#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 4.41 -3.58 2.23 4.77 -0.50 -4.95 117.00 119.39 3ktm n LEU 29 Ca 0.00 -2.85 -0.08 0.00 -0.03 0.00 0.00 56.01 53.05 3ktm n LEU 29 Cb 0.00 -0.56 -0.04 0.00 -2.33 0.00 0.00 43.42 40.49 3ktm n LEU 29 CO 0.00 0.68 0.86 0.00 -1.33 0.00 0.00 177.39 177.60 3ktm s ALA 30 N -2.55 -1.97 0.06 -1.18 0.00 -1.24 -4.76 121.76 110.13 3ktm s ALA 30 Ca 0.45 1.59 -0.30 0.00 0.00 0.00 0.00 51.96 53.70 3ktm s ALA 30 Cb 0.34 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.71 3ktm s ALA 30 CO 0.13 -0.36 0.97 -2.00 0.00 0.00 0.00 175.76 174.51 3ktm s GLU 31 N -1.40 4.63 0.26 0.00 2.12 -1.26 -4.72 118.70 118.33 3ktm s GLU 31 Ca 0.02 1.45 -0.30 0.00 0.36 0.00 0.00 54.97 56.50 3ktm s GLU 31 Cb -0.01 -3.41 -0.10 0.00 0.26 0.00 0.00 34.13 30.87 3ktm s GLU 31 CO -0.02 0.09 1.42 -1.25 -0.54 0.00 0.00 175.26 174.97 3ktm s PRO 32 N 0.44 4.28 0.06 4.30 0.04 -1.26 -4.82 135.00 138.03 3ktm s PRO 32 Ca 0.49 2.29 -0.26 0.00 0.04 0.00 0.00 61.00 63.56 3ktm s PRO 32 Cb -0.22 -3.11 0.09 0.00 0.04 0.00 0.00 34.50 31.29 3ktm s PRO 32 CO 0.29 -0.39 0.74 1.14 0.04 0.00 0.00 177.00 178.82 3ktm s GLN 33 N -0.54 1.04 0.09 4.56 -2.07 -1.26 -1.74 119.66 119.74 3ktm s GLN 33 Ca 0.58 -0.30 0.08 0.00 -1.82 0.00 0.00 55.36 53.90 3ktm s GLN 33 Cb -0.42 0.48 -0.03 0.00 -1.09 0.00 0.00 33.01 31.95 3ktm s GLN 33 CO 0.44 -0.44 -0.21 0.96 -1.32 0.00 0.00 175.29 174.72 3ktm s ILE 34 N -3.11 1.76 0.00 3.63 -5.25 -0.27 -0.40 121.20 117.56 3ktm s ILE 34 Ca 0.01 -1.50 0.04 0.00 -0.99 0.00 0.00 60.65 58.20 3ktm s ILE 34 Cb -0.01 -1.58 -0.01 0.00 2.95 0.00 0.00 42.46 43.81 3ktm s ILE 34 CO -0.08 0.00 -0.11 0.00 -1.79 0.00 0.00 174.94 172.96 3ktm s ALA 35 N -1.09 0.93 0.07 2.27 0.00 0.49 -0.42 121.76 124.02 3ktm s ALA 35 Ca 0.07 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.53 3ktm s ALA 35 Cb -0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.78 3ktm s ALA 35 CO 0.04 0.21 -0.11 -1.64 0.00 0.00 0.00 175.76 174.26 3ktm s MET 36 N -0.46 0.75 -0.30 0.00 -1.94 -1.26 -0.45 119.30 115.63 3ktm s MET 36 Ca 0.03 -0.99 0.00 0.00 -1.71 0.00 0.00 55.69 53.03 3ktm s MET 36 Cb -0.05 -0.55 0.14 0.00 2.01 0.00 0.00 34.83 36.38 3ktm s MET 36 CO -0.00 0.10 0.32 0.12 -0.01 0.00 0.00 175.02 175.55 3ktm s PHE 37 N -1.81 -0.48 0.04 -0.03 5.36 -1.26 -4.87 117.98 114.92 3ktm s PHE 37 Ca -0.01 -0.23 -0.38 0.00 -0.96 0.00 0.00 56.93 55.36 3ktm s PHE 37 Cb -0.07 -0.43 -0.18 0.00 -0.34 0.00 0.00 43.02 42.00 3ktm s PHE 37 CO 0.01 -0.93 1.29 0.00 -1.46 0.00 0.00 175.22 174.12 3ktm n GLY 39 N 2.34 2.82 3.55 0.00 0.00 -1.26 -5.04 105.19 107.60 3ktm n GLY 39 Ca 0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.50 1.83 0.30 1.61 1.81 -0.16 -4.65 118.95 119.18 3ktm s ARG 40 Ca 0.00 -2.02 -0.28 0.00 -1.72 0.00 0.00 55.73 51.71 3ktm s ARG 40 Cb 0.00 -1.32 -0.09 0.00 -0.45 0.00 0.00 34.95 33.08 3ktm s ARG 40 CO 0.00 -0.10 0.98 -0.51 -0.68 0.00 0.00 175.30 174.99 3ktm s LEU 41 N -3.61 4.45 0.52 2.53 1.43 -0.06 -4.05 118.68 119.90 3ktm s LEU 41 Ca 0.35 1.96 -0.22 0.00 -1.03 0.00 0.00 54.13 55.20 3ktm s LEU 41 Cb 0.09 -3.84 -0.07 0.00 0.03 0.00 0.00 46.19 42.41 3ktm s LEU 41 CO 0.17 -0.05 1.16 0.59 0.23 0.00 0.00 176.35 178.45 3ktm n ASN 42 N 0.90 1.80 -4.64 2.29 3.02 -0.51 -4.69 115.26 113.42 3ktm n ASN 42 Ca 0.00 0.95 -0.26 0.00 -0.03 0.00 0.00 54.58 55.24 3ktm n ASN 42 Cb 0.48 -1.47 -0.08 0.00 -0.61 0.00 0.00 39.78 38.11 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 -2.59 2.33 -0.05 3.52 -1.94 0.40 -0.50 119.30 120.47 3ktm s MET 43 Ca 0.70 -1.15 -0.12 0.00 -1.71 0.00 0.00 55.69 53.41 3ktm s MET 43 Cb -0.46 -2.31 0.02 0.00 2.01 0.00 0.00 34.83 34.09 3ktm s MET 43 CO 0.51 0.45 0.28 -3.38 -0.01 0.00 0.00 175.02 172.87 3ktm s HIS 44 N -1.74 -0.21 0.04 -0.03 -3.43 -0.62 -0.38 115.29 108.92 3ktm s HIS 44 Ca 0.27 0.42 -0.31 0.00 -0.80 0.00 0.00 55.06 54.65 3ktm s HIS 44 Cb -0.09 0.08 -0.06 0.00 -1.43 0.00 0.00 32.58 31.08 3ktm s HIS 44 CO 0.18 -0.28 1.41 1.41 -2.00 0.00 0.00 174.74 175.45 3ktm s MET 45 N -0.75 4.30 -0.41 -0.38 1.75 0.47 -1.37 119.30 122.90 3ktm s MET 45 Ca -0.08 2.02 -0.29 0.00 -1.25 0.00 0.00 55.69 56.08 3ktm s MET 45 Cb -0.04 -3.46 0.02 0.00 2.84 0.00 0.00 34.83 34.19 3ktm s MET 45 CO 0.02 -0.53 1.19 1.21 -0.65 0.00 0.00 175.02 176.27 3ktm s ASN 46 N 1.63 6.65 0.00 1.11 3.84 0.61 -4.54 114.94 124.24 3ktm s ASN 46 Ca 0.65 0.75 0.23 0.00 0.21 0.00 0.00 52.86 54.69 3ktm s ASN 46 Cb -0.34 -2.55 1.38 0.00 -0.55 0.00 0.00 41.25 39.20 3ktm s ASN 46 CO 0.28 -1.18 1.76 1.33 -2.79 0.00 0.00 177.10 176.50 3ktm n VAL 47 N 6.59 0.01 -0.09 -5.21 0.24 -1.26 -1.60 118.33 117.01 3ktm n VAL 47 Ca 0.13 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.30 3ktm n VAL 47 Cb 0.48 -0.64 -0.06 0.00 -1.47 0.00 0.00 33.84 32.15 3ktm n VAL 47 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ktm n GLN 48 N -1.01 0.51 -0.03 7.34 6.02 -1.26 -1.40 117.38 127.56 3ktm n GLN 48 Ca 0.17 0.47 -0.18 0.00 -0.01 0.00 0.00 57.00 57.45 3ktm n GLN 48 Cb 0.08 -1.65 -0.14 0.00 1.02 0.00 0.00 30.24 29.56 3ktm n GLN 48 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3ktm n ASN 49 N -4.49 1.74 0.00 1.08 0.23 -1.24 -4.58 115.26 108.00 3ktm n ASN 49 Ca -0.22 0.19 0.00 0.00 -0.53 0.00 0.00 54.58 54.02 3ktm n ASN 49 Cb 0.51 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.67 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 1.94 1.32 3.75 4.83 0.00 -0.62 -4.99 105.19 111.40 3ktm n GLY 50 Ca -0.31 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.38 2.54 -0.04 1.61 -0.14 -1.25 -4.84 119.74 117.24 3ktm s LYS 51 Ca 0.00 -1.35 -0.24 0.00 -1.36 0.00 0.00 55.97 53.02 3ktm s LYS 51 Cb 0.00 -2.31 -0.04 0.00 -1.68 0.00 0.00 37.83 33.80 3ktm s LYS 51 CO 0.00 0.25 0.72 -1.58 -0.76 0.00 0.00 175.35 173.98 3ktm s TRP 52 N -2.31 3.61 0.37 3.18 0.52 -1.26 -0.29 118.94 122.77 3ktm s TRP 52 Ca 0.35 1.31 0.08 0.00 0.02 0.00 0.00 56.10 57.86 3ktm s TRP 52 Cb -0.05 -2.81 -0.06 0.00 -1.15 0.00 0.00 33.47 29.40 3ktm s TRP 52 CO 0.23 0.13 0.06 -0.51 0.02 0.00 0.00 176.95 176.88 3ktm s ASP 53 N 0.63 4.22 0.33 2.95 1.01 -0.47 -4.94 116.67 120.39 3ktm s ASP 53 Ca 0.38 -1.06 0.07 0.00 0.71 0.00 0.00 52.55 52.65 3ktm s ASP 53 Cb -0.18 -0.51 -0.02 0.00 1.01 0.00 0.00 42.92 43.22 3ktm s ASP 53 CO 0.19 -0.35 0.40 -0.55 0.21 0.00 0.00 175.17 175.08 3ktm s SER 54 N -3.77 5.79 -0.38 0.27 0.15 -1.26 -1.60 113.70 112.91 3ktm s SER 54 Ca 0.37 -0.26 -0.43 0.00 0.70 0.00 0.00 55.95 56.33 3ktm s SER 54 Cb 0.02 -1.21 -0.17 0.00 -1.71 0.00 0.00 66.02 62.95 3ktm s SER 54 CO 0.20 -0.37 1.74 -0.67 1.20 0.00 0.00 173.24 175.34 3ktm n ASP 55 N -1.53 1.84 -0.34 5.45 4.64 0.34 -4.81 116.55 122.14 3ktm n ASP 55 Ca -0.01 1.06 0.26 0.00 -1.38 0.00 0.00 54.79 54.71 3ktm n ASP 55 Cb 0.58 -1.03 0.54 0.00 -1.04 0.00 0.00 41.12 40.17 3ktm n ASP 55 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 3ktm h PRO 56 N 6.75 0.32 -0.01 -0.67 0.11 -1.94 0.20 132.00 136.75 3ktm h PRO 56 Ca -0.42 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3ktm h PRO 56 Cb 1.34 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3ktm h PRO 56 CO 0.98 0.21 -0.31 -1.13 -0.21 0.00 0.00 178.00 177.54 3ktm n SER 57 N -4.64 1.31 -2.11 -2.05 3.41 -1.26 -4.94 113.62 103.35 3ktm n SER 57 Ca 0.28 -1.08 -0.20 0.00 -0.26 0.00 0.00 58.87 57.61 3ktm n SER 57 Cb 0.99 0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 65.13 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 1.36 0.12 0.00 5.00 0.00 0.71 -4.83 105.19 107.53 3ktm n GLY 58 Ca 0.12 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.63 0.00 -3.05 2.61 -2.24 -1.26 -4.65 114.28 102.06 3ktm n THR 59 Ca -0.23 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 3ktm n THR 59 Cb 0.68 0.21 -0.06 0.00 -2.10 0.00 0.00 70.33 69.06 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 -1.07 4.17 0.59 -0.78 1.02 -1.26 -5.00 119.74 117.41 3ktm s LYS 60 Ca 0.00 0.69 0.06 0.00 0.02 0.00 0.00 55.97 56.74 3ktm s LYS 60 Cb 0.00 -3.62 0.08 0.00 -0.52 0.00 0.00 37.83 33.77 3ktm s LYS 60 CO 0.00 -0.37 0.82 0.95 -0.92 0.00 0.00 175.35 175.83 3ktm s THR 61 N 2.36 2.29 0.32 2.17 -4.23 -1.26 -1.43 115.64 115.86 3ktm s THR 61 Ca 0.30 -0.86 -0.26 0.00 -1.18 0.00 0.00 61.69 59.69 3ktm s THR 61 Cb -0.16 -2.43 -0.14 0.00 1.34 0.00 0.00 72.50 71.11 3ktm s THR 61 CO 0.09 0.00 0.75 0.00 -0.54 0.00 0.00 174.62 174.92 3ktm s ILE 63 N -1.19 3.99 -0.24 0.00 1.01 -1.26 -5.01 121.20 118.50 3ktm s ILE 63 Ca 0.61 -0.58 0.22 0.00 0.00 0.00 0.00 60.65 60.91 3ktm s ILE 63 Cb -0.72 -2.74 -0.10 0.00 0.01 0.00 0.00 42.46 38.92 3ktm s ILE 63 CO 0.58 0.44 0.90 0.47 0.00 0.00 0.00 174.94 177.34 3ktm n ASP 64 N 1.65 0.60 -4.39 3.58 9.92 -1.26 -4.93 116.55 121.72 3ktm n ASP 64 Ca -0.16 0.17 -0.24 0.00 -0.53 0.00 0.00 54.79 54.03 3ktm n ASP 64 Cb 0.53 0.88 -0.11 0.00 -0.64 0.00 0.00 41.12 41.77 3ktm n ASP 64 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3ktm s THR 65 N -3.38 2.15 0.22 -3.53 -4.23 -1.26 -5.03 115.64 100.58 3ktm s THR 65 Ca -0.02 -2.04 -0.09 0.00 -1.18 0.00 0.00 61.69 58.37 3ktm s THR 65 Cb 0.11 -2.03 0.18 0.00 1.34 0.00 0.00 72.50 72.10 3ktm s THR 65 CO 0.82 -0.24 1.85 0.11 -0.54 0.00 0.00 174.62 176.62 3ktm h LYS 66 N 3.09 1.13 -0.67 3.99 6.56 -1.93 0.67 116.57 129.41 3ktm h LYS 66 Ca -0.44 -0.12 -0.04 0.00 -1.06 0.00 0.00 60.65 59.00 3ktm h LYS 66 Cb 1.21 -0.23 -0.03 0.00 -0.57 0.00 0.00 32.23 32.61 3ktm h LYS 66 CO 0.51 0.82 0.27 1.49 -2.06 0.00 0.00 179.45 180.47 3ktm h GLU 67 N 1.14 0.99 -0.33 3.15 4.81 -1.96 -0.68 114.58 121.69 3ktm h GLU 67 Ca 0.29 -0.16 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 3ktm h GLU 67 Cb -0.01 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 3ktm h GLU 67 CO -0.05 0.80 -0.02 0.78 -0.73 0.00 0.00 179.01 179.79 3ktm h GLY 68 N 1.05 0.65 0.92 1.92 0.00 -1.70 -1.70 103.07 104.22 3ktm h GLY 68 Ca 0.23 -0.50 0.02 0.00 0.00 0.00 0.00 47.33 47.08 3ktm h GLY 68 CO -0.02 0.46 0.37 -2.22 0.00 0.00 0.00 176.54 175.12 3ktm h ILE 69 N 0.40 1.10 -0.81 2.60 2.04 -0.49 -0.27 117.51 122.08 3ktm h ILE 69 Ca 0.09 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 3ktm h ILE 69 Cb 0.49 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 3ktm h ILE 69 CO 0.02 0.13 0.47 0.25 0.00 0.00 0.00 178.15 179.03 3ktm h LEU 70 N 0.73 0.99 -0.48 1.44 5.85 -1.02 -0.35 115.31 122.47 3ktm h LEU 70 Ca 0.23 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 3ktm h LEU 70 Cb -0.02 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.74 3ktm h LEU 70 CO -0.08 0.78 0.24 1.56 -0.34 0.00 0.00 178.44 180.60 3ktm h GLN 71 N 1.11 0.68 -0.47 1.25 4.20 -0.55 -1.53 115.11 119.80 3ktm h GLN 71 Ca 0.29 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 3ktm h GLN 71 Cb -0.01 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.62 3ktm h GLN 71 CO -0.05 0.56 0.27 -0.92 -0.67 0.00 0.00 178.83 178.03 3ktm h TYR 72 N 0.63 0.64 -0.45 2.96 3.20 -0.69 0.14 116.97 123.40 3ktm h TYR 72 Ca 0.17 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.10 3ktm h TYR 72 Cb 0.10 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.10 3ktm h TYR 72 CO -0.01 0.46 0.11 0.00 -1.64 0.00 0.00 178.16 177.07 3ktm h GLN 74 N 0.25 0.22 0.31 0.00 4.20 -0.76 -1.21 115.11 118.12 3ktm h GLN 74 Ca 0.22 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.83 3ktm h GLN 74 Cb 0.27 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.04 3ktm h GLN 74 CO -0.27 0.53 -0.15 1.49 -0.67 0.00 0.00 178.83 179.76 3ktm h GLU 75 N 0.20 -0.40 0.00 1.46 4.81 0.48 -3.10 114.58 118.03 3ktm h GLU 75 Ca 0.03 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 3ktm h GLU 75 Cb 0.68 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 3ktm h GLU 75 CO 0.05 -0.14 -0.19 0.28 -0.73 0.00 0.00 179.01 178.29 3ktm h VAL 76 N -0.63 0.85 -2.20 0.32 2.07 -0.77 -3.29 116.25 112.59 3ktm h VAL 76 Ca -0.04 -0.71 -0.57 0.00 0.82 0.00 0.00 66.70 66.19 3ktm h VAL 76 Cb 0.45 1.42 -0.42 0.00 -1.52 0.00 0.00 31.29 31.22 3ktm h VAL 76 CO 0.07 0.18 -0.73 -1.22 0.02 0.00 0.00 177.57 175.89 3ktm n TYR 77 N -3.90 3.46 -0.22 1.57 4.01 -0.47 -4.91 117.16 116.69 3ktm n TYR 77 Ca -0.02 -3.92 0.30 0.00 -0.16 0.00 0.00 57.90 54.10 3ktm n TYR 77 Cb 0.28 -0.46 0.72 0.00 -0.31 0.00 0.00 39.34 39.57 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 2.96 0.02 -0.00 -0.72 0.13 -1.61 -0.26 132.00 132.52 3ktm h PRO 78 Ca 0.13 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3ktm h PRO 78 Cb 0.59 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 3ktm h PRO 78 CO 0.77 0.01 -0.00 -0.85 -0.23 0.00 0.00 178.00 177.70 3ktm n GLU 79 N -4.26 0.07 -4.23 0.86 -0.00 -1.26 -4.84 120.64 106.98 3ktm n GLU 79 Ca 0.21 -0.00 -0.24 0.00 -0.00 0.00 0.00 57.16 57.13 3ktm n GLU 79 Cb 1.03 -1.50 -0.07 0.00 -0.00 0.00 0.00 31.44 30.90 3ktm n GLU 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3ktm s LEU 80 N -2.93 3.37 -1.03 -1.84 1.43 -0.11 -5.05 118.68 112.52 3ktm s LEU 80 Ca 0.16 -0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 52.68 3ktm s LEU 80 Cb 0.19 -1.93 0.25 0.00 0.03 0.00 0.00 46.19 44.73 3ktm s LEU 80 CO 0.52 0.02 1.03 -1.58 0.23 0.00 0.00 176.35 176.57 3ktm s GLN 81 N -3.48 4.01 -0.11 1.70 0.74 -1.26 -4.97 119.66 116.29 3ktm s GLN 81 Ca 0.30 -2.94 -0.30 0.00 0.05 0.00 0.00 55.36 52.48 3ktm s GLN 81 Cb -0.08 -4.55 -0.03 0.00 1.10 0.00 0.00 33.01 29.46 3ktm s GLN 81 CO 0.21 -1.29 1.28 0.42 -0.55 0.00 0.00 175.29 175.35 3ktm s ILE 82 N -0.63 4.18 -0.56 -2.34 1.09 -1.26 -0.84 121.20 120.84 3ktm s ILE 82 Ca 0.28 1.47 0.09 0.00 -1.10 0.00 0.00 60.65 61.38 3ktm s ILE 82 Cb -0.10 -3.95 -0.06 0.00 -1.06 0.00 0.00 42.46 37.29 3ktm s ILE 82 CO -0.08 -0.08 0.45 0.35 -0.10 0.00 0.00 174.94 175.48 3ktm n THR 83 N 5.09 0.00 -3.70 2.92 -2.24 -0.27 -4.91 114.28 111.16 3ktm n THR 83 Ca 0.13 -0.33 0.01 0.00 -2.27 0.00 0.00 64.05 61.58 3ktm n THR 83 Cb 0.45 1.04 -0.00 0.00 -2.10 0.00 0.00 70.33 69.72 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 -1.64 -0.07 0.08 3.42 3.84 -1.23 -5.02 114.94 114.32 3ktm s ASN 84 Ca 0.05 -0.23 0.01 0.00 0.21 0.00 0.00 52.86 52.90 3ktm s ASN 84 Cb 0.07 0.24 -0.04 0.00 -0.55 0.00 0.00 41.25 40.97 3ktm s ASN 84 CO 0.32 -0.45 -0.06 0.68 -2.79 0.00 0.00 177.10 174.80 3ktm s VAL 85 N -2.51 0.54 -0.23 -5.21 -7.23 -1.26 -0.70 120.40 103.79 3ktm s VAL 85 Ca 0.16 -1.75 -0.21 0.00 -1.81 0.00 0.00 61.98 58.37 3ktm s VAL 85 Cb 0.03 -1.45 0.06 0.00 0.56 0.00 0.00 36.38 35.58 3ktm s VAL 85 CO -0.02 -0.83 0.61 0.54 -0.31 0.00 0.00 175.10 175.10 3ktm s VAL 86 N -3.32 -0.00 0.51 1.32 0.11 -1.02 -3.14 120.40 114.87 3ktm s VAL 86 Ca 0.07 0.00 -0.21 0.00 -2.93 0.00 0.00 61.98 58.91 3ktm s VAL 86 Cb 0.03 -0.85 -0.07 0.00 -1.53 0.00 0.00 36.38 33.96 3ktm s VAL 86 CO -0.05 0.00 1.12 -1.83 -3.33 0.00 0.00 175.10 171.01 3ktm s GLU 87 N 0.42 3.56 0.68 1.54 1.03 -1.26 -0.45 118.70 124.22 3ktm s GLU 87 Ca -0.01 1.60 -0.14 0.00 0.03 0.00 0.00 54.97 56.45 3ktm s GLU 87 Cb -0.04 -2.14 0.01 0.00 -0.80 0.00 0.00 34.13 31.16 3ktm s GLU 87 CO -0.01 -0.67 1.12 0.00 -1.33 0.00 0.00 175.26 174.37 3ktm s ALA 88 N -1.75 2.39 -0.56 -0.84 0.00 -0.16 -4.80 121.76 116.04 3ktm s ALA 88 Ca 0.69 0.56 0.25 0.00 0.00 0.00 0.00 51.96 53.46 3ktm s ALA 88 Cb -0.23 -3.33 0.74 0.00 0.00 0.00 0.00 23.12 20.29 3ktm s ALA 88 CO 0.27 -1.42 1.74 -0.91 0.00 0.00 0.00 175.76 175.44 3ktm h ASN 89 N -0.15 0.00 -4.46 0.00 4.21 -1.94 -3.46 115.58 109.78 3ktm h ASN 89 Ca -0.46 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 56.86 3ktm h ASN 89 Cb 1.25 0.00 -0.24 0.00 -1.12 0.00 0.00 38.32 38.21 3ktm h ASN 89 CO 0.53 0.00 -0.67 0.00 -1.29 0.00 0.00 177.43 176.00 3ktm s GLN 90 N -3.20 0.21 0.79 0.81 0.00 -1.26 -5.15 119.66 111.86 3ktm s GLN 90 Ca 0.08 -0.31 -0.11 0.00 -0.00 0.00 0.00 55.36 55.02 3ktm s GLN 90 Cb 0.10 0.08 0.06 0.00 0.00 0.00 0.00 33.01 33.25 3ktm s GLN 90 CO 0.59 -0.04 1.09 -1.25 0.00 0.00 0.00 175.29 175.68 3ktm s PRO 91 N -0.83 2.15 0.09 9.60 0.04 -1.26 -4.62 135.00 140.16 3ktm s PRO 91 Ca -0.09 0.86 0.03 0.00 0.04 0.00 0.00 61.00 61.84 3ktm s PRO 91 Cb -0.06 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 3ktm s PRO 91 CO -0.00 -1.63 -0.09 0.54 0.04 0.00 0.00 177.00 175.86 3ktm s VAL 92 N -3.03 0.79 -0.22 -0.36 0.11 0.12 -4.90 120.40 112.91 3ktm s VAL 92 Ca 0.61 -1.63 -0.13 0.00 -2.93 0.00 0.00 61.98 57.90 3ktm s VAL 92 Cb -0.16 -1.32 -0.04 0.00 -1.53 0.00 0.00 36.38 33.33 3ktm s VAL 92 CO 0.55 -0.62 0.29 0.42 -3.33 0.00 0.00 175.10 172.41 3ktm s THR 93 N -2.61 5.27 -0.05 5.04 -4.23 -1.26 -0.15 115.64 117.67 3ktm s THR 93 Ca 0.04 0.46 0.05 0.00 -1.18 0.00 0.00 61.69 61.07 3ktm s THR 93 Cb -0.02 -3.62 -0.01 0.00 1.34 0.00 0.00 72.50 70.19 3ktm s THR 93 CO -0.01 0.30 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.53 3ktm s ILE 94 N 1.18 1.66 0.28 2.99 1.01 0.14 -4.93 121.20 123.53 3ktm s ILE 94 Ca 0.14 -0.85 0.12 0.00 0.00 0.00 0.00 60.65 60.06 3ktm s ILE 94 Cb -0.14 -1.41 -0.05 0.00 0.01 0.00 0.00 42.46 40.86 3ktm s ILE 94 CO 0.06 0.47 -0.19 0.00 0.00 0.00 0.00 174.94 175.28 3ktm s GLN 95 N -0.04 1.69 -0.20 2.79 -2.07 -1.26 -0.68 119.66 119.89 3ktm s GLN 95 Ca -0.04 -1.78 -0.01 0.00 -1.82 0.00 0.00 55.36 51.72 3ktm s GLN 95 Cb -0.12 -1.77 0.00 0.00 -1.09 0.00 0.00 33.01 30.03 3ktm s GLN 95 CO 0.03 0.32 0.17 0.09 -1.32 0.00 0.00 175.29 174.58 3ktm n ASN 96 N -0.63 -2.57 -4.71 12.60 3.02 -1.23 -4.92 115.26 116.81 3ktm n ASN 96 Ca -0.05 -0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.00 3ktm n ASN 96 Cb 0.60 -1.16 -0.03 0.00 -0.61 0.00 0.00 39.78 38.58 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 -3.05 3.40 0.43 3.10 0.52 -1.24 -4.79 118.94 117.31 3ktm s TRP 97 Ca 0.08 1.28 -0.04 0.00 0.02 0.00 0.00 56.10 57.44 3ktm s TRP 97 Cb -0.03 -3.43 -0.04 0.00 -1.15 0.00 0.00 33.47 28.82 3ktm s TRP 97 CO 0.11 -1.32 0.71 0.00 0.02 0.00 0.00 176.95 176.46 3ktm s LYS 99 N -4.54 2.16 0.22 0.00 2.20 -1.26 -0.88 119.74 117.64 3ktm s LYS 99 Ca 0.45 -0.92 -0.31 0.00 -0.36 0.00 0.00 55.97 54.83 3ktm s LYS 99 Cb -0.10 -2.21 -0.11 0.00 -1.51 0.00 0.00 37.83 33.90 3ktm s LYS 99 CO 0.41 0.56 1.61 0.50 -0.36 0.00 0.00 175.35 178.07 3ktm s ARG 100 N -1.23 4.17 0.00 4.03 3.52 -1.26 -2.63 118.95 125.56 3ktm s ARG 100 Ca 0.14 2.48 0.00 0.00 -0.13 0.00 0.00 55.73 58.21 3ktm s ARG 100 Cb -0.10 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.19 3ktm s ARG 100 CO 0.04 -0.63 0.00 0.41 -0.81 0.00 0.00 175.30 174.30 3ktm n GLY 101 N 3.28 2.50 3.77 8.12 0.00 -1.26 -5.01 105.19 116.59 3ktm n GLY 101 Ca 0.12 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.21 3ktm n GLY 101 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ktm s ARG 102 N 0.00 4.02 0.02 1.61 3.52 -1.08 -4.96 118.95 122.07 3ktm s ARG 102 Ca 0.00 2.26 -0.05 0.00 -0.13 0.00 0.00 55.73 57.81 3ktm s ARG 102 Cb 0.00 -2.83 -0.29 0.00 -1.56 0.00 0.00 34.95 30.27 3ktm s ARG 102 CO 0.00 -0.49 0.92 0.87 -0.81 0.00 0.00 175.30 175.79 3ktm h LYS 103 N 2.80 0.29 -5.64 5.12 1.79 -1.95 -3.42 116.57 115.56 3ktm h LYS 103 Ca -0.50 -0.50 -0.59 0.00 -2.18 0.00 0.00 60.65 56.88 3ktm h LYS 103 Cb 1.24 0.18 -0.10 0.00 -1.58 0.00 0.00 32.23 31.98 3ktm h LYS 103 CO 0.63 1.18 0.11 -1.14 -1.08 0.00 0.00 179.45 179.15 3ktm s GLN 104 N -2.62 4.20 -0.83 3.15 0.74 -1.26 -5.00 119.66 118.04 3ktm s GLN 104 Ca -0.08 0.60 -0.14 0.00 0.05 0.00 0.00 55.36 55.78 3ktm s GLN 104 Cb 0.07 -3.58 0.21 0.00 1.10 0.00 0.00 33.01 30.81 3ktm s GLN 104 CO 0.87 -0.24 0.79 0.00 -0.55 0.00 0.00 175.29 176.15 3ktm s LYS 106 N 0.33 4.17 -0.99 0.00 1.02 -1.26 -4.69 119.74 118.33 3ktm s LYS 106 Ca 0.19 2.47 -0.23 0.00 0.02 0.00 0.00 55.97 58.41 3ktm s LYS 106 Cb -0.10 -3.40 -0.14 0.00 -0.52 0.00 0.00 37.83 33.67 3ktm s LYS 106 CO -0.09 -0.74 1.93 2.41 -0.92 0.00 0.00 175.35 177.94 3ktm n THR 107 N 4.42 1.60 -3.73 2.17 -1.04 -1.26 -3.54 114.28 112.90 3ktm n THR 107 Ca 0.16 -1.59 -0.28 0.00 -2.04 0.00 0.00 64.05 60.30 3ktm n THR 107 Cb 0.38 -2.19 -0.10 0.00 -1.82 0.00 0.00 70.33 66.60 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 12.67 3.42 -1.03 -1.42 -0.00 -1.26 -4.75 115.22 122.86 3ktm n HIS 108 Ca 0.46 -4.25 -0.36 0.00 -0.00 0.00 0.00 57.72 53.56 3ktm n HIS 108 Cb 0.45 -0.62 -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 1.59 0.00 -4.16 1.57 -0.02 -1.26 -4.71 135.00 128.00 3ktm n PRO 109 Ca 0.23 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.56 3ktm n PRO 109 Cb 0.37 -0.81 -0.13 0.00 -0.02 0.00 0.00 33.50 32.91 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 0.64 -0.39 6.00 3.76 0.14 -4.96 115.29 119.94 3ktm s HIS 110 Ca 0.51 -0.26 -0.13 0.00 -0.15 0.00 0.00 55.06 55.03 3ktm s HIS 110 Cb -0.73 -0.40 0.02 0.00 1.11 0.00 0.00 32.58 32.59 3ktm s HIS 110 CO 0.40 -0.03 0.25 0.12 -0.85 0.00 0.00 174.74 174.63 3ktm s PHE 111 N -0.63 3.24 0.12 1.40 5.99 -1.26 0.25 117.98 127.10 3ktm s PHE 111 Ca -0.02 -0.81 0.04 0.00 0.00 0.00 0.00 56.93 56.15 3ktm s PHE 111 Cb -0.05 -2.50 -0.04 0.00 0.00 0.00 0.00 43.02 40.42 3ktm s PHE 111 CO 0.00 -0.62 -0.11 0.14 -0.00 0.00 0.00 175.22 174.63 3ktm s VAL 112 N 1.61 1.12 -0.43 3.12 -7.23 0.79 -4.86 120.40 114.52 3ktm s VAL 112 Ca 0.03 -1.85 -0.16 0.00 -1.81 0.00 0.00 61.98 58.20 3ktm s VAL 112 Cb -0.19 -1.62 0.03 0.00 0.56 0.00 0.00 36.38 35.16 3ktm s VAL 112 CO 0.08 -0.62 0.35 -0.63 -0.31 0.00 0.00 175.10 173.97 3ktm s ILE 113 N -2.79 5.21 0.97 -0.62 1.01 -1.26 0.16 121.20 123.87 3ktm s ILE 113 Ca 0.11 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 59.97 3ktm s ILE 113 Cb -0.01 -4.00 0.17 0.00 0.01 0.00 0.00 42.46 38.64 3ktm s ILE 113 CO 0.01 -0.40 1.09 -2.84 0.00 0.00 0.00 174.94 172.80 3ktm s PRO 114 N 1.79 0.65 -0.12 2.79 0.02 -1.26 -4.77 135.00 134.09 3ktm s PRO 114 Ca 0.06 0.62 -0.00 0.00 0.02 0.00 0.00 61.00 61.70 3ktm s PRO 114 Cb -0.20 -1.75 -0.02 0.00 0.02 0.00 0.00 34.50 32.55 3ktm s PRO 114 CO 0.10 -2.61 -0.11 0.71 -0.33 0.00 0.00 177.00 174.76 3ktm s TYR 115 N -2.95 2.84 -0.02 6.54 1.51 0.44 -0.99 117.35 124.73 3ktm s TYR 115 Ca 0.65 -0.50 -0.23 0.00 -1.01 0.00 0.00 57.07 55.99 3ktm s TYR 115 Cb -0.18 -1.83 -0.05 0.00 -0.11 0.00 0.00 41.96 39.78 3ktm s TYR 115 CO 0.57 -0.11 0.67 1.03 -1.11 0.00 0.00 175.55 176.60 3ktm s ARG 116 N 0.17 4.40 -0.72 -0.62 0.52 0.40 -1.11 118.95 122.00 3ktm s ARG 116 Ca -0.06 0.86 -0.20 0.00 -0.52 0.00 0.00 55.73 55.80 3ktm s ARG 116 Cb -0.15 -3.39 0.10 0.00 0.52 0.00 0.00 34.95 32.03 3ktm s ARG 116 CO 0.04 0.24 0.94 0.00 0.02 0.00 0.00 175.30 176.54 3ktm s LEU 118 N 3.27 4.41 -0.09 0.00 1.43 0.12 -4.68 118.68 123.14 3ktm s LEU 118 Ca 0.22 2.66 -0.00 0.00 -1.03 0.00 0.00 54.13 55.98 3ktm s LEU 118 Cb -0.15 -3.64 -0.03 0.00 0.03 0.00 0.00 46.19 42.40 3ktm s LEU 118 CO 0.04 -0.60 -0.06 -0.69 0.23 0.00 0.00 176.35 175.26 3ktm s VAL 119 N -0.60 3.75 0.00 -1.59 1.01 -1.26 -1.11 120.40 120.59 3ktm s VAL 119 Ca 0.54 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 62.06 3ktm s VAL 119 Cb -0.40 -2.56 0.00 0.00 0.00 0.00 0.00 36.38 33.42 3ktm s VAL 119 CO 0.48 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.77 3ktm n GLY 120 N 2.53 1.01 3.72 4.51 0.00 -0.02 -4.65 105.19 112.28 3ktm n GLY 120 Ca -0.18 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 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 4.30 0.27 1.61 2.12 -1.26 -4.67 118.70 121.07 3ktm s GLU 121 Ca 0.00 2.16 -0.30 0.00 0.36 0.00 0.00 54.97 57.19 3ktm s GLU 121 Cb 0.00 -3.20 -0.10 0.00 0.26 0.00 0.00 34.13 31.08 3ktm s GLU 121 CO 0.00 -0.44 1.48 0.12 -0.54 0.00 0.00 175.26 175.88 3ktm s PHE 122 N 0.82 2.93 -0.02 5.30 5.36 -1.26 -5.02 117.98 126.09 3ktm s PHE 122 Ca 0.64 0.98 0.00 0.00 -0.96 0.00 0.00 56.93 57.59 3ktm s PHE 122 Cb -0.39 -3.89 0.02 0.00 -0.34 0.00 0.00 43.02 38.42 3ktm s PHE 122 CO 0.33 -2.91 0.01 0.08 -1.46 0.00 0.00 175.22 171.28 3ktm s VAL 123 N -0.10 0.05 0.59 3.12 1.01 -1.26 -5.11 120.40 118.70 3ktm s VAL 123 Ca 0.60 0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.50 3ktm s VAL 123 Cb -0.44 -0.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.77 3ktm s VAL 123 CO 0.46 0.09 1.23 -0.94 0.00 0.00 0.00 175.10 175.94 3ktm s SER 124 N 0.80 5.12 0.40 3.32 1.04 -1.26 -4.95 113.70 118.18 3ktm s SER 124 Ca -0.07 2.46 -0.27 0.00 0.48 0.00 0.00 55.95 58.55 3ktm s SER 124 Cb -0.10 -2.61 -0.10 0.00 0.10 0.00 0.00 66.02 63.32 3ktm s SER 124 CO -0.02 -1.64 1.42 -1.81 0.98 0.00 0.00 173.24 172.17 3ktm s ASP 125 N -1.49 6.22 0.09 7.02 1.01 -1.26 -4.98 116.67 123.27 3ktm s ASP 125 Ca 0.77 2.91 -0.27 0.00 0.71 0.00 0.00 52.55 56.67 3ktm s ASP 125 Cb -0.32 -2.66 -0.06 0.00 1.01 0.00 0.00 42.92 40.89 3ktm s ASP 125 CO 0.35 -0.94 0.84 0.00 0.21 0.00 0.00 175.17 175.63 3ktm s ALA 126 N -1.17 3.34 0.00 5.23 0.00 -1.26 -4.95 121.76 122.95 3ktm s ALA 126 Ca 0.56 0.40 0.08 0.00 0.00 0.00 0.00 51.96 53.00 3ktm s ALA 126 Cb -0.43 -3.09 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 3ktm s ALA 126 CO 0.57 0.07 -0.25 -0.51 0.00 0.00 0.00 175.76 175.65 3ktm s LEU 127 N -0.24 2.09 0.06 0.00 1.43 -1.26 -5.10 118.68 115.66 3ktm s LEU 127 Ca 0.41 -0.50 -0.29 0.00 -1.03 0.00 0.00 54.13 52.72 3ktm s LEU 127 Cb -0.22 -1.27 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 3ktm s LEU 127 CO 0.26 0.29 0.94 -0.76 0.23 0.00 0.00 176.35 177.31 3ktm s LEU 128 N -0.80 4.44 -0.45 1.79 1.43 -1.26 -5.02 118.68 118.82 3ktm s LEU 128 Ca 0.10 1.70 -0.07 0.00 -1.03 0.00 0.00 54.13 54.82 3ktm s LEU 128 Cb -0.10 -3.53 0.11 0.00 0.03 0.00 0.00 46.19 42.71 3ktm s LEU 128 CO 0.00 -0.13 0.29 -0.69 0.23 0.00 0.00 176.35 176.06 3ktm s VAL 129 N 0.36 3.91 0.50 -1.59 1.01 -1.26 -4.95 120.40 118.39 3ktm s VAL 129 Ca 0.47 -1.85 -0.22 0.00 0.00 0.00 0.00 61.98 60.39 3ktm s VAL 129 Cb -0.22 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.50 3ktm s VAL 129 CO 0.28 -0.73 1.25 -2.16 0.00 0.00 0.00 175.10 173.75 3ktm s PRO 130 N 1.30 3.47 0.09 2.72 0.04 -1.26 -4.87 135.00 136.49 3ktm s PRO 130 Ca 0.06 1.99 -0.35 0.00 0.04 0.00 0.00 61.00 62.74 3ktm s PRO 130 Cb -0.25 -2.34 -0.18 0.00 0.04 0.00 0.00 34.50 31.77 3ktm s PRO 130 CO -0.02 -0.85 0.99 -0.25 0.04 0.00 0.00 177.00 176.92 3ktm n ASP 131 N -0.73 0.15 0.00 6.66 10.43 -1.26 -1.09 116.55 130.70 3ktm n ASP 131 Ca 0.09 1.15 0.00 0.00 2.57 0.00 0.00 54.79 58.59 3ktm n ASP 131 Cb 0.47 -1.02 0.00 0.00 1.84 0.00 0.00 41.12 42.41 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 1.53 0.00 -2.47 -1.24 4.76 -1.26 -4.99 118.16 114.48 3ktm n LYS 132 Ca 0.18 0.00 -0.25 0.00 -2.87 0.00 0.00 58.31 55.38 3ktm n LYS 132 Cb 0.16 -2.37 0.04 0.00 -1.84 0.00 0.00 35.03 31.02 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 -4.96 1.81 -0.19 0.00 1.02 0.10 -4.88 119.74 112.64 3ktm s LYS 134 Ca 0.56 -0.73 -0.19 0.00 0.02 0.00 0.00 55.97 55.63 3ktm s LYS 134 Cb -0.10 -1.67 -0.03 0.00 -0.52 0.00 0.00 37.83 35.51 3ktm s LYS 134 CO 0.43 0.39 0.55 0.12 -0.92 0.00 0.00 175.35 175.91 3ktm s PHE 135 N -0.31 3.38 0.26 3.18 2.19 -1.26 -1.08 117.98 124.34 3ktm s PHE 135 Ca 0.03 0.83 0.03 0.00 0.33 0.00 0.00 56.93 58.15 3ktm s PHE 135 Cb -0.10 -2.71 -0.05 0.00 -1.31 0.00 0.00 43.02 38.85 3ktm s PHE 135 CO 0.01 -0.11 0.03 -0.51 1.83 0.00 0.00 175.22 176.47 3ktm s LEU 136 N 1.67 2.06 -0.08 6.12 1.43 -0.11 -5.01 118.68 124.77 3ktm s LEU 136 Ca 0.26 -1.29 -0.29 0.00 -1.03 0.00 0.00 54.13 51.77 3ktm s LEU 136 Cb -0.16 -0.23 0.07 0.00 0.03 0.00 0.00 46.19 45.90 3ktm s LEU 136 CO 0.10 -0.58 0.66 -1.38 0.23 0.00 0.00 176.35 175.38 3ktm s HIS 137 N -3.46 -0.65 0.01 0.29 -3.43 -1.26 -0.68 115.29 106.11 3ktm s HIS 137 Ca 0.32 1.18 0.00 0.00 -0.80 0.00 0.00 55.06 55.77 3ktm s HIS 137 Cb 0.07 0.37 -0.01 0.00 -1.43 0.00 0.00 32.58 31.58 3ktm s HIS 137 CO 0.11 -0.56 -0.02 -0.65 -2.00 0.00 0.00 174.74 171.62 3ktm s GLN 138 N -0.98 0.20 0.15 -0.38 -0.21 -0.46 -5.00 119.66 112.98 3ktm s GLN 138 Ca -0.10 -0.29 -0.25 0.00 0.02 0.00 0.00 55.36 54.75 3ktm s GLN 138 Cb -0.01 -0.04 0.06 0.00 1.00 0.00 0.00 33.01 34.02 3ktm s GLN 138 CO 0.08 0.00 0.81 -1.83 -2.12 0.00 0.00 175.29 172.24 3ktm s GLU 139 N -0.64 1.26 -0.14 2.91 1.03 -1.26 -0.65 118.70 121.20 3ktm s GLU 139 Ca -0.06 -0.61 -0.08 0.00 0.03 0.00 0.00 54.97 54.26 3ktm s GLU 139 Cb -0.04 0.48 0.05 0.00 -0.80 0.00 0.00 34.13 33.82 3ktm s GLU 139 CO -0.00 -0.57 0.34 1.03 -1.33 0.00 0.00 175.26 174.73 3ktm s ARG 140 N -3.48 0.31 0.62 -4.83 1.81 -0.78 -5.00 118.95 107.60 3ktm s ARG 140 Ca 0.08 0.67 0.40 0.00 -1.72 0.00 0.00 55.73 55.16 3ktm s ARG 140 Cb -0.02 -0.06 2.01 0.00 -0.45 0.00 0.00 34.95 36.43 3ktm s ARG 140 CO -0.03 -0.16 2.22 0.52 -0.68 0.00 0.00 175.30 177.17 3ktm h MET 141 N 7.12 0.00 -0.37 3.54 2.86 -2.02 -2.99 114.93 123.07 3ktm h MET 141 Ca -0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 3ktm h MET 141 Cb 1.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.83 3ktm h MET 141 CO 0.33 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 177.90 3ktm n ASP 142 N -3.07 4.03 -4.18 1.22 5.75 -1.26 -4.94 116.55 114.09 3ktm n ASP 142 Ca -0.02 -2.72 -0.25 0.00 -0.01 0.00 0.00 54.79 51.79 3ktm n ASP 142 Cb 0.16 -0.50 -0.15 0.00 -1.03 0.00 0.00 41.12 39.60 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 -2.32 1.41 -0.26 2.12 -7.23 -1.13 -5.10 120.40 107.90 3ktm s VAL 143 Ca 0.41 -0.85 -0.01 0.00 -1.81 0.00 0.00 61.98 59.72 3ktm s VAL 143 Cb 0.30 -1.19 0.08 0.00 0.56 0.00 0.00 36.38 36.13 3ktm s VAL 143 CO 0.13 0.32 0.04 0.00 -0.31 0.00 0.00 175.10 175.28 3ktm s GLU 145 N 1.60 2.00 0.52 0.00 0.41 0.03 -4.86 118.70 118.40 3ktm s GLU 145 Ca 0.03 -2.23 -0.05 0.00 -0.41 0.00 0.00 54.97 52.31 3ktm s GLU 145 Cb -0.18 -0.93 -0.01 0.00 -1.78 0.00 0.00 34.13 31.23 3ktm s GLU 145 CO -0.14 -0.42 0.81 0.95 -0.49 0.00 0.00 175.26 175.97 3ktm s THR 146 N -3.10 4.24 0.25 3.63 -4.23 -1.26 -0.20 115.64 114.96 3ktm s THR 146 Ca 0.19 -0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 60.66 3ktm s THR 146 Cb 0.03 -3.63 0.22 0.00 1.34 0.00 0.00 72.50 70.46 3ktm s THR 146 CO 0.11 -0.60 1.82 -0.74 -0.54 0.00 0.00 174.62 174.67 3ktm h HIS 147 N 0.09 0.91 -0.68 3.99 -0.00 -1.97 -1.10 115.15 116.39 3ktm h HIS 147 Ca -0.46 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 59.91 3ktm h HIS 147 Cb 1.23 -0.28 -0.03 0.00 -0.00 0.00 0.00 27.41 28.33 3ktm h HIS 147 CO 0.51 0.39 0.32 1.25 -0.00 0.00 0.00 177.93 180.41 3ktm h LEU 148 N 0.85 0.89 0.33 0.26 5.85 -1.97 0.31 115.31 121.84 3ktm h LEU 148 Ca 0.40 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 3ktm h LEU 148 Cb 0.33 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.13 3ktm h LEU 148 CO -0.23 0.78 -0.23 -0.74 -0.34 0.00 0.00 178.44 177.67 3ktm h HIS 149 N 0.94 -0.60 -0.26 1.25 2.76 -1.61 -1.70 115.15 115.94 3ktm h HIS 149 Ca 0.23 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.37 3ktm h HIS 149 Cb 0.12 0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 3ktm h HIS 149 CO 0.00 -0.35 0.04 -1.49 -1.30 0.00 0.00 177.93 174.84 3ktm h TRP 150 N -0.55 0.37 -0.31 5.26 4.06 -1.19 -0.15 115.95 123.43 3ktm h TRP 150 Ca -0.03 -0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.89 3ktm h TRP 150 Cb 0.47 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 28.50 3ktm h TRP 150 CO -0.11 0.35 0.16 1.25 -3.56 0.00 0.00 178.44 176.53 3ktm h HIS 151 N 0.37 0.44 -0.67 0.49 2.76 -0.67 -1.15 115.15 116.72 3ktm h HIS 151 Ca 0.09 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.21 3ktm h HIS 151 Cb 0.18 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 28.97 3ktm h HIS 151 CO 0.00 0.37 0.28 1.15 -1.30 0.00 0.00 177.93 178.44 3ktm h THR 152 N 0.38 1.24 -0.10 6.26 2.02 -0.37 0.04 112.91 122.38 3ktm h THR 152 Ca 0.11 -0.72 0.02 0.00 0.77 0.00 0.00 66.41 66.59 3ktm h THR 152 Cb 0.08 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 3ktm h THR 152 CO -0.02 0.29 -0.03 0.58 0.37 0.00 0.00 175.52 176.71 3ktm h VAL 153 N 0.95 0.88 -0.60 3.16 2.07 -0.73 0.27 116.25 122.25 3ktm h VAL 153 Ca 0.23 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.73 3ktm h VAL 153 Cb 0.18 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 3ktm h VAL 153 CO -0.02 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.87 3ktm h ALA 154 N 1.09 0.77 -0.21 1.67 0.00 -0.99 -0.54 119.26 121.04 3ktm h ALA 154 Ca 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3ktm h ALA 154 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3ktm h ALA 154 CO -0.11 0.32 0.11 -0.22 0.00 0.00 0.00 179.25 179.35 3ktm h LYS 155 N 0.81 0.30 -0.39 0.00 3.64 -0.58 -2.37 116.57 117.99 3ktm h LYS 155 Ca 0.21 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.60 3ktm h LYS 155 Cb 0.10 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.82 3ktm h LYS 155 CO -0.03 0.30 0.12 0.93 -2.27 0.00 0.00 179.45 178.50 3ktm h GLU 156 N 0.23 0.26 -0.76 1.90 5.08 -0.15 0.18 114.58 121.33 3ktm h GLU 156 Ca 0.07 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 3ktm h GLU 156 Cb 0.09 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 3ktm h GLU 156 CO -0.01 0.18 0.47 1.15 -1.00 0.00 0.00 179.01 179.79 3ktm h THR 157 N 0.27 1.06 -0.15 1.13 2.02 -0.89 0.82 112.91 117.17 3ktm h THR 157 Ca 0.18 -0.30 -0.10 0.00 0.77 0.00 0.00 66.41 66.96 3ktm h THR 157 Cb 0.18 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 3ktm h THR 157 CO -0.20 0.16 -0.29 0.00 0.37 0.00 0.00 175.52 175.56 3ktm h SER 159 N 0.07 0.67 -0.56 0.00 0.02 -0.69 -0.66 113.55 112.41 3ktm h SER 159 Ca 0.01 0.05 0.08 0.00 -0.84 0.00 0.00 61.79 61.08 3ktm h SER 159 Cb 0.88 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 63.28 3ktm h SER 159 CO 0.06 0.38 0.22 -0.33 -1.14 0.00 0.00 176.83 176.02 3ktm h GLU 160 N 0.78 0.39 0.00 3.45 5.08 -0.79 0.83 114.58 124.32 3ktm h GLU 160 Ca 0.40 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 3ktm h GLU 160 Cb 0.38 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3ktm h GLU 160 CO -0.25 0.26 0.00 1.63 -1.00 0.00 0.00 179.01 179.65 3ktm n LYS 161 N -4.98 0.89 -3.24 2.33 5.02 -0.37 -4.88 118.16 112.94 3ktm n LYS 161 Ca 0.07 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.21 3ktm n LYS 161 Cb 0.23 -1.25 0.08 0.00 -0.02 0.00 0.00 35.03 34.07 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 -0.75 -3.66 -2.94 4.39 7.64 0.29 -5.02 113.62 113.57 3ktm n SER 162 Ca 0.11 -0.60 -0.16 0.00 1.01 0.00 0.00 58.87 59.22 3ktm n SER 162 Cb 0.05 -4.79 -0.06 0.00 -1.01 0.00 0.00 64.21 58.40 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 -3.58 0.00 -4.55 0.44 -2.24 -0.55 -4.56 114.28 99.25 3ktm n THR 163 Ca -0.19 -2.04 -0.33 0.00 -2.27 0.00 0.00 64.05 59.22 3ktm n THR 163 Cb 0.64 1.06 -0.11 0.00 -2.10 0.00 0.00 70.33 69.82 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 -3.04 4.64 -0.38 3.42 0.01 0.17 -4.01 114.94 115.76 3ktm s ASN 164 Ca 0.33 -0.08 -0.26 0.00 -0.71 0.00 0.00 52.86 52.15 3ktm s ASN 164 Cb 0.01 -1.13 0.02 0.00 0.41 0.00 0.00 41.25 40.56 3ktm s ASN 164 CO 0.24 0.33 0.92 -0.22 -1.51 0.00 0.00 177.10 176.85 3ktm s LEU 165 N -1.09 4.01 -0.12 0.60 2.96 -1.26 0.23 118.68 124.00 3ktm s LEU 165 Ca 0.15 0.52 0.07 0.00 -0.22 0.00 0.00 54.13 54.64 3ktm s LEU 165 Cb -0.11 -3.24 -0.23 0.00 0.50 0.00 0.00 46.19 43.11 3ktm s LEU 165 CO 0.04 -0.87 0.34 1.57 -1.32 0.00 0.00 176.35 176.12 3ktm n HIS 166 N 6.79 0.75 -3.54 5.38 -0.00 -0.30 -4.98 115.22 119.32 3ktm n HIS 166 Ca 0.07 0.22 -0.09 0.00 -0.00 0.00 0.00 57.72 57.92 3ktm n HIS 166 Cb 0.48 -1.12 -0.03 0.00 -0.00 0.00 0.00 29.99 29.32 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 -6.31 -0.34 0.22 0.26 3.68 -1.25 -4.99 116.67 107.95 3ktm s ASP 167 Ca -0.15 0.13 -0.17 0.00 2.13 0.00 0.00 52.55 54.48 3ktm s ASP 167 Cb 0.07 0.34 0.02 0.00 -1.45 0.00 0.00 42.92 41.90 3ktm s ASP 167 CO 0.78 -0.50 0.56 -0.72 0.13 0.00 0.00 175.17 175.42 3ktm s TYR 168 N -2.43 -0.05 0.10 -5.34 1.13 -1.26 -0.33 117.35 109.17 3ktm s TYR 168 Ca 0.03 -0.32 -0.16 0.00 -1.41 0.00 0.00 57.07 55.21 3ktm s TYR 168 Cb -0.01 0.43 0.03 0.00 -1.10 0.00 0.00 41.96 41.31 3ktm s TYR 168 CO -0.05 -1.00 0.38 0.20 -2.51 0.00 0.00 175.55 172.57 3ktm s GLY 169 N -2.91 -0.24 0.50 5.49 0.00 0.19 -4.95 107.32 105.40 3ktm s GLY 169 Ca 0.12 -0.00 -0.15 0.00 0.00 0.00 0.00 44.72 44.69 3ktm s GLY 169 CO 0.01 -0.26 0.94 1.06 0.00 0.00 0.00 173.10 174.86 3ktm s MET 170 N -3.42 3.89 0.08 2.90 -1.94 -1.26 -0.15 119.30 119.39 3ktm s MET 170 Ca 0.01 0.84 0.04 0.00 -1.71 0.00 0.00 55.69 54.86 3ktm s MET 170 Cb 0.01 -2.19 -0.03 0.00 2.01 0.00 0.00 34.83 34.64 3ktm s MET 170 CO -0.09 -0.24 -0.10 -0.51 -0.01 0.00 0.00 175.02 174.07 3ktm s LEU 171 N -4.09 2.35 -0.53 -0.03 1.43 -0.44 -4.57 118.68 112.79 3ktm s LEU 171 Ca 0.57 -0.72 -0.23 0.00 -1.03 0.00 0.00 54.13 52.72 3ktm s LEU 171 Cb -0.10 -0.30 0.03 0.00 0.03 0.00 0.00 46.19 45.85 3ktm s LEU 171 CO 0.33 -0.22 0.64 0.18 0.23 0.00 0.00 176.35 177.51 3ktm n LEU 172 N 0.91 -4.27 -4.77 1.79 7.99 -1.26 -2.22 117.00 115.17 3ktm n LEU 172 Ca -0.19 -0.09 -0.40 0.00 -0.01 0.00 0.00 56.01 55.32 3ktm n LEU 172 Cb 0.56 -2.25 -0.01 0.00 -0.11 0.00 0.00 43.42 41.61 3ktm n LEU 172 CO 0.24 -0.69 0.95 -2.16 -1.51 0.00 0.00 177.39 174.22 3ktm s PRO 173 N -2.95 4.17 -0.00 3.23 0.04 -1.26 -0.85 135.00 137.38 3ktm s PRO 173 Ca 0.25 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.43 3ktm s PRO 173 Cb -0.04 -2.90 0.00 0.00 0.04 0.00 0.00 34.50 31.61 3ktm s PRO 173 CO 0.84 -0.32 0.83 0.00 0.04 0.00 0.00 177.00 178.39 3ktm n GLY 175 N -0.34 -1.46 3.61 0.00 0.00 -1.21 -4.95 105.19 100.84 3ktm n GLY 175 Ca 0.00 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.57 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 -2.41 3.81 -1.26 -0.61 1.01 -1.26 -2.74 121.20 117.74 3ktm s ILE 176 Ca 0.00 0.84 -0.07 0.00 0.00 0.00 0.00 60.65 61.43 3ktm s ILE 176 Cb 0.00 -4.02 0.01 0.00 0.01 0.00 0.00 42.46 38.46 3ktm s ILE 176 CO 0.00 -0.60 1.10 -0.67 0.00 0.00 0.00 174.94 174.76 3ktm n ASP 177 N 8.99 -5.31 -3.90 3.58 2.03 -1.19 -4.91 116.55 115.84 3ktm n ASP 177 Ca 0.18 -0.53 -0.15 0.00 0.52 0.00 0.00 54.79 54.81 3ktm n ASP 177 Cb 0.47 -4.85 -0.15 0.00 -0.72 0.00 0.00 41.12 35.88 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 -6.05 0.32 0.14 -0.67 -0.14 -1.11 -4.49 119.74 107.73 3ktm s LYS 178 Ca 0.44 -0.08 0.00 0.00 -1.36 0.00 0.00 55.97 54.97 3ktm s LYS 178 Cb -0.19 -0.35 -0.04 0.00 -1.68 0.00 0.00 37.83 35.57 3ktm s LYS 178 CO 0.70 0.03 0.02 -0.06 -0.76 0.00 0.00 175.35 175.27 3ktm s PHE 179 N 0.19 0.99 -2.62 3.18 0.40 0.72 -1.01 117.98 119.83 3ktm s PHE 179 Ca -0.02 -1.11 0.21 0.00 -0.60 0.00 0.00 56.93 55.42 3ktm s PHE 179 Cb -0.05 -0.57 0.16 0.00 0.51 0.00 0.00 43.02 43.07 3ktm s PHE 179 CO -0.00 -0.35 1.17 0.54 0.70 0.00 0.00 175.22 177.27 3ktm n ARG 180 N -0.14 1.94 -3.69 0.44 1.74 -0.03 -0.79 116.66 116.13 3ktm n ARG 180 Ca -0.07 -1.71 -0.01 0.00 -0.77 0.00 0.00 57.85 55.28 3ktm n ARG 180 Cb 0.63 -1.41 0.02 0.00 -1.02 0.00 0.00 32.46 30.68 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 1.22 0.54 3.06 -0.13 0.00 -1.13 -1.86 105.19 106.89 3ktm n GLY 181 Ca 0.12 -1.10 -0.11 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.08 0.06 -0.06 1.61 0.11 0.17 -1.33 120.40 118.88 3ktm s VAL 182 Ca 0.23 -0.46 0.05 0.00 -2.93 0.00 0.00 61.98 58.87 3ktm s VAL 182 Cb -0.02 -0.33 -0.02 0.00 -1.53 0.00 0.00 36.38 34.49 3ktm s VAL 182 CO 0.03 -0.25 -0.20 -1.83 -3.33 0.00 0.00 175.10 169.53 3ktm s GLU 183 N -0.84 2.54 0.28 1.54 -1.05 0.78 -1.36 118.70 120.59 3ktm s GLU 183 Ca -0.09 -0.81 -0.10 0.00 -0.15 0.00 0.00 54.97 53.82 3ktm s GLU 183 Cb -0.05 -2.27 0.00 0.00 -0.44 0.00 0.00 34.13 31.36 3ktm s GLU 183 CO 0.01 0.49 0.49 -0.59 0.95 0.00 0.00 175.26 176.61 3ktm s PHE 184 N -0.41 0.52 -0.09 4.83 -0.71 0.14 0.57 117.98 122.83 3ktm s PHE 184 Ca 0.04 -0.87 0.02 0.00 -1.04 0.00 0.00 56.93 55.08 3ktm s PHE 184 Cb -0.12 0.16 0.01 0.00 -1.21 0.00 0.00 43.02 41.87 3ktm s PHE 184 CO 0.02 -1.07 -0.15 0.08 -1.34 0.00 0.00 175.22 172.76 3ktm s VAL 185 N -3.66 1.41 -0.06 -2.49 1.01 0.55 -0.93 120.40 116.22 3ktm s VAL 185 Ca 0.24 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.60 3ktm s VAL 185 Cb -0.01 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 3ktm s VAL 185 CO 0.12 0.42 -0.03 0.00 0.00 0.00 0.00 175.10 175.61 3ktm s PRO 188 N -1.14 2.85 0.50 0.00 0.02 -1.26 0.44 135.00 136.41 3ktm s PRO 188 Ca 0.06 1.68 0.29 0.00 0.02 0.00 0.00 61.00 63.05 3ktm s PRO 188 Cb -0.08 -1.93 1.14 0.00 0.02 0.00 0.00 34.50 33.64 3ktm s PRO 188 CO 0.02 -1.26 1.90 -0.07 -0.33 0.00 0.00 177.00 177.26 3ktm h LEU 189 N 0.54 0.00 -7.00 -5.54 3.38 -1.90 -3.42 115.31 101.37 3ktm h LEU 189 Ca -0.49 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 3ktm h LEU 189 Cb 1.28 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.90 3ktm h LEU 189 CO 0.54 0.10 0.24 0.00 0.09 0.00 0.00 178.44 179.42 3ktm s ALA 190 N -3.66 -1.65 -0.14 1.53 0.00 -1.26 -1.72 121.76 114.86 3ktm s ALA 190 Ca 0.01 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.63 3ktm s ALA 190 Cb 0.09 0.71 0.03 0.00 0.00 0.00 0.00 23.12 23.95 3ktm s ALA 190 CO 0.59 -0.71 -0.11 0.42 0.00 0.00 0.00 175.76 175.95 3ktm s ILE 191 N -3.34 1.34 -1.47 0.00 1.01 0.23 -4.78 121.20 114.18 3ktm s ILE 191 Ca -0.00 -0.52 -0.07 0.00 0.00 0.00 0.00 60.65 60.06 3ktm s ILE 191 Cb -0.01 -1.31 0.05 0.00 0.01 0.00 0.00 42.46 41.20 3ktm s ILE 191 CO -0.10 0.39 0.72 -0.62 0.00 0.00 0.00 174.94 175.34 3ktm n GLU 192 N 4.84 -4.35 0.00 2.79 1.02 -1.26 -2.18 120.64 121.50 3ktm n GLU 192 Ca -0.15 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.50 3ktm n GLU 192 Cb 0.50 -5.08 0.00 0.00 -0.02 0.00 0.00 31.44 26.84 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 -1.69 2.53 3.69 0.62 0.00 -1.26 -5.01 105.19 104.06 3ktm n GLY 193 Ca -0.13 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 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 4.44 0.60 1.61 3.03 -0.92 -4.98 118.95 122.73 3ktm s ARG 194 Ca 0.00 1.33 -0.18 0.00 2.03 0.00 0.00 55.73 58.91 3ktm s ARG 194 Cb 0.00 -3.53 -0.05 0.00 -1.03 0.00 0.00 34.95 30.34 3ktm s ARG 194 CO 0.00 -0.25 0.87 1.17 -1.13 0.00 0.00 175.30 175.96 3ktm n LYS 195 N 4.76 0.78 -3.98 3.89 4.81 -1.26 -0.60 118.16 126.56 3ktm n LYS 195 Ca 0.07 0.31 -0.34 0.00 -0.87 0.00 0.00 58.31 57.48 3ktm n LYS 195 Cb 0.49 -2.08 -0.14 0.00 0.02 0.00 0.00 35.03 33.33 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 -1.55 3.74 0.45 3.14 2.96 -0.70 -4.74 118.68 121.98 3ktm s LEU 196 Ca 0.75 -1.36 0.05 0.00 -0.22 0.00 0.00 54.13 53.35 3ktm s LEU 196 Cb -0.42 -1.64 -0.05 0.00 0.50 0.00 0.00 46.19 44.59 3ktm s LEU 196 CO 0.48 -0.24 0.06 0.00 -1.32 0.00 0.00 176.35 175.33 3ktm s ALA 197 N 1.17 3.60 -0.25 5.97 0.00 -1.26 -4.80 121.76 126.19 3ktm s ALA 197 Ca -0.06 -1.62 -0.28 0.00 0.00 0.00 0.00 51.96 50.00 3ktm s ALA 197 Cb -0.20 -0.02 0.16 0.00 0.00 0.00 0.00 23.12 23.06 3ktm s ALA 197 CO -0.03 -0.12 1.19 0.00 0.00 0.00 0.00 175.76 176.81 3ktm s ALA 198 N -2.75 -2.05 -0.17 0.00 0.00 -1.26 -5.16 121.76 110.37 3ktm s ALA 198 Ca 0.27 1.75 -0.03 0.00 0.00 0.00 0.00 51.96 53.94 3ktm s ALA 198 Cb 0.06 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 3ktm s ALA 198 CO 0.14 -0.23 -0.05 0.00 0.00 0.00 0.00 175.76 175.63 3ktm s ALA 199 N -0.52 2.89 -1.17 0.00 0.00 -1.26 -5.21 121.76 116.49 3ktm s ALA 199 Ca 0.04 -0.94 0.09 0.00 0.00 0.00 0.00 51.96 51.16 3ktm s ALA 199 Cb -0.03 -1.56 0.07 0.00 0.00 0.00 0.00 23.12 21.61 3ktm s ALA 199 CO -0.06 0.02 0.80 1.28 0.00 0.00 0.00 175.76 177.79