1.15 0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 65.46 3ktm n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3ktm n GLY 58 N 1.39 -0.42 0.00 5.00 0.00 0.29 -4.86 105.19 106.59 3ktm n GLY 58 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3ktm n GLY 58 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ktm n THR 59 N -4.08 0.00 -2.63 2.61 -2.24 -1.26 -4.65 114.28 102.02 3ktm n THR 59 Ca -0.21 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.15 3ktm n THR 59 Cb 0.66 -0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 3ktm n THR 59 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3ktm s LYS 60 N -1.06 4.33 0.49 -0.78 -0.14 -1.26 -5.01 119.74 116.31 3ktm s LYS 60 Ca 0.00 1.43 0.08 0.00 -1.36 0.00 0.00 55.97 56.12 3ktm s LYS 60 Cb 0.00 -3.60 0.04 0.00 -1.68 0.00 0.00 37.83 32.58 3ktm s LYS 60 CO 0.00 -0.50 0.60 0.99 -0.76 0.00 0.00 175.35 175.69 3ktm s THR 61 N 2.67 2.47 0.42 2.17 2.01 -1.26 -1.53 115.64 122.59 3ktm s THR 61 Ca 0.48 -1.11 -0.23 0.00 0.31 0.00 0.00 61.69 61.13 3ktm s THR 61 Cb -0.18 -2.58 -0.12 0.00 0.01 0.00 0.00 72.50 69.63 3ktm s THR 61 CO 0.13 0.00 0.69 0.00 -0.69 0.00 0.00 174.62 174.75 3ktm s ILE 63 N -1.40 4.25 -0.23 0.00 1.01 -1.26 -5.02 121.20 118.55 3ktm s ILE 63 Ca 0.64 -0.48 0.22 0.00 0.00 0.00 0.00 60.65 61.03 3ktm s ILE 63 Cb -0.59 -2.87 -0.19 0.00 0.01 0.00 0.00 42.46 38.82 3ktm s ILE 63 CO 0.57 0.44 0.76 -0.67 0.00 0.00 0.00 174.94 176.05 3ktm n ASP 64 N 1.60 0.41 -4.42 3.58 4.64 -1.26 -4.94 116.55 116.17 3ktm n ASP 64 Ca -0.16 0.03 -0.26 0.00 -1.38 0.00 0.00 54.79 53.03 3ktm n ASP 64 Cb 0.53 1.27 -0.11 0.00 -1.04 0.00 0.00 41.12 41.77 3ktm n ASP 64 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 3ktm s THR 65 N -3.40 2.31 0.32 5.18 -4.23 -1.26 -5.02 115.64 109.55 3ktm s THR 65 Ca -0.03 -2.08 0.03 0.00 -1.18 0.00 0.00 61.69 58.43 3ktm s THR 65 Cb 0.13 -2.12 0.15 0.00 1.34 0.00 0.00 72.50 71.99 3ktm s THR 65 CO 0.85 -0.19 1.85 0.11 -0.54 0.00 0.00 174.62 176.71 3ktm h LYS 66 N 3.06 0.55 -0.52 3.99 1.79 -1.93 -0.05 116.57 123.44 3ktm h LYS 66 Ca -0.45 -0.13 -0.09 0.00 -2.18 0.00 0.00 60.65 57.80 3ktm h LYS 66 Cb 1.22 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.77 3ktm h LYS 66 CO 0.50 0.59 -0.04 1.49 -1.08 0.00 0.00 179.45 180.91 3ktm h GLU 67 N 0.53 0.92 -0.29 3.15 4.81 -1.95 -0.79 114.58 120.96 3ktm h GLU 67 Ca 0.11 -0.29 -0.18 0.00 -0.13 0.00 0.00 59.36 58.87 3ktm h GLU 67 Cb 0.37 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.66 3ktm h GLU 67 CO 0.01 0.93 -0.52 0.78 -0.73 0.00 0.00 179.01 179.49 3ktm h GLY 68 N 0.98 0.91 1.03 1.92 0.00 -1.76 -2.13 103.07 104.02 3ktm h GLY 68 Ca 0.15 -1.04 -0.04 0.00 0.00 0.00 0.00 47.33 46.40 3ktm h GLY 68 CO 0.03 0.93 0.28 -2.22 0.00 0.00 0.00 176.54 175.56 3ktm h ILE 69 N 0.65 1.25 -0.69 2.60 2.04 -0.80 -0.82 117.51 121.74 3ktm h ILE 69 Ca 0.02 -0.78 -0.05 0.00 1.00 0.00 0.00 64.86 65.05 3ktm h ILE 69 Cb 1.12 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3ktm h ILE 69 CO 0.11 0.31 0.24 0.25 0.00 0.00 0.00 178.15 179.07 3ktm h LEU 70 N 1.01 0.96 -0.36 1.44 5.85 -1.05 -1.45 115.31 121.71 3ktm h LEU 70 Ca 0.23 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 3ktm h LEU 70 Cb 0.22 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 3ktm h LEU 70 CO -0.02 0.88 0.04 1.56 -0.34 0.00 0.00 178.44 180.56 3ktm h GLN 71 N 1.01 0.62 -0.75 1.25 4.20 -0.88 -2.06 115.11 118.50 3ktm h GLN 71 Ca 0.23 -0.18 0.02 0.00 0.06 0.00 0.00 58.65 58.78 3ktm h GLN 71 Cb 0.25 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.92 3ktm h GLN 71 CO -0.01 0.70 0.48 -0.92 -0.67 0.00 0.00 178.83 178.41 3ktm h TYR 72 N 0.45 0.91 -0.17 2.96 3.20 -0.85 0.17 116.97 123.63 3ktm h TYR 72 Ca 0.11 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.04 3ktm h TYR 72 Cb 0.40 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 3ktm h TYR 72 CO 0.03 0.55 -0.06 0.00 -1.64 0.00 0.00 178.16 177.03 3ktm h GLN 74 N -0.04 0.58 -0.38 0.00 4.20 -0.64 -1.34 115.11 117.49 3ktm h GLN 74 Ca 0.09 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.57 3ktm h GLN 74 Cb 0.17 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 3ktm h GLN 74 CO -0.20 0.59 -0.16 1.49 -0.67 0.00 0.00 178.83 179.89 3ktm h GLU 75 N 0.55 0.77 0.00 1.46 4.81 0.03 -3.06 114.58 119.14 3ktm h GLU 75 Ca 0.12 -0.33 -0.10 0.00 -0.13 0.00 0.00 59.36 58.92 3ktm h GLU 75 Cb 0.34 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 3ktm h GLU 75 CO 0.01 0.94 -0.48 0.28 -0.73 0.00 0.00 179.01 179.04 3ktm h VAL 76 N 0.57 1.05 -2.24 0.32 2.07 -0.81 -3.33 116.25 113.87 3ktm h VAL 76 Ca 0.09 -1.83 -0.59 0.00 0.82 0.00 0.00 66.70 65.19 3ktm h VAL 76 Cb 0.70 2.08 -0.42 0.00 -1.52 0.00 0.00 31.29 32.13 3ktm h VAL 76 CO 0.05 0.47 -0.67 -1.22 0.02 0.00 0.00 177.57 176.22 3ktm n TYR 77 N -3.55 3.65 0.27 1.57 4.01 -0.53 -4.91 117.16 117.67 3ktm n TYR 77 Ca -0.00 -4.02 0.17 0.00 -0.16 0.00 0.00 57.90 53.90 3ktm n TYR 77 Cb 0.58 -0.50 0.93 0.00 -0.31 0.00 0.00 39.34 40.04 3ktm n TYR 77 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3ktm h PRO 78 N 3.28 0.00 -0.00 -0.72 0.13 -1.65 -1.20 132.00 131.84 3ktm h PRO 78 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3ktm h PRO 78 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 3ktm h PRO 78 CO 0.80 0.00 -0.08 -1.91 -0.23 0.00 0.00 178.00 176.58 3ktm n GLU 79 N -3.60 0.78 -4.36 0.86 2.13 -1.26 -4.86 120.64 110.33 3ktm n GLU 79 Ca -0.01 -0.24 -0.27 0.00 0.66 0.00 0.00 57.16 57.30 3ktm n GLU 79 Cb 0.21 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.32 3ktm n GLU 79 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3ktm s LEU 80 N -2.39 2.64 -1.15 4.31 1.43 -0.45 -5.06 118.68 118.01 3ktm s LEU 80 Ca 0.32 -0.72 -0.13 0.00 -1.03 0.00 0.00 54.13 52.57 3ktm s LEU 80 Cb 0.20 -1.39 0.19 0.00 0.03 0.00 0.00 46.19 45.22 3ktm s LEU 80 CO 0.45 0.13 1.32 -1.58 0.23 0.00 0.00 176.35 176.90 3ktm s GLN 81 N -2.59 4.05 -0.13 1.70 0.74 -1.26 -4.97 119.66 117.19 3ktm s GLN 81 Ca 0.21 -2.62 -0.29 0.00 0.05 0.00 0.00 55.36 52.71 3ktm s GLN 81 Cb -0.09 -4.93 -0.03 0.00 1.10 0.00 0.00 33.01 29.06 3ktm s GLN 81 CO 0.11 -1.65 1.43 0.42 -0.55 0.00 0.00 175.29 175.05 3ktm s ILE 82 N 1.10 3.99 -0.63 -2.34 -1.09 -1.26 -0.95 121.20 120.01 3ktm s ILE 82 Ca 0.39 1.19 0.09 0.00 -2.23 0.00 0.00 60.65 60.08 3ktm s ILE 82 Cb -0.05 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 37.00 3ktm s ILE 82 CO -0.03 -0.13 0.49 0.35 -1.23 0.00 0.00 174.94 174.39 3ktm n THR 83 N 5.49 0.00 -3.79 2.92 -2.24 -0.54 -4.92 114.28 111.20 3ktm n THR 83 Ca 0.15 -0.36 0.02 0.00 -2.27 0.00 0.00 64.05 61.59 3ktm n THR 83 Cb 0.44 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 3ktm n THR 83 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ktm s ASN 84 N -1.49 -0.03 0.04 3.42 3.84 -1.22 -5.02 114.94 114.48 3ktm s ASN 84 Ca 0.06 -0.20 -0.01 0.00 0.21 0.00 0.00 52.86 52.92 3ktm s ASN 84 Cb 0.07 0.18 -0.03 0.00 -0.55 0.00 0.00 41.25 40.91 3ktm s ASN 84 CO 0.28 -0.34 -0.02 0.68 -2.79 0.00 0.00 177.10 174.90 3ktm s VAL 85 N -2.25 0.19 -0.21 -5.21 -7.23 -1.26 -1.31 120.40 103.12 3ktm s VAL 85 Ca 0.21 -1.53 -0.19 0.00 -1.81 0.00 0.00 61.98 58.66 3ktm s VAL 85 Cb 0.02 -1.16 0.05 0.00 0.56 0.00 0.00 36.38 35.86 3ktm s VAL 85 CO -0.02 -0.84 0.56 0.54 -0.31 0.00 0.00 175.10 175.03 3ktm s VAL 86 N -3.21 -0.00 0.51 1.32 0.11 -0.99 -3.09 120.40 115.05 3ktm s VAL 86 Ca 0.00 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 58.83 3ktm s VAL 86 Cb 0.03 -0.78 -0.06 0.00 -1.53 0.00 0.00 36.38 34.03 3ktm s VAL 86 CO -0.07 0.00 1.29 -0.62 -3.33 0.00 0.00 175.10 172.36 3ktm n GLU 87 N 2.81 1.68 -2.03 1.54 4.71 -1.26 -0.13 120.64 127.95 3ktm n GLU 87 Ca -0.14 0.61 -0.32 0.00 -0.01 0.00 0.00 57.16 57.30 3ktm n GLU 87 Cb 0.56 -2.47 0.01 0.00 -1.01 0.00 0.00 31.44 28.53 3ktm n GLU 87 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3ktm s ALA 88 N -1.29 2.80 -0.19 0.62 0.00 -0.48 -4.74 121.76 118.47 3ktm s ALA 88 Ca 0.69 0.29 0.27 0.00 0.00 0.00 0.00 51.96 53.21 3ktm s ALA 88 Cb -0.44 -3.20 0.77 0.00 0.00 0.00 0.00 23.12 20.25 3ktm s ALA 88 CO 0.52 -0.77 1.77 -0.91 0.00 0.00 0.00 175.76 176.36 3ktm h ASN 89 N 0.32 0.00 -4.48 0.00 2.35 -1.94 -3.46 115.58 108.37 3ktm h ASN 89 Ca -0.46 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.11 3ktm h ASN 89 Cb 1.21 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 39.35 3ktm h ASN 89 CO 0.58 0.02 -0.63 0.00 -1.65 0.00 0.00 177.43 175.75 3ktm s GLN 90 N -3.40 0.25 0.69 0.81 0.00 -1.26 -4.99 119.66 111.75 3ktm s GLN 90 Ca 0.04 -0.28 -0.13 0.00 -0.00 0.00 0.00 55.36 54.99 3ktm s GLN 90 Cb 0.07 0.10 0.01 0.00 0.00 0.00 0.00 33.01 33.19 3ktm s GLN 90 CO 0.62 -0.05 1.09 -1.25 0.00 0.00 0.00 175.29 175.70 3ktm s PRO 91 N -0.83 2.72 0.19 9.60 0.04 -1.26 -4.65 135.00 140.82 3ktm s PRO 91 Ca -0.09 1.25 0.06 0.00 0.04 0.00 0.00 61.00 62.25 3ktm s PRO 91 Cb -0.06 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 3ktm s PRO 91 CO 0.00 -1.29 -0.10 0.54 0.04 0.00 0.00 177.00 176.19 3ktm s VAL 92 N -2.60 1.40 -0.23 -0.36 0.11 0.87 -4.89 120.40 114.69 3ktm s VAL 92 Ca 0.64 -2.12 -0.07 0.00 -2.93 0.00 0.00 61.98 57.49 3ktm s VAL 92 Cb -0.18 -2.05 -0.03 0.00 -1.53 0.00 0.00 36.38 32.59 3ktm s VAL 92 CO 0.47 -0.59 0.07 0.42 -3.33 0.00 0.00 175.10 172.14 3ktm s THR 93 N -3.18 4.50 -0.08 5.04 -4.23 -1.26 -0.42 115.64 116.02 3ktm s THR 93 Ca 0.22 -0.12 0.05 0.00 -1.18 0.00 0.00 61.69 60.66 3ktm s THR 93 Cb 0.02 -3.08 -0.01 0.00 1.34 0.00 0.00 72.50 70.77 3ktm s THR 93 CO 0.05 0.37 -0.24 -0.63 -0.54 0.00 0.00 174.62 173.63 3ktm s ILE 94 N 1.25 2.12 0.31 2.99 1.01 0.50 -4.94 121.20 124.44 3ktm s ILE 94 Ca 0.05 -1.03 0.09 0.00 0.00 0.00 0.00 60.65 59.77 3ktm s ILE 94 Cb -0.14 -1.78 -0.05 0.00 0.01 0.00 0.00 42.46 40.49 3ktm s ILE 94 CO 0.04 0.57 0.00 -1.10 0.00 0.00 0.00 174.94 174.45 3ktm s GLN 95 N 0.03 2.14 -0.59 2.79 -0.21 -1.26 -1.18 119.66 121.38 3ktm s GLN 95 Ca -0.09 -1.63 -0.02 0.00 0.02 0.00 0.00 55.36 53.63 3ktm s GLN 95 Cb -0.15 -2.01 0.00 0.00 1.00 0.00 0.00 33.01 31.85 3ktm s GLN 95 CO 0.06 0.21 0.50 0.09 -2.12 0.00 0.00 175.29 174.03 3ktm n ASN 96 N -0.93 -3.21 -4.71 5.90 3.02 -1.24 -4.92 115.26 109.17 3ktm n ASN 96 Ca -0.05 -0.26 -0.42 0.00 -0.03 0.00 0.00 54.58 53.82 3ktm n ASN 96 Cb 0.61 -2.57 -0.03 0.00 -0.61 0.00 0.00 39.78 37.19 3ktm n ASN 96 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3ktm s TRP 97 N -3.15 3.33 0.40 3.10 0.52 -1.25 -4.80 118.94 117.10 3ktm s TRP 97 Ca 0.16 1.22 -0.04 0.00 0.02 0.00 0.00 56.10 57.46 3ktm s TRP 97 Cb -0.07 -3.46 -0.04 0.00 -1.15 0.00 0.00 33.47 28.75 3ktm s TRP 97 CO 0.33 -1.47 0.68 0.00 0.02 0.00 0.00 176.95 176.51 3ktm s LYS 99 N -4.30 2.20 0.14 0.00 2.20 -1.26 -0.82 119.74 117.90 3ktm s LYS 99 Ca 0.45 -0.89 -0.31 0.00 -0.36 0.00 0.00 55.97 54.86 3ktm s LYS 99 Cb -0.10 -2.22 -0.10 0.00 -1.51 0.00 0.00 37.83 33.90 3ktm s LYS 99 CO 0.38 0.57 1.69 0.50 -0.36 0.00 0.00 175.35 178.13 3ktm s ARG 100 N -1.11 4.17 0.00 4.03 3.52 -1.26 -2.31 118.95 125.99 3ktm s ARG 100 Ca 0.13 2.47 0.00 0.00 -0.13 0.00 0.00 55.73 58.20 3ktm s ARG 100 Cb -0.10 -3.34 0.00 0.00 -1.56 0.00 0.00 34.95 29.94 3ktm s ARG 100 CO 0.03 -0.73 0.00 0.41 -0.81 0.00 0.00 175.30 174.20 3ktm n GLY 101 N 3.98 2.72 3.77 8.12 0.00 -1.26 -5.03 105.19 117.49 3ktm n GLY 101 Ca 0.16 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 3ktm n GLY 101 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ktm s ARG 102 N 0.00 3.71 -0.01 1.61 0.52 -0.98 -4.95 118.95 118.86 3ktm s ARG 102 Ca 0.00 2.35 -0.13 0.00 -0.52 0.00 0.00 55.73 57.43 3ktm s ARG 102 Cb 0.00 -2.65 -0.33 0.00 0.52 0.00 0.00 34.95 32.49 3ktm s ARG 102 CO 0.00 -0.77 0.84 0.87 0.02 0.00 0.00 175.30 176.26 3ktm h LYS 103 N 2.34 0.46 -6.12 3.54 1.79 -1.96 -3.42 116.57 113.21 3ktm h LYS 103 Ca -0.51 -0.79 -0.57 0.00 -2.18 0.00 0.00 60.65 56.60 3ktm h LYS 103 Cb 1.26 0.29 -0.05 0.00 -1.58 0.00 0.00 32.23 32.15 3ktm h LYS 103 CO 0.61 1.37 0.72 -0.65 -1.08 0.00 0.00 179.45 180.42 3ktm s GLN 104 N -2.59 4.30 -0.92 3.15 -0.21 -1.26 -4.99 119.66 117.13 3ktm s GLN 104 Ca -0.12 1.35 -0.09 0.00 0.02 0.00 0.00 55.36 56.51 3ktm s GLN 104 Cb 0.05 -3.61 0.24 0.00 1.00 0.00 0.00 33.01 30.68 3ktm s GLN 104 CO 0.90 -0.54 0.87 0.00 -2.12 0.00 0.00 175.29 174.40 3ktm s LYS 106 N -0.59 4.25 -1.10 0.00 -2.85 -1.26 -4.67 119.74 113.52 3ktm s LYS 106 Ca 0.24 2.27 -0.24 0.00 -1.00 0.00 0.00 55.97 57.24 3ktm s LYS 106 Cb -0.11 -3.18 -0.14 0.00 -2.06 0.00 0.00 37.83 32.34 3ktm s LYS 106 CO -0.08 -0.55 1.97 2.41 0.10 0.00 0.00 175.35 179.19 3ktm n THR 107 N 3.92 1.38 -3.77 3.79 -1.04 -1.26 -3.64 114.28 113.66 3ktm n THR 107 Ca 0.13 -1.42 -0.28 0.00 -2.04 0.00 0.00 64.05 60.44 3ktm n THR 107 Cb 0.40 -2.13 -0.11 0.00 -1.82 0.00 0.00 70.33 66.67 3ktm n THR 107 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 3ktm n HIS 108 N 15.21 3.41 -1.09 -1.42 -0.00 -1.26 -4.75 115.22 125.31 3ktm n HIS 108 Ca 0.44 -4.26 -0.39 0.00 -0.00 0.00 0.00 57.72 53.51 3ktm n HIS 108 Cb 0.46 -0.64 -0.03 0.00 -0.00 0.00 0.00 29.99 29.78 3ktm n HIS 108 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 3ktm n PRO 109 N 1.70 0.00 -4.03 1.57 -0.02 -1.26 -4.70 135.00 128.26 3ktm n PRO 109 Ca 0.22 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.57 3ktm n PRO 109 Cb 0.36 -0.88 -0.14 0.00 -0.02 0.00 0.00 33.50 32.83 3ktm n PRO 109 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 3ktm s HIS 110 N -0.54 0.30 -0.34 6.00 3.76 -0.32 -4.97 115.29 119.16 3ktm s HIS 110 Ca 0.55 -0.12 -0.12 0.00 -0.15 0.00 0.00 55.06 55.22 3ktm s HIS 110 Cb -0.79 -0.19 -0.00 0.00 1.11 0.00 0.00 32.58 32.71 3ktm s HIS 110 CO 0.43 -0.02 0.22 0.12 -0.85 0.00 0.00 174.74 174.64 3ktm s PHE 111 N -0.27 3.22 0.08 1.40 5.36 -1.26 -0.37 117.98 126.14 3ktm s PHE 111 Ca -0.01 -0.45 0.01 0.00 -0.96 0.00 0.00 56.93 55.52 3ktm s PHE 111 Cb -0.02 -2.45 -0.04 0.00 -0.34 0.00 0.00 43.02 40.16 3ktm s PHE 111 CO -0.00 -0.45 -0.06 0.14 -1.46 0.00 0.00 175.22 173.39 3ktm s VAL 112 N 1.67 0.56 -0.40 3.12 -7.23 0.45 -4.89 120.40 113.67 3ktm s VAL 112 Ca 0.05 -1.90 -0.16 0.00 -1.81 0.00 0.00 61.98 58.16 3ktm s VAL 112 Cb -0.18 -1.63 0.01 0.00 0.56 0.00 0.00 36.38 35.14 3ktm s VAL 112 CO 0.09 -0.91 0.38 -0.63 -0.31 0.00 0.00 175.10 173.72 3ktm s ILE 113 N -3.71 5.15 1.05 -0.62 1.01 -1.26 -0.09 121.20 122.73 3ktm s ILE 113 Ca 0.10 -0.34 -0.13 0.00 0.00 0.00 0.00 60.65 60.28 3ktm s ILE 113 Cb 0.06 -3.96 0.22 0.00 0.01 0.00 0.00 42.46 38.79 3ktm s ILE 113 CO -0.06 -0.32 1.08 -2.84 0.00 0.00 0.00 174.94 172.80 3ktm s PRO 114 N 1.99 0.04 -0.12 2.79 0.02 -1.26 -4.76 135.00 133.69 3ktm s PRO 114 Ca 0.10 0.50 0.02 0.00 0.02 0.00 0.00 61.00 61.63 3ktm s PRO 114 Cb -0.17 -1.69 -0.01 0.00 0.02 0.00 0.00 34.50 32.65 3ktm s PRO 114 CO 0.12 -2.99 -0.18 0.71 -0.33 0.00 0.00 177.00 174.33 3ktm s TYR 115 N -2.90 2.71 0.02 6.54 1.51 0.33 -1.39 117.35 124.17 3ktm s TYR 115 Ca 0.66 -0.89 -0.25 0.00 -1.01 0.00 0.00 57.07 55.58 3ktm s TYR 115 Cb -0.19 -1.80 -0.05 0.00 -0.11 0.00 0.00 41.96 39.81 3ktm s TYR 115 CO 0.59 -0.35 0.78 1.03 -1.11 0.00 0.00 175.55 176.49 3ktm s ARG 116 N 0.44 4.50 -0.61 -0.62 0.52 0.82 -1.43 118.95 122.56 3ktm s ARG 116 Ca -0.13 1.07 -0.21 0.00 -0.52 0.00 0.00 55.73 55.95 3ktm s ARG 116 Cb -0.17 -3.39 0.08 0.00 0.52 0.00 0.00 34.95 31.99 3ktm s ARG 116 CO 0.06 0.19 0.82 0.00 0.02 0.00 0.00 175.30 176.39 3ktm s LEU 118 N 3.36 4.48 -0.03 0.00 1.43 -0.42 -4.66 118.68 122.84 3ktm s LEU 118 Ca 0.18 2.34 0.04 0.00 -1.03 0.00 0.00 54.13 55.66 3ktm s LEU 118 Cb -0.20 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 3ktm s LEU 118 CO 0.09 -0.34 -0.14 0.68 0.23 0.00 0.00 176.35 176.87 3ktm s VAL 119 N -0.60 3.05 0.00 -1.59 -7.23 -1.26 -1.47 120.40 111.29 3ktm s VAL 119 Ca 0.50 -0.81 0.00 0.00 -1.81 0.00 0.00 61.98 59.85 3ktm s VAL 119 Cb -0.34 -2.22 0.00 0.00 0.56 0.00 0.00 36.38 34.38 3ktm s VAL 119 CO 0.41 0.53 0.00 0.61 -0.31 0.00 0.00 175.10 176.34 3ktm n GLY 120 N 2.12 0.84 3.72 2.32 0.00 -0.13 -4.68 105.19 109.38 3ktm n GLY 120 Ca -0.17 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 3ktm n GLY 120 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ktm s GLU 121 N 0.00 4.20 0.23 1.61 2.12 -1.26 -4.68 118.70 120.92 3ktm s GLU 121 Ca 0.00 2.39 -0.30 0.00 0.36 0.00 0.00 54.97 57.42 3ktm s GLU 121 Cb 0.00 -3.16 -0.10 0.00 0.26 0.00 0.00 34.13 31.13 3ktm s GLU 121 CO 0.00 -0.63 1.48 0.12 -0.54 0.00 0.00 175.26 175.69 3ktm s PHE 122 N 1.19 3.02 -0.02 5.30 5.36 -1.26 -5.03 117.98 126.54 3ktm s PHE 122 Ca 0.71 0.91 0.01 0.00 -0.96 0.00 0.00 56.93 57.59 3ktm s PHE 122 Cb -0.44 -3.86 0.02 0.00 -0.34 0.00 0.00 43.02 38.40 3ktm s PHE 122 CO 0.31 -2.91 -0.01 0.08 -1.46 0.00 0.00 175.22 171.24 3ktm s VAL 123 N 0.33 0.17 0.51 3.12 1.01 -1.26 -5.10 120.40 119.18 3ktm s VAL 123 Ca 0.62 0.03 -0.22 0.00 0.00 0.00 0.00 61.98 62.41 3ktm s VAL 123 Cb -0.43 -0.23 -0.06 0.00 0.00 0.00 0.00 36.38 35.67 3ktm s VAL 123 CO 0.40 0.11 1.29 -0.94 0.00 0.00 0.00 175.10 175.97 3ktm s SER 124 N 0.68 5.60 0.43 3.32 1.04 -1.26 -4.94 113.70 118.55 3ktm s SER 124 Ca -0.07 2.62 -0.26 0.00 0.48 0.00 0.00 55.95 58.72 3ktm s SER 124 Cb -0.10 -2.63 -0.09 0.00 0.10 0.00 0.00 66.02 63.31 3ktm s SER 124 CO -0.01 -1.34 1.38 0.47 0.98 0.00 0.00 173.24 174.72 3ktm n ASP 125 N -0.81 3.11 -4.76 7.02 8.00 -1.26 -4.97 116.55 122.87 3ktm n ASP 125 Ca 0.09 1.13 -0.40 0.00 0.71 0.00 0.00 54.79 56.33 3ktm n ASP 125 Cb 0.46 -1.57 -0.05 0.00 -0.02 0.00 0.00 41.12 39.94 3ktm n ASP 125 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ktm s ALA 126 N -1.18 3.41 0.03 2.24 0.00 -1.26 -4.95 121.76 120.05 3ktm s ALA 126 Ca 0.60 0.29 0.09 0.00 0.00 0.00 0.00 51.96 52.94 3ktm s ALA 126 Cb -0.48 -2.96 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 3ktm s ALA 126 CO 0.59 0.16 -0.25 -0.51 0.00 0.00 0.00 175.76 175.75 3ktm s LEU 127 N -0.49 2.14 -0.01 0.00 1.43 -1.26 -5.10 118.68 115.39 3ktm s LEU 127 Ca 0.37 -0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 52.63 3ktm s LEU 127 Cb -0.21 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.75 3ktm s LEU 127 CO 0.24 0.25 0.94 -0.76 0.23 0.00 0.00 176.35 177.25 3ktm s LEU 128 N -1.07 4.36 -0.42 1.79 1.43 -1.26 -5.01 118.68 118.49 3ktm s LEU 128 Ca 0.11 1.59 -0.07 0.00 -1.03 0.00 0.00 54.13 54.72 3ktm s LEU 128 Cb -0.10 -3.50 0.10 0.00 0.03 0.00 0.00 46.19 42.72 3ktm s LEU 128 CO 0.01 -0.24 0.25 -0.69 0.23 0.00 0.00 176.35 175.92 3ktm s VAL 129 N 0.98 3.91 0.57 -1.59 1.01 -1.26 -4.93 120.40 119.09 3ktm s VAL 129 Ca 0.50 -1.67 -0.19 0.00 0.00 0.00 0.00 61.98 60.62 3ktm s VAL 129 Cb -0.20 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3ktm s VAL 129 CO 0.26 -0.60 1.20 -2.16 0.00 0.00 0.00 175.10 173.80 3ktm s PRO 130 N 1.33 3.13 0.26 2.72 0.04 -1.26 -4.89 135.00 136.32 3ktm s PRO 130 Ca 0.04 1.80 -0.29 0.00 0.04 0.00 0.00 61.00 62.59 3ktm s PRO 130 Cb -0.24 -2.00 -0.14 0.00 0.04 0.00 0.00 34.50 32.16 3ktm s PRO 130 CO -0.00 -1.07 1.05 -0.25 0.04 0.00 0.00 177.00 176.76 3ktm n ASP 131 N -1.40 1.30 0.00 6.66 10.43 -1.26 -1.51 116.55 130.77 3ktm n ASP 131 Ca 0.13 1.17 0.00 0.00 2.57 0.00 0.00 54.79 58.65 3ktm n ASP 131 Cb 0.49 -1.27 0.00 0.00 1.84 0.00 0.00 41.12 42.19 3ktm n ASP 131 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3ktm n LYS 132 N 1.04 0.00 -2.87 -1.24 4.76 -1.26 -4.98 118.16 113.60 3ktm n LYS 132 Ca 0.11 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.31 3ktm n LYS 132 Cb 0.30 -2.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.00 3ktm n LYS 132 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ktm s LYS 134 N -4.63 1.94 -0.24 0.00 3.01 0.15 -4.87 119.74 115.11 3ktm s LYS 134 Ca 0.49 -0.84 -0.20 0.00 -1.01 0.00 0.00 55.97 54.40 3ktm s LYS 134 Cb -0.10 -1.86 -0.02 0.00 -1.01 0.00 0.00 37.83 34.83 3ktm s LYS 134 CO 0.40 0.50 0.62 0.12 0.51 0.00 0.00 175.35 177.49 3ktm s PHE 135 N -0.53 3.30 0.31 3.18 2.19 -1.26 -1.14 117.98 124.03 3ktm s PHE 135 Ca 0.08 0.83 0.04 0.00 0.33 0.00 0.00 56.93 58.21 3ktm s PHE 135 Cb -0.09 -2.82 -0.06 0.00 -1.31 0.00 0.00 43.02 38.73 3ktm s PHE 135 CO -0.01 -0.29 0.03 -0.51 1.83 0.00 0.00 175.22 176.27 3ktm s LEU 136 N 2.36 2.28 -0.04 6.12 1.43 0.09 -5.00 118.68 125.91 3ktm s LEU 136 Ca 0.26 -1.32 -0.30 0.00 -1.03 0.00 0.00 54.13 51.75 3ktm s LEU 136 Cb -0.16 -0.44 0.08 0.00 0.03 0.00 0.00 46.19 45.70 3ktm s LEU 136 CO 0.09 -0.54 0.75 -1.38 0.23 0.00 0.00 176.35 175.50 3ktm s HIS 137 N -3.23 -0.57 0.01 0.29 -3.43 -1.26 -0.52 115.29 106.59 3ktm s HIS 137 Ca 0.34 0.87 0.00 0.00 -0.80 0.00 0.00 55.06 55.48 3ktm s HIS 137 Cb 0.07 0.44 -0.01 0.00 -1.43 0.00 0.00 32.58 31.66 3ktm s HIS 137 CO 0.14 -0.58 -0.02 -0.65 -2.00 0.00 0.00 174.74 171.63 3ktm s GLN 138 N -1.62 0.20 0.18 -0.38 -0.21 -0.15 -4.99 119.66 112.69 3ktm s GLN 138 Ca -0.07 -0.31 -0.23 0.00 0.02 0.00 0.00 55.36 54.78 3ktm s GLN 138 Cb -0.00 -0.02 0.06 0.00 1.00 0.00 0.00 33.01 34.05 3ktm s GLN 138 CO 0.04 -0.01 0.62 -1.83 -2.12 0.00 0.00 175.29 172.00 3ktm s GLU 139 N -0.69 1.38 -0.22 2.91 -1.05 -1.26 -0.80 118.70 118.97 3ktm s GLU 139 Ca -0.07 -0.58 -0.11 0.00 -0.15 0.00 0.00 54.97 54.07 3ktm s GLU 139 Cb -0.05 0.59 0.08 0.00 -0.44 0.00 0.00 34.13 34.31 3ktm s GLU 139 CO -0.00 -0.61 0.52 1.03 0.95 0.00 0.00 175.26 177.15 3ktm s ARG 140 N -3.78 0.49 0.44 -4.83 0.52 -0.84 -5.01 118.95 105.94 3ktm s ARG 140 Ca 0.03 1.04 0.31 0.00 -0.52 0.00 0.00 55.73 56.58 3ktm s ARG 140 Cb -0.02 0.19 1.48 0.00 0.52 0.00 0.00 34.95 37.11 3ktm s ARG 140 CO -0.09 -0.18 1.92 0.00 0.02 0.00 0.00 175.30 176.98 3ktm h MET 141 N 7.38 0.00 -0.34 3.54 -0.00 -2.02 -2.85 114.93 120.64 3ktm h MET 141 Ca -0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.40 3ktm h MET 141 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.77 3ktm h MET 141 CO 0.20 0.00 0.00 -0.40 -0.00 0.00 0.00 176.91 176.72 3ktm n ASP 142 N -2.65 4.29 -4.20 -0.10 5.75 -1.26 -4.94 116.55 113.44 3ktm n ASP 142 Ca -0.00 -3.02 -0.27 0.00 -0.01 0.00 0.00 54.79 51.48 3ktm n ASP 142 Cb 0.16 -0.58 -0.16 0.00 -1.03 0.00 0.00 41.12 39.51 3ktm n ASP 142 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3ktm s VAL 143 N -2.83 1.61 -0.33 2.12 -7.23 -1.08 -5.09 120.40 107.57 3ktm s VAL 143 Ca 0.45 -0.85 -0.01 0.00 -1.81 0.00 0.00 61.98 59.77 3ktm s VAL 143 Cb 0.36 -1.35 0.11 0.00 0.56 0.00 0.00 36.38 36.06 3ktm s VAL 143 CO 0.10 0.46 0.14 0.00 -0.31 0.00 0.00 175.10 175.49 3ktm s GLU 145 N 1.48 2.11 0.71 0.00 0.41 -0.60 -4.85 118.70 117.95 3ktm s GLU 145 Ca 0.12 -2.22 -0.07 0.00 -0.41 0.00 0.00 54.97 52.38 3ktm s GLU 145 Cb -0.19 -1.64 0.06 0.00 -1.78 0.00 0.00 34.13 30.58 3ktm s GLU 145 CO -0.21 -0.23 1.02 0.95 -0.49 0.00 0.00 175.26 176.30 3ktm s THR 146 N -2.78 2.36 0.18 3.63 -4.23 -1.26 -0.30 115.64 113.24 3ktm s THR 146 Ca 0.22 -0.22 -0.14 0.00 -1.18 0.00 0.00 61.69 60.37 3ktm s THR 146 Cb 0.05 -3.04 0.07 0.00 1.34 0.00 0.00 72.50 70.92 3ktm s THR 146 CO 0.11 -0.04 1.84 -0.74 -0.54 0.00 0.00 174.62 175.25 3ktm h HIS 147 N -0.61 0.69 -0.27 3.99 -0.00 -1.96 -1.48 115.15 115.50 3ktm h HIS 147 Ca -0.45 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 59.94 3ktm h HIS 147 Cb 1.31 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 28.48 3ktm h HIS 147 CO 0.34 0.44 0.18 1.25 -0.00 0.00 0.00 177.93 180.14 3ktm h LEU 148 N 0.74 0.32 -0.28 0.26 5.85 -1.97 0.11 115.31 120.35 3ktm h LEU 148 Ca 0.20 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.95 3ktm h LEU 148 Cb -0.09 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.82 3ktm h LEU 148 CO -0.04 0.24 0.00 -0.74 -0.34 0.00 0.00 178.44 177.56 3ktm h HIS 149 N 0.37 -0.01 -0.06 1.25 2.76 -1.82 -1.03 115.15 116.60 3ktm h HIS 149 Ca 0.10 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.23 3ktm h HIS 149 Cb -0.03 0.05 -0.01 0.00 1.55 0.00 0.00 27.41 28.97 3ktm h HIS 149 CO -0.06 -0.04 -0.23 -1.49 -1.30 0.00 0.00 177.93 174.81 3ktm h TRP 150 N 0.08 0.11 -0.35 5.26 4.06 -0.99 -1.44 115.95 122.69 3ktm h TRP 150 Ca 0.13 -0.02 -0.04 0.00 2.06 0.00 0.00 58.89 61.03 3ktm h TRP 150 Cb 0.17 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.29 3ktm h TRP 150 CO -0.21 0.33 0.06 1.25 -3.56 0.00 0.00 178.44 176.31 3ktm h HIS 151 N 0.09 0.62 -0.33 0.49 2.76 -0.41 -1.73 115.15 116.65 3ktm h HIS 151 Ca 0.02 -0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.09 3ktm h HIS 151 Cb 0.46 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 3ktm h HIS 151 CO 0.00 0.64 0.17 1.15 -1.30 0.00 0.00 177.93 178.59 3ktm h THR 152 N 0.42 1.15 -0.06 6.26 2.02 -0.55 0.48 112.91 122.63 3ktm h THR 152 Ca 0.11 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.92 3ktm h THR 152 Cb 0.35 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 3ktm h THR 152 CO 0.01 0.15 -0.28 0.58 0.37 0.00 0.00 175.52 176.35 3ktm h VAL 153 N 0.40 0.37 -0.41 3.16 2.07 -1.17 0.33 116.25 121.01 3ktm h VAL 153 Ca 0.11 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.69 3ktm h VAL 153 Cb 0.09 0.37 -0.05 0.00 -1.52 0.00 0.00 31.29 30.18 3ktm h VAL 153 CO -0.02 0.00 0.10 0.00 0.02 0.00 0.00 177.57 177.67 3ktm h ALA 154 N 0.45 0.45 0.20 1.67 0.00 -1.06 0.22 119.26 121.19 3ktm h ALA 154 Ca 0.08 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3ktm h ALA 154 Cb 0.50 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3ktm h ALA 154 CO -0.28 -0.30 -0.09 -0.22 0.00 0.00 0.00 179.25 178.36 3ktm h LYS 155 N 0.24 -0.25 -0.70 0.00 3.64 -0.24 -2.43 116.57 116.82 3ktm h LYS 155 Ca 0.19 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 3ktm h LYS 155 Cb 0.22 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 3ktm h LYS 155 CO -0.24 -0.13 0.47 0.93 -2.27 0.00 0.00 179.45 178.21 3ktm h GLU 156 N -0.31 0.88 -0.79 1.90 5.08 -0.08 -0.01 114.58 121.26 3ktm h GLU 156 Ca -0.03 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 3ktm h GLU 156 Cb 0.24 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3ktm h GLU 156 CO 0.04 0.59 0.31 1.15 -1.00 0.00 0.00 179.01 180.10 3ktm h THR 157 N 0.91 1.26 -0.03 1.13 2.02 -0.69 -0.02 112.91 117.50 3ktm h THR 157 Ca 0.27 -0.83 -0.16 0.00 0.77 0.00 0.00 66.41 66.45 3ktm h THR 157 Cb -0.04 0.33 0.01 0.00 -1.74 0.00 0.00 68.15 66.71 3ktm h THR 157 CO -0.07 0.34 -0.62 0.00 0.37 0.00 0.00 175.52 175.54 3ktm h SER 159 N 0.01 0.52 -0.63 0.00 0.87 -0.84 -0.71 113.55 112.76 3ktm h SER 159 Ca -0.07 0.06 0.08 0.00 -1.23 0.00 0.00 61.79 60.63 3ktm h SER 159 Cb 1.31 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 63.17 3ktm h SER 159 CO 0.12 0.28 0.29 -0.33 -0.53 0.00 0.00 176.83 176.67 3ktm h GLU 160 N 0.65 0.50 -0.57 2.24 5.08 -1.02 0.15 114.58 121.61 3ktm h GLU 160 Ca 0.38 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3ktm h GLU 160 Cb 0.41 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3ktm h GLU 160 CO -0.28 0.33 0.00 1.63 -1.00 0.00 0.00 179.01 179.70 3ktm n LYS 161 N -4.91 1.64 -3.44 2.33 5.02 -0.61 -4.88 118.16 113.31 3ktm n LYS 161 Ca 0.09 -0.65 -0.18 0.00 -2.02 0.00 0.00 58.31 55.55 3ktm n LYS 161 Cb 0.24 -1.42 0.07 0.00 -0.02 0.00 0.00 35.03 33.90 3ktm n LYS 161 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3ktm n SER 162 N 0.07 -3.47 -3.07 4.39 7.64 0.53 -5.01 113.62 114.70 3ktm n SER 162 Ca 0.06 -0.71 -0.18 0.00 1.01 0.00 0.00 58.87 59.05 3ktm n SER 162 Cb 0.31 -4.86 -0.07 0.00 -1.01 0.00 0.00 64.21 58.59 3ktm n SER 162 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3ktm n THR 163 N -3.89 0.00 -4.77 0.44 -2.24 -0.37 -4.55 114.28 98.90 3ktm n THR 163 Ca -0.21 -2.07 -0.32 0.00 -2.27 0.00 0.00 64.05 59.18 3ktm n THR 163 Cb 0.65 0.96 -0.13 0.00 -2.10 0.00 0.00 70.33 69.71 3ktm n THR 163 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3ktm s ASN 164 N -3.03 4.03 -0.32 3.42 0.01 0.14 -3.91 114.94 115.28 3ktm s ASN 164 Ca 0.30 -0.26 -0.26 0.00 -0.71 0.00 0.00 52.86 51.93 3ktm s ASN 164 Cb 0.01 -0.80 0.01 0.00 0.41 0.00 0.00 41.25 40.88 3ktm s ASN 164 CO 0.21 0.31 0.91 -0.22 -1.51 0.00 0.00 177.10 176.80 3ktm s LEU 165 N -1.04 4.03 -0.17 0.60 2.96 -1.26 0.53 118.68 124.33 3ktm s LEU 165 Ca 0.13 0.78 0.06 0.00 -0.22 0.00 0.00 54.13 54.89 3ktm s LEU 165 Cb -0.11 -3.27 -0.22 0.00 0.50 0.00 0.00 46.19 43.09 3ktm s LEU 165 CO 0.03 -0.74 0.17 1.57 -1.32 0.00 0.00 176.35 176.05 3ktm n HIS 166 N 6.51 0.50 -3.49 5.38 -0.00 -0.25 -4.97 115.22 118.90 3ktm n HIS 166 Ca 0.07 0.14 -0.09 0.00 -0.00 0.00 0.00 57.72 57.84 3ktm n HIS 166 Cb 0.48 -1.08 -0.02 0.00 -0.00 0.00 0.00 29.99 29.37 3ktm n HIS 166 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 3ktm s ASP 167 N -6.30 -0.40 0.11 0.26 3.68 -1.24 -4.99 116.67 107.80 3ktm s ASP 167 Ca -0.20 0.02 -0.23 0.00 2.13 0.00 0.00 52.55 54.27 3ktm s ASP 167 Cb 0.07 0.41 0.06 0.00 -1.45 0.00 0.00 42.92 42.02 3ktm s ASP 167 CO 0.74 -0.66 0.56 -0.72 0.13 0.00 0.00 175.17 175.22 3ktm s TYR 168 N -3.15 -0.48 0.08 -5.34 1.13 -1.26 -0.17 117.35 108.16 3ktm s TYR 168 Ca 0.04 0.38 -0.06 0.00 -1.41 0.00 0.00 57.07 56.02 3ktm s TYR 168 Cb -0.01 0.46 -0.02 0.00 -1.10 0.00 0.00 41.96 41.29 3ktm s TYR 168 CO -0.09 -0.76 0.10 0.20 -2.51 0.00 0.00 175.55 172.49 3ktm s GLY 169 N -2.45 0.26 0.61 5.49 0.00 0.24 -4.96 107.32 106.52 3ktm s GLY 169 Ca -0.01 -0.87 -0.10 0.00 0.00 0.00 0.00 44.72 43.73 3ktm s GLY 169 CO -0.08 -1.02 1.01 1.06 0.00 0.00 0.00 173.10 174.07 3ktm s MET 170 N -3.89 3.51 0.02 2.90 -1.94 -1.26 -0.18 119.30 118.46 3ktm s MET 170 Ca 0.06 0.65 0.01 0.00 -1.71 0.00 0.00 55.69 54.70 3ktm s MET 170 Cb 0.06 -2.11 -0.02 0.00 2.01 0.00 0.00 34.83 34.77 3ktm s MET 170 CO -0.10 -0.58 -0.04 -0.51 -0.01 0.00 0.00 175.02 173.78 3ktm s LEU 171 N -5.15 2.22 -0.28 -0.03 1.43 -0.70 -4.56 118.68 111.60 3ktm s LEU 171 Ca 0.54 -0.46 -0.17 0.00 -1.03 0.00 0.00 54.13 53.01 3ktm s LEU 171 Cb -0.11 0.02 0.03 0.00 0.03 0.00 0.00 46.19 46.15 3ktm s LEU 171 CO 0.53 -0.24 0.35 0.18 0.23 0.00 0.00 176.35 177.39 3ktm n LEU 172 N 1.72 -4.54 -4.77 1.79 4.77 -1.26 -2.27 117.00 112.45 3ktm n LEU 172 Ca -0.22 0.36 -0.39 0.00 -0.03 0.00 0.00 56.01 55.73 3ktm n LEU 172 Cb 0.55 -2.14 -0.03 0.00 -2.33 0.00 0.00 43.42 39.47 3ktm n LEU 172 CO 0.21 -1.31 0.84 -2.16 -1.33 0.00 0.00 177.39 173.63 3ktm s PRO 173 N -1.90 4.28 -0.01 3.23 0.04 -1.26 -0.59 135.00 138.79 3ktm s PRO 173 Ca 0.19 1.85 0.01 0.00 0.04 0.00 0.00 61.00 63.08 3ktm s PRO 173 Cb -0.03 -2.87 0.01 0.00 0.04 0.00 0.00 34.50 31.66 3ktm s PRO 173 CO 0.57 -0.13 0.81 0.00 0.04 0.00 0.00 177.00 178.29 3ktm n GLY 175 N -0.33 -0.56 3.62 0.00 0.00 -1.21 -4.95 105.19 101.76 3ktm n GLY 175 Ca 0.01 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 3ktm n GLY 175 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ktm s ILE 176 N -2.00 3.37 -1.33 -0.61 1.09 -1.26 -2.21 121.20 118.25 3ktm s ILE 176 Ca 0.00 0.40 -0.04 0.00 -1.10 0.00 0.00 60.65 59.91 3ktm s ILE 176 Cb 0.00 -3.42 0.02 0.00 -1.06 0.00 0.00 42.46 38.00 3ktm s ILE 176 CO 0.00 -0.21 0.94 -0.67 -0.10 0.00 0.00 174.94 174.89 3ktm n ASP 177 N 9.69 -3.13 -3.84 3.58 2.03 -1.18 -4.92 116.55 118.78 3ktm n ASP 177 Ca 0.23 -0.70 -0.14 0.00 0.52 0.00 0.00 54.79 54.70 3ktm n ASP 177 Cb 0.45 -4.53 -0.15 0.00 -0.72 0.00 0.00 41.12 36.18 3ktm n ASP 177 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3ktm s LYS 178 N -5.99 0.06 0.08 -0.67 -0.14 -0.94 -4.52 119.74 107.62 3ktm s LYS 178 Ca 0.24 0.05 0.01 0.00 -1.36 0.00 0.00 55.97 54.91 3ktm s LYS 178 Cb -0.11 -0.16 -0.04 0.00 -1.68 0.00 0.00 37.83 35.84 3ktm s LYS 178 CO 0.78 -0.06 -0.06 -0.06 -0.76 0.00 0.00 175.35 175.19 3ktm s PHE 179 N 0.42 0.74 -2.48 3.18 0.40 0.59 -1.14 117.98 119.70 3ktm s PHE 179 Ca -0.04 -0.88 0.23 0.00 -0.60 0.00 0.00 56.93 55.64 3ktm s PHE 179 Cb -0.06 -0.46 0.51 0.00 0.51 0.00 0.00 43.02 43.53 3ktm s PHE 179 CO -0.01 -0.20 1.44 0.54 0.70 0.00 0.00 175.22 177.69 3ktm n ARG 180 N 0.27 2.24 -3.86 0.44 1.74 0.24 -1.56 116.66 116.17 3ktm n ARG 180 Ca -0.15 -1.86 0.00 0.00 -0.77 0.00 0.00 57.85 55.08 3ktm n ARG 180 Cb 0.60 -1.47 0.02 0.00 -1.02 0.00 0.00 32.46 30.58 3ktm n ARG 180 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ktm n GLY 181 N 1.37 0.39 3.14 -0.13 0.00 -1.10 -1.99 105.19 106.87 3ktm n GLY 181 Ca 0.18 -1.08 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 3ktm n GLY 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ktm s VAL 182 N -2.04 0.04 -0.03 1.61 0.11 0.02 -1.72 120.40 118.38 3ktm s VAL 182 Ca 0.26 -0.31 0.07 0.00 -2.93 0.00 0.00 61.98 59.07 3ktm s VAL 182 Cb -0.02 -0.42 -0.02 0.00 -1.53 0.00 0.00 36.38 34.40 3ktm s VAL 182 CO 0.02 -0.17 -0.23 -1.83 -3.33 0.00 0.00 175.10 169.56 3ktm s GLU 183 N -0.62 2.22 0.25 1.54 -1.05 0.75 -0.98 118.70 120.81 3ktm s GLU 183 Ca -0.07 -0.86 -0.18 0.00 -0.15 0.00 0.00 54.97 53.70 3ktm s GLU 183 Cb -0.04 -2.13 0.02 0.00 -0.44 0.00 0.00 34.13 31.53 3ktm s GLU 183 CO 0.01 0.58 0.61 -0.59 0.95 0.00 0.00 175.26 176.82 3ktm s PHE 184 N -0.64 -0.03 -0.09 4.83 -0.71 0.32 0.80 117.98 122.47 3ktm s PHE 184 Ca 0.10 -0.37 0.04 0.00 -1.04 0.00 0.00 56.93 55.66 3ktm s PHE 184 Cb -0.10 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 3ktm s PHE 184 CO -0.01 -1.09 -0.22 0.08 -1.34 0.00 0.00 175.22 172.65 3ktm s VAL 185 N -3.93 1.88 -0.07 -2.49 1.01 0.76 -0.73 120.40 116.83 3ktm s VAL 185 Ca 0.14 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3ktm s VAL 185 Cb -0.03 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 3ktm s VAL 185 CO 0.05 0.52 -0.10 0.00 0.00 0.00 0.00 175.10 175.57 3ktm s PRO 188 N -1.41 3.02 0.44 0.00 0.02 -1.26 0.23 135.00 136.03 3ktm s PRO 188 Ca 0.07 1.94 0.18 0.00 0.02 0.00 0.00 61.00 63.21 3ktm s PRO 188 Cb -0.09 -2.03 1.02 0.00 0.02 0.00 0.00 34.50 33.41 3ktm s PRO 188 CO 0.03 -1.20 1.94 -0.07 -0.33 0.00 0.00 177.00 177.36 3ktm h LEU 189 N 1.07 0.00 -7.00 -5.54 4.07 -1.90 -3.42 115.31 102.60 3ktm h LEU 189 Ca -0.51 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.46 3ktm h LEU 189 Cb 1.30 0.00 -0.15 0.00 1.08 0.00 0.00 40.66 42.89 3ktm h LEU 189 CO 0.56 0.24 0.28 0.00 -1.08 0.00 0.00 178.44 178.44 3ktm s ALA 190 N -4.25 -1.71 -0.20 1.53 0.00 -1.26 -1.66 121.76 114.22 3ktm s ALA 190 Ca -0.03 0.86 0.01 0.00 0.00 0.00 0.00 51.96 52.81 3ktm s ALA 190 Cb 0.14 0.48 0.03 0.00 0.00 0.00 0.00 23.12 23.76 3ktm s ALA 190 CO 0.67 -0.63 -0.18 0.42 0.00 0.00 0.00 175.76 176.04 3ktm s ILE 191 N -2.83 2.07 -1.47 0.00 1.01 0.08 -4.72 121.20 115.34 3ktm s ILE 191 Ca -0.01 -1.07 -0.06 0.00 0.00 0.00 0.00 60.65 59.51 3ktm s ILE 191 Cb -0.01 -1.93 0.04 0.00 0.01 0.00 0.00 42.46 40.57 3ktm s ILE 191 CO -0.06 0.43 0.60 -0.62 0.00 0.00 0.00 174.94 175.29 3ktm n GLU 192 N 4.59 -3.75 0.00 2.79 1.02 -1.26 -2.08 120.64 121.94 3ktm n GLU 192 Ca -0.20 0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 3ktm n GLU 192 Cb 0.48 -4.85 0.00 0.00 -0.02 0.00 0.00 31.44 27.06 3ktm n GLU 192 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ktm n GLY 193 N -1.78 2.74 3.69 0.62 0.00 -1.26 -5.02 105.19 104.17 3ktm n GLY 193 Ca -0.19 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 3ktm n GLY 193 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ktm s ARG 194 N 0.00 4.43 0.35 1.61 1.70 -0.88 -4.97 118.95 121.19 3ktm s ARG 194 Ca 0.00 1.37 -0.27 0.00 -0.47 0.00 0.00 55.73 56.36 3ktm s ARG 194 Cb 0.00 -3.53 -0.12 0.00 -0.57 0.00 0.00 34.95 30.73 3ktm s ARG 194 CO 0.00 -0.28 1.22 1.17 -1.08 0.00 0.00 175.30 176.33 3ktm n LYS 195 N 4.88 1.92 -3.75 3.89 4.81 -1.26 -0.74 118.16 127.90 3ktm n LYS 195 Ca 0.08 0.67 -0.38 0.00 -0.87 0.00 0.00 58.31 57.82 3ktm n LYS 195 Cb 0.49 -2.24 -0.12 0.00 0.02 0.00 0.00 35.03 33.18 3ktm n LYS 195 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 3ktm s LEU 196 N -0.85 4.47 0.43 3.14 1.98 -0.66 -4.81 118.68 122.38 3ktm s LEU 196 Ca 0.57 -1.30 0.06 0.00 -2.89 0.00 0.00 54.13 50.58 3ktm s LEU 196 Cb -0.58 -1.86 -0.05 0.00 0.66 0.00 0.00 46.19 44.36 3ktm s LEU 196 CO 0.61 -0.37 0.11 0.00 -1.89 0.00 0.00 176.35 174.81 3ktm s ALA 197 N 1.36 3.54 -0.03 5.97 0.00 -1.26 -4.81 121.76 126.53 3ktm s ALA 197 Ca -0.01 -1.93 -0.30 0.00 0.00 0.00 0.00 51.96 49.72 3ktm s ALA 197 Cb -0.20 -0.14 0.11 0.00 0.00 0.00 0.00 23.12 22.88 3ktm s ALA 197 CO 0.01 -0.15 0.99 0.00 0.00 0.00 0.00 175.76 176.62 3ktm s ALA 198 N -2.68 -1.88 0.04 0.00 0.00 -1.26 -5.19 121.76 110.78 3ktm s ALA 198 Ca 0.34 1.03 0.04 0.00 0.00 0.00 0.00 51.96 53.37 3ktm s ALA 198 Cb 0.06 0.32 -0.02 0.00 0.00 0.00 0.00 23.12 23.47 3ktm s ALA 198 CO 0.18 -0.73 -0.13 0.00 0.00 0.00 0.00 175.76 175.09 3ktm s ALA 199 N -2.94 1.03 0.00 0.00 0.00 -1.26 -5.15 121.76 113.44 3ktm s ALA 199 Ca 0.07 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.22 3ktm s ALA 199 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.99 3ktm s ALA 199 CO -0.06 0.16 0.00 1.47 0.00 0.00 0.00 175.76 177.33 3ktm n LEU 200 N 1.77 0.00 -1.54 0.00 -0.00 -1.26 -5.10 117.00 110.86 3ktm n LEU 200 Ca -0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.80 3ktm n LEU 200 Cb 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.96 3ktm n LEU 200 CO 0.22 0.00 -0.02 -0.62 -0.00 0.00 0.00 177.39 176.97 3ktm n GLU 201 N -0.11 -1.66 0.00 1.47 1.02 -1.26 -5.14 120.64 114.96 3ktm n GLU 201 Ca 0.00 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 3ktm n GLU 201 Cb 0.00 -4.32 0.00 0.00 -0.02 0.00 0.00 31.44 27.10 3ktm n GLU 201 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03