#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 5.83 0.00 2.23 7.99 0.13 -4.86 117.00 128.32 3ktm n LEU 29 Ca 0.00 -3.08 0.00 0.00 -0.01 0.00 0.00 56.01 52.92 3ktm n LEU 29 Cb 0.00 -0.75 0.00 0.00 -0.11 0.00 0.00 43.42 42.56 3ktm n LEU 29 CO 0.00 0.88 0.00 0.00 -1.51 0.00 0.00 177.39 176.76 3ktm n ALA 30 N -0.63 0.00 -2.55 -1.18 0.00 -1.16 -4.63 120.51 110.36 3ktm n ALA 30 Ca 0.44 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.46 3ktm n ALA 30 Cb 1.38 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.80 3ktm n ALA 30 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3ktm s GLU 31 N -1.62 4.49 0.27 0.00 2.12 -1.26 -4.63 118.70 118.07 3ktm s GLU 31 Ca 0.00 1.61 -0.29 0.00 0.36 0.00 0.00 54.97 56.64 3ktm s GLU 31 Cb 0.00 -3.40 -0.10 0.00 0.26 0.00 0.00 34.13 30.89 3ktm s GLU 31 CO 0.00 -0.15 1.35 -1.25 -0.54 0.00 0.00 175.26 174.66 3ktm s PRO 32 N 1.01 4.34 0.12 4.30 0.04 -1.26 -4.84 135.00 138.71 3ktm s PRO 32 Ca 0.55 2.20 -0.25 0.00 0.04 0.00 0.00 61.00 63.54 3ktm s PRO 32 Cb -0.26 -3.12 0.08 0.00 0.04 0.00 0.00 34.50 31.25 3ktm s PRO 32 CO 0.29 -0.27 0.69 1.14 0.04 0.00 0.00 177.00 178.89 3ktm s GLN 33 N -0.92 1.17 0.06 4.56 -2.07 -1.26 -1.83 119.66 119.37 3ktm s GLN 33 Ca 0.54 -0.44 0.07 0.00 -1.82 0.00 0.00 55.36 53.71 3ktm s GLN 33 Cb -0.39 0.53 -0.03 0.00 -1.09 0.00 0.00 33.01 32.03 3ktm s GLN 33 CO 0.46 -0.51 -0.19 0.96 -1.32 0.00 0.00 175.29 174.69 3ktm s ILE 34 N -3.57 1.54 0.01 3.63 -5.25 -0.13 -0.45 121.20 116.98 3ktm s ILE 34 Ca 0.03 -1.28 0.04 0.00 -0.99 0.00 0.00 60.65 58.44 3ktm s ILE 34 Cb -0.01 -1.38 -0.01 0.00 2.95 0.00 0.00 42.46 44.00 3ktm s ILE 34 CO -0.11 0.05 -0.13 0.00 -1.79 0.00 0.00 174.94 172.96 3ktm s ALA 35 N -0.96 1.05 0.15 2.27 0.00 0.32 -0.07 121.76 124.52 3ktm s ALA 35 Ca 0.05 -0.64 0.06 0.00 0.00 0.00 0.00 51.96 51.43 3ktm s ALA 35 Cb -0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.77 3ktm s ALA 35 CO 0.03 0.23 -0.13 -1.64 0.00 0.00 0.00 175.76 174.25 3ktm s MET 36 N -0.63 1.10 -0.32 0.00 -1.94 -1.26 -0.58 119.30 115.67 3ktm s MET 36 Ca 0.03 -1.38 0.03 0.00 -1.71 0.00 0.00 55.69 52.66 3ktm s MET 36 Cb -0.06 -0.85 0.16 0.00 2.01 0.00 0.00 34.83 36.09 3ktm s MET 36 CO 0.00 0.14 0.42 0.12 -0.01 0.00 0.00 175.02 175.70 3ktm s PHE 37 N -2.70 -0.93 0.02 -0.03 2.19 -1.26 -4.90 117.98 110.37 3ktm s PHE 37 Ca 0.14 0.07 -0.39 0.00 0.33 0.00 0.00 56.93 57.09 3ktm s PHE 37 Cb -0.02 -0.16 -0.18 0.00 -1.31 0.00 0.00 43.02 41.35 3ktm s PHE 37 CO 0.03 -1.00 1.23 0.00 1.83 0.00 0.00 175.22 177.31 3ktm n GLY 39 N 2.12 2.75 3.51 0.00 0.00 -1.26 -5.03 105.19 107.28 3ktm n GLY 39 Ca 0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.56 1.74 0.28 1.61 1.81 -0.01 -4.66 118.95 119.17 3ktm s ARG 40 Ca 0.00 -1.94 -0.29 0.00 -1.72 0.00 0.00 55.73 51.79 3ktm s ARG 40 Cb 0.00 -1.33 -0.09 0.00 -0.45 0.00 0.00 34.95 33.08 3ktm s ARG 40 CO 0.00 -0.02 0.99 -0.51 -0.68 0.00 0.00 175.30 175.08 3ktm s LEU 41 N -3.56 4.53 0.52 2.53 1.43 0.14 -4.05 118.68 120.21 3ktm s LEU 41 Ca 0.33 2.01 -0.21 0.00 -1.03 0.00 0.00 54.13 55.23 3ktm s LEU 41 Cb 0.06 -3.74 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 3ktm s LEU 41 CO 0.15 -0.01 1.10 0.59 0.23 0.00 0.00 176.35 178.42 3ktm n ASN 42 N 1.11 1.54 -4.62 2.29 3.02 -0.76 -4.65 115.26 113.20 3ktm n ASN 42 Ca -0.00 0.94 -0.26 0.00 -0.03 0.00 0.00 54.58 55.23 3ktm n ASN 42 Cb 0.47 -1.44 -0.08 0.00 -0.61 0.00 0.00 39.78 38.12 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 -2.53 2.24 -0.04 3.52 -1.94 0.26 -0.79 119.30 120.01 3ktm s MET 43 Ca 0.70 -1.24 -0.13 0.00 -1.71 0.00 0.00 55.69 53.30 3ktm s MET 43 Cb -0.46 -2.23 0.02 0.00 2.01 0.00 0.00 34.83 34.17 3ktm s MET 43 CO 0.51 0.43 0.30 -3.38 -0.01 0.00 0.00 175.02 172.87 3ktm s HIS 44 N -1.85 -0.21 0.08 -0.03 -3.43 -0.61 -0.52 115.29 108.71 3ktm s HIS 44 Ca 0.27 0.41 -0.31 0.00 -0.80 0.00 0.00 55.06 54.63 3ktm s HIS 44 Cb -0.08 0.09 -0.07 0.00 -1.43 0.00 0.00 32.58 31.08 3ktm s HIS 44 CO 0.17 -0.32 1.46 1.41 -2.00 0.00 0.00 174.74 175.47 3ktm s MET 45 N -0.91 4.27 -0.58 -0.38 1.75 0.41 -1.46 119.30 122.41 3ktm s MET 45 Ca -0.10 2.12 -0.28 0.00 -1.25 0.00 0.00 55.69 56.18 3ktm s MET 45 Cb -0.05 -3.41 0.03 0.00 2.84 0.00 0.00 34.83 34.25 3ktm s MET 45 CO 0.03 -0.55 1.20 1.21 -0.65 0.00 0.00 175.02 176.26 3ktm s ASN 46 N 1.60 6.44 0.00 1.11 3.84 0.43 -4.57 114.94 123.79 3ktm s ASN 46 Ca 0.67 0.12 0.10 0.00 0.21 0.00 0.00 52.86 53.96 3ktm s ASN 46 Cb -0.36 -2.55 0.52 0.00 -0.55 0.00 0.00 41.25 38.30 3ktm s ASN 46 CO 0.30 -1.49 1.22 1.33 -2.79 0.00 0.00 177.10 175.67 3ktm n VAL 47 N 6.68 0.76 -0.08 -5.21 0.24 -1.26 -1.36 118.33 118.10 3ktm n VAL 47 Ca 0.09 0.19 -0.11 0.00 -2.04 0.00 0.00 64.34 62.47 3ktm n VAL 47 Cb 0.49 -1.02 -0.05 0.00 -1.47 0.00 0.00 33.84 31.79 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 -1.29 0.49 -0.08 7.34 6.02 -1.26 0.20 117.38 128.81 3ktm n GLN 48 Ca 0.05 0.51 -0.19 0.00 -0.01 0.00 0.00 57.00 57.35 3ktm n GLN 48 Cb 0.08 -1.68 -0.12 0.00 1.02 0.00 0.00 30.24 29.54 3ktm n GLN 48 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 177.06 173.10 3ktm h ASN 49 N -1.00 0.06 0.00 1.08 -1.07 -1.88 -3.41 115.58 109.36 3ktm h ASN 49 Ca -0.13 -0.72 0.00 0.00 0.07 0.00 0.00 56.30 55.52 3ktm h ASN 49 Cb 0.81 -0.02 0.00 0.00 -2.07 0.00 0.00 38.32 37.05 3ktm h ASN 49 CO -0.08 1.35 0.00 0.61 0.07 0.00 0.00 177.43 179.38 3ktm n GLY 50 N 1.54 1.53 3.71 9.14 0.00 -0.47 -4.96 105.19 115.68 3ktm n GLY 50 Ca -0.24 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.03 2.36 0.04 1.61 1.02 -1.25 -4.82 119.74 118.66 3ktm s LYS 51 Ca 0.00 -1.52 -0.27 0.00 0.02 0.00 0.00 55.97 54.20 3ktm s LYS 51 Cb 0.00 -2.17 -0.05 0.00 -0.52 0.00 0.00 37.83 35.09 3ktm s LYS 51 CO 0.00 0.17 0.86 -1.58 -0.92 0.00 0.00 175.35 173.88 3ktm s TRP 52 N -2.40 3.72 0.35 3.18 0.52 -1.26 -0.42 118.94 122.62 3ktm s TRP 52 Ca 0.36 1.59 0.09 0.00 0.02 0.00 0.00 56.10 58.16 3ktm s TRP 52 Cb -0.03 -2.95 -0.06 0.00 -1.15 0.00 0.00 33.47 29.28 3ktm s TRP 52 CO 0.22 0.17 -0.01 -0.51 0.02 0.00 0.00 176.95 176.84 3ktm s ASP 53 N 0.31 4.07 0.36 2.95 1.01 -0.53 -4.93 116.67 119.91 3ktm s ASP 53 Ca 0.44 -1.06 0.04 0.00 0.71 0.00 0.00 52.55 52.68 3ktm s ASP 53 Cb -0.21 -0.48 -0.01 0.00 1.01 0.00 0.00 42.92 43.23 3ktm s ASP 53 CO 0.25 -0.24 0.52 -0.55 0.21 0.00 0.00 175.17 175.36 3ktm s SER 54 N -3.69 5.96 -0.37 0.27 0.15 -1.26 -1.57 113.70 113.18 3ktm s SER 54 Ca 0.34 -0.00 -0.43 0.00 0.70 0.00 0.00 55.95 56.56 3ktm s SER 54 Cb 0.01 -1.40 -0.18 0.00 -1.71 0.00 0.00 66.02 62.75 3ktm s SER 54 CO 0.19 -0.48 1.66 -0.67 1.20 0.00 0.00 173.24 175.13 3ktm n ASP 55 N -1.76 1.76 -0.34 5.45 2.03 0.03 -4.82 116.55 118.90 3ktm n ASP 55 Ca -0.01 1.13 0.21 0.00 0.52 0.00 0.00 54.79 56.65 3ktm n ASP 55 Cb 0.58 -1.01 0.44 0.00 -0.72 0.00 0.00 41.12 40.41 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 6.03 0.42 0.00 -0.67 0.11 -1.94 0.30 132.00 136.25 3ktm h PRO 56 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3ktm h PRO 56 Cb 1.35 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3ktm h PRO 56 CO 0.96 0.28 -0.63 -1.13 -0.21 0.00 0.00 178.00 177.27 3ktm n SER 57 N -4.94 0.59 -1.10 -2.05 3.41 -1.26 -4.95 113.62 103.33 3ktm n SER 57 Ca 0.29 -0.10 -0.10 0.00 -0.26 0.00 0.00 58.87 58.70 3ktm n SER 57 Cb 0.89 0.30 -0.01 0.00 -0.26 0.00 0.00 64.21 65.12 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 1.42 0.24 0.00 5.00 0.00 0.09 -4.89 105.19 107.05 3ktm n GLY 58 Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 -3.69 0.00 -2.54 2.61 -2.24 -1.26 -4.62 114.28 102.54 3ktm n THR 59 Ca -0.12 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 3ktm n THR 59 Cb 0.53 -0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 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 -1.05 4.37 0.51 -0.78 -0.14 -1.26 -4.99 119.74 116.40 3ktm s LYS 60 Ca 0.00 1.57 0.05 0.00 -1.36 0.00 0.00 55.97 56.23 3ktm s LYS 60 Cb 0.00 -3.56 0.05 0.00 -1.68 0.00 0.00 37.83 32.64 3ktm s LYS 60 CO 0.00 -0.41 0.41 2.41 -0.76 0.00 0.00 175.35 177.00 3ktm n THR 61 N 4.62 0.00 -1.55 2.17 -1.04 -1.26 -1.83 114.28 115.40 3ktm n THR 61 Ca 0.10 -1.97 -0.46 0.00 -2.04 0.00 0.00 64.05 59.68 3ktm n THR 61 Cb 0.47 -0.12 -0.03 0.00 -1.82 0.00 0.00 70.33 68.84 3ktm n THR 61 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3ktm s ILE 63 N -0.81 4.78 -0.93 0.00 -1.09 -1.26 -5.00 121.20 116.89 3ktm s ILE 63 Ca 0.64 -0.35 0.09 0.00 -2.23 0.00 0.00 60.65 58.79 3ktm s ILE 63 Cb -0.79 -3.17 0.18 0.00 -1.58 0.00 0.00 42.46 37.10 3ktm s ILE 63 CO 0.57 0.38 1.05 -0.90 -1.23 0.00 0.00 174.94 174.81 3ktm n ASP 64 N 1.27 2.39 -4.20 3.58 5.75 -1.26 -4.94 116.55 119.13 3ktm n ASP 64 Ca -0.14 -1.76 -0.25 0.00 -0.01 0.00 0.00 54.79 52.63 3ktm n ASP 64 Cb 0.53 -0.12 -0.15 0.00 -1.03 0.00 0.00 41.12 40.35 3ktm n ASP 64 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3ktm s THR 65 N -0.91 1.50 0.33 2.12 -4.23 -1.26 -5.03 115.64 108.16 3ktm s THR 65 Ca 0.16 -0.97 0.01 0.00 -1.18 0.00 0.00 61.69 59.71 3ktm s THR 65 Cb 0.09 -1.28 0.27 0.00 1.34 0.00 0.00 72.50 72.92 3ktm s THR 65 CO 0.13 0.29 1.98 0.11 -0.54 0.00 0.00 174.62 176.58 3ktm h LYS 66 N 5.28 0.92 -0.39 3.99 6.56 -1.94 1.00 116.57 131.98 3ktm h LYS 66 Ca -0.40 -0.06 -0.08 0.00 -1.06 0.00 0.00 60.65 59.06 3ktm h LYS 66 Cb 1.16 -0.21 -0.02 0.00 -0.57 0.00 0.00 32.23 32.59 3ktm h LYS 66 CO 0.46 0.61 -0.10 0.93 -2.06 0.00 0.00 179.45 179.29 3ktm h GLU 67 N 0.95 0.68 -0.41 3.15 5.08 -1.96 -0.42 114.58 121.65 3ktm h GLU 67 Ca 0.28 -0.21 -0.14 0.00 -1.00 0.00 0.00 59.36 58.29 3ktm h GLU 67 Cb -0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 3ktm h GLU 67 CO -0.07 0.77 -0.28 0.78 -1.00 0.00 0.00 179.01 179.21 3ktm h GLY 68 N 0.97 1.00 0.93 -3.84 0.00 -1.58 -1.76 103.07 98.79 3ktm h GLY 68 Ca 0.11 -0.95 -0.04 0.00 0.00 0.00 0.00 47.33 46.45 3ktm h GLY 68 CO 0.03 0.86 0.07 -2.22 0.00 0.00 0.00 176.54 175.28 3ktm h ILE 69 N 0.74 1.24 -0.72 2.60 2.04 -0.54 -0.96 117.51 121.91 3ktm h ILE 69 Ca 0.08 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.14 3ktm h ILE 69 Cb 0.86 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.95 3ktm h ILE 69 CO 0.08 0.28 0.48 0.25 0.00 0.00 0.00 178.15 179.24 3ktm h LEU 70 N 0.47 0.78 -0.11 1.44 5.85 -1.01 -0.11 115.31 122.61 3ktm h LEU 70 Ca 0.12 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 3ktm h LEU 70 Cb 0.35 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 3ktm h LEU 70 CO 0.01 0.54 0.03 -0.61 -0.34 0.00 0.00 178.44 178.07 3ktm h GLN 71 N 0.91 0.17 -0.66 1.25 4.15 -0.85 -1.35 115.11 118.73 3ktm h GLN 71 Ca 0.28 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.70 3ktm h GLN 71 Cb 0.01 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.63 3ktm h GLN 71 CO -0.07 0.33 0.40 -0.92 -1.93 0.00 0.00 178.83 176.64 3ktm h TYR 72 N -0.03 0.75 -0.11 3.99 3.20 -0.60 0.15 116.97 124.32 3ktm h TYR 72 Ca 0.03 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.97 3ktm h TYR 72 Cb 0.24 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.22 3ktm h TYR 72 CO 0.00 0.42 -0.22 0.00 -1.64 0.00 0.00 178.16 176.72 3ktm h GLN 74 N -0.29 0.66 -0.18 0.00 4.20 -0.41 -1.75 115.11 117.34 3ktm h GLN 74 Ca 0.09 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.65 3ktm h GLN 74 Cb 0.42 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 3ktm h GLN 74 CO -0.27 0.53 -0.14 1.49 -0.67 0.00 0.00 178.83 179.77 3ktm h GLU 75 N 0.66 0.42 0.00 1.46 4.81 0.11 -3.13 114.58 118.90 3ktm h GLU 75 Ca 0.16 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3ktm h GLU 75 Cb 0.11 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 3ktm h GLU 75 CO -0.02 0.76 -0.02 -0.39 -0.73 0.00 0.00 179.01 178.61 3ktm h VAL 76 N 0.08 0.04 -2.23 0.32 -1.51 -0.81 -3.32 116.25 108.83 3ktm h VAL 76 Ca 0.03 -0.69 -0.58 0.00 -1.23 0.00 0.00 66.70 64.24 3ktm h VAL 76 Cb 0.66 1.66 -0.42 0.00 -2.13 0.00 0.00 31.29 31.06 3ktm h VAL 76 CO 0.04 0.02 -0.71 -1.22 -1.23 0.00 0.00 177.57 174.47 3ktm n TYR 77 N -3.11 3.42 -0.01 5.19 4.01 -0.68 -4.93 117.16 121.05 3ktm n TYR 77 Ca 0.01 -4.00 0.21 0.00 -0.16 0.00 0.00 57.90 53.97 3ktm n TYR 77 Cb 0.37 -0.49 0.70 0.00 -0.31 0.00 0.00 39.34 39.61 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 3.25 0.00 -0.00 -0.72 0.13 -1.65 -1.00 132.00 132.01 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 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.73 3ktm h PRO 78 CO 0.78 0.00 -0.01 0.39 -0.23 0.00 0.00 178.00 178.92 3ktm n GLU 79 N -4.32 0.68 -4.32 0.86 4.71 -1.26 -4.83 120.64 112.16 3ktm n GLU 79 Ca 0.11 -0.05 -0.28 0.00 -0.01 0.00 0.00 57.16 56.93 3ktm n GLU 79 Cb 0.65 -1.50 -0.10 0.00 -1.01 0.00 0.00 31.44 29.47 3ktm n GLU 79 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3ktm s LEU 80 N -2.36 2.77 -1.20 -4.62 1.43 -0.38 -5.05 118.68 109.27 3ktm s LEU 80 Ca 0.35 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.71 3ktm s LEU 80 Cb 0.21 -1.52 0.21 0.00 0.03 0.00 0.00 46.19 45.12 3ktm s LEU 80 CO 0.43 0.13 1.49 1.67 0.23 0.00 0.00 176.35 180.30 3ktm n GLN 81 N 0.34 3.58 -2.21 1.70 7.27 -1.26 -4.97 117.38 121.83 3ktm n GLN 81 Ca -0.13 -3.96 -0.42 0.00 0.07 0.00 0.00 57.00 52.56 3ktm n GLN 81 Cb 0.55 -2.87 -0.03 0.00 2.41 0.00 0.00 30.24 30.30 3ktm n GLN 81 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 3ktm s ILE 82 N 0.29 3.78 -0.44 1.69 1.09 -1.26 -1.04 121.20 125.31 3ktm s ILE 82 Ca 0.39 1.09 0.07 0.00 -1.10 0.00 0.00 60.65 61.09 3ktm s ILE 82 Cb -0.00 -3.70 -0.04 0.00 -1.06 0.00 0.00 42.46 37.66 3ktm s ILE 82 CO -0.00 -0.04 0.37 0.35 -0.10 0.00 0.00 174.94 175.52 3ktm n THR 83 N 4.96 0.00 -3.89 2.92 -2.24 -0.22 -4.91 114.28 110.89 3ktm n THR 83 Ca 0.14 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 3ktm n THR 83 Cb 0.44 1.03 0.01 0.00 -2.10 0.00 0.00 70.33 69.71 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 -1.37 -0.01 0.06 3.42 3.84 -1.20 -5.02 114.94 114.66 3ktm s ASN 84 Ca 0.04 -0.35 -0.05 0.00 0.21 0.00 0.00 52.86 52.72 3ktm s ASN 84 Cb 0.05 0.27 -0.02 0.00 -0.55 0.00 0.00 41.25 41.00 3ktm s ASN 84 CO 0.22 -0.53 0.07 0.68 -2.79 0.00 0.00 177.10 174.75 3ktm s VAL 85 N -2.17 0.17 -0.18 -5.21 -7.23 -1.26 -1.36 120.40 103.15 3ktm s VAL 85 Ca 0.24 -1.39 -0.21 0.00 -1.81 0.00 0.00 61.98 58.81 3ktm s VAL 85 Cb -0.00 -1.26 0.05 0.00 0.56 0.00 0.00 36.38 35.73 3ktm s VAL 85 CO 0.01 -0.77 0.57 0.54 -0.31 0.00 0.00 175.10 175.14 3ktm s VAL 86 N -3.47 0.00 0.60 1.32 0.11 -1.00 -3.39 120.40 114.57 3ktm s VAL 86 Ca 0.02 -0.03 -0.18 0.00 -2.93 0.00 0.00 61.98 58.86 3ktm s VAL 86 Cb 0.04 -0.81 -0.03 0.00 -1.53 0.00 0.00 36.38 34.05 3ktm s VAL 86 CO -0.09 -0.02 1.14 -1.61 -3.33 0.00 0.00 175.10 171.20 3ktm s GLU 87 N 0.03 3.04 0.51 1.54 8.01 -1.26 -0.21 118.70 130.36 3ktm s GLU 87 Ca -0.02 1.60 -0.18 0.00 0.01 0.00 0.00 54.97 56.37 3ktm s GLU 87 Cb -0.04 -1.96 -0.08 0.00 -4.31 0.00 0.00 34.13 27.74 3ktm s GLU 87 CO 0.02 -1.10 1.01 0.00 0.01 0.00 0.00 175.26 175.20 3ktm s ALA 88 N -1.92 2.94 -0.15 5.21 0.00 -0.61 -4.75 121.76 122.48 3ktm s ALA 88 Ca 0.72 0.37 0.29 0.00 0.00 0.00 0.00 51.96 53.34 3ktm s ALA 88 Cb -0.24 -3.18 0.91 0.00 0.00 0.00 0.00 23.12 20.61 3ktm s ALA 88 CO 0.33 -0.31 1.82 -0.91 0.00 0.00 0.00 175.76 176.69 3ktm h ASN 89 N 1.16 0.00 -4.11 0.00 2.35 -1.94 -3.45 115.58 109.58 3ktm h ASN 89 Ca -0.48 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.03 3ktm h ASN 89 Cb 1.20 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.31 3ktm h ASN 89 CO 0.60 0.00 -0.72 0.00 -1.65 0.00 0.00 177.43 175.65 3ktm s GLN 90 N -3.46 0.20 0.65 0.81 -2.07 -1.26 -4.98 119.66 109.54 3ktm s GLN 90 Ca 0.04 -0.23 -0.16 0.00 -1.82 0.00 0.00 55.36 53.19 3ktm s GLN 90 Cb 0.07 -0.09 -0.01 0.00 -1.09 0.00 0.00 33.01 31.90 3ktm s GLN 90 CO 0.60 0.02 1.13 -1.25 -1.32 0.00 0.00 175.29 174.47 3ktm s PRO 91 N -0.46 2.81 0.15 9.60 0.04 -1.26 -4.66 135.00 141.21 3ktm s PRO 91 Ca -0.04 1.50 0.06 0.00 0.04 0.00 0.00 61.00 62.56 3ktm s PRO 91 Cb -0.03 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 3ktm s PRO 91 CO -0.00 -1.26 -0.14 0.54 0.04 0.00 0.00 177.00 176.17 3ktm s VAL 92 N -2.16 1.45 -0.24 -0.36 0.11 0.28 -4.89 120.40 114.59 3ktm s VAL 92 Ca 0.69 -1.88 -0.10 0.00 -2.93 0.00 0.00 61.98 57.76 3ktm s VAL 92 Cb -0.23 -1.71 -0.05 0.00 -1.53 0.00 0.00 36.38 32.86 3ktm s VAL 92 CO 0.39 -0.48 0.16 0.28 -3.33 0.00 0.00 175.10 172.12 3ktm s THR 93 N -2.45 5.33 -0.04 5.04 -1.32 -1.26 -0.27 115.64 120.68 3ktm s THR 93 Ca 0.13 0.17 0.06 0.00 -1.21 0.00 0.00 61.69 60.84 3ktm s THR 93 Cb -0.03 -3.48 -0.01 0.00 -1.51 0.00 0.00 72.50 67.46 3ktm s THR 93 CO 0.04 0.35 -0.21 -0.63 -2.21 0.00 0.00 174.62 171.96 3ktm s ILE 94 N 1.05 1.68 0.30 5.08 1.01 0.11 -4.94 121.20 125.49 3ktm s ILE 94 Ca 0.07 -0.88 0.10 0.00 0.00 0.00 0.00 60.65 59.95 3ktm s ILE 94 Cb -0.13 -1.42 -0.06 0.00 0.01 0.00 0.00 42.46 40.86 3ktm s ILE 94 CO 0.04 0.48 -0.14 -1.10 0.00 0.00 0.00 174.94 174.22 3ktm s GLN 95 N -0.23 1.71 -0.57 2.79 -0.21 -1.26 -0.48 119.66 121.41 3ktm s GLN 95 Ca 0.01 -1.83 -0.02 0.00 0.02 0.00 0.00 55.36 53.53 3ktm s GLN 95 Cb -0.11 -1.66 0.00 0.00 1.00 0.00 0.00 33.01 32.25 3ktm s GLN 95 CO 0.01 0.22 0.49 0.09 -2.12 0.00 0.00 175.29 173.98 3ktm n ASN 96 N -0.68 -3.13 -4.73 5.90 3.02 -1.23 -4.92 115.26 109.49 3ktm n ASN 96 Ca -0.05 -0.25 -0.41 0.00 -0.03 0.00 0.00 54.58 53.83 3ktm n ASN 96 Cb 0.62 -2.53 -0.04 0.00 -0.61 0.00 0.00 39.78 37.22 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 3.55 0.35 3.10 0.52 -1.25 -4.83 118.94 117.24 3ktm s TRP 97 Ca 0.15 1.53 0.01 0.00 0.02 0.00 0.00 56.10 57.81 3ktm s TRP 97 Cb -0.07 -3.31 -0.03 0.00 -1.15 0.00 0.00 33.47 28.92 3ktm s TRP 97 CO 0.32 -0.76 0.55 0.00 0.02 0.00 0.00 176.95 177.09 3ktm s LYS 99 N -4.32 2.57 0.11 0.00 2.20 -1.26 -0.69 119.74 118.36 3ktm s LYS 99 Ca 0.40 -0.79 -0.34 0.00 -0.36 0.00 0.00 55.97 54.89 3ktm s LYS 99 Cb -0.10 -2.30 -0.13 0.00 -1.51 0.00 0.00 37.83 33.79 3ktm s LYS 99 CO 0.36 0.49 1.67 -2.13 -0.36 0.00 0.00 175.35 175.38 3ktm n ARG 100 N 2.67 2.25 0.00 4.03 0.63 -1.26 -1.91 116.66 123.07 3ktm n ARG 100 Ca -0.17 0.82 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 3ktm n ARG 100 Cb 0.52 -2.62 0.00 0.00 0.45 0.00 0.00 32.46 30.81 3ktm n ARG 100 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3ktm n GLY 101 N 3.71 2.61 3.76 5.14 0.00 -1.26 -5.02 105.19 114.13 3ktm n GLY 101 Ca 0.18 -0.61 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 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 4.44 0.06 1.61 3.52 -0.80 -4.97 118.95 122.81 3ktm s ARG 102 Ca 0.00 2.08 0.11 0.00 -0.13 0.00 0.00 55.73 57.79 3ktm s ARG 102 Cb 0.00 -3.12 -0.19 0.00 -1.56 0.00 0.00 34.95 30.08 3ktm s ARG 102 CO 0.00 -0.08 1.01 0.87 -0.81 0.00 0.00 175.30 176.28 3ktm h LYS 103 N 3.74 0.00 -5.43 5.12 1.57 -1.95 -3.41 116.57 116.20 3ktm h LYS 103 Ca -0.48 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 57.70 3ktm h LYS 103 Cb 1.22 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.42 3ktm h LYS 103 CO 0.67 0.69 -0.23 1.14 -0.57 0.00 0.00 179.45 181.15 3ktm s GLN 104 N -2.70 4.19 -0.89 3.15 -2.07 -1.26 -5.01 119.66 115.07 3ktm s GLN 104 Ca -0.01 0.17 -0.11 0.00 -1.82 0.00 0.00 55.36 53.58 3ktm s GLN 104 Cb 0.09 -3.51 0.23 0.00 -1.09 0.00 0.00 33.01 28.72 3ktm s GLN 104 CO 0.82 0.02 0.83 0.00 -1.32 0.00 0.00 175.29 175.63 3ktm n LYS 106 N 3.53 2.62 -1.73 0.00 2.85 -1.26 -4.64 118.16 119.53 3ktm n LYS 106 Ca 0.16 0.94 -0.34 0.00 -1.05 0.00 0.00 58.31 58.02 3ktm n LYS 106 Cb 0.44 -2.75 -0.06 0.00 -0.65 0.00 0.00 35.03 32.01 3ktm n LYS 106 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 3ktm n THR 107 N 3.27 1.90 -3.85 0.58 -1.04 -1.26 -3.51 114.28 110.36 3ktm n THR 107 Ca 0.14 -1.87 -0.30 0.00 -2.04 0.00 0.00 64.05 59.98 3ktm n THR 107 Cb 0.34 -2.22 -0.11 0.00 -1.82 0.00 0.00 70.33 66.52 3ktm n THR 107 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 3ktm s HIS 108 N 8.76 3.62 0.11 -1.42 5.04 -1.26 -4.74 115.29 125.39 3ktm s HIS 108 Ca 0.64 -3.27 -0.26 0.00 -1.54 0.00 0.00 55.06 50.63 3ktm s HIS 108 Cb 0.05 -2.83 -0.15 0.00 0.04 0.00 0.00 32.58 29.70 3ktm s HIS 108 CO 0.13 -0.60 0.57 -2.30 -2.34 0.00 0.00 174.74 170.21 3ktm n PRO 109 N 2.11 0.00 -4.02 2.88 -0.02 -1.26 -4.68 135.00 130.02 3ktm n PRO 109 Ca 0.19 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.54 3ktm n PRO 109 Cb 0.35 -0.95 -0.14 0.00 -0.02 0.00 0.00 33.50 32.75 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 0.28 -0.33 6.00 3.76 0.37 -4.96 115.29 119.87 3ktm s HIS 110 Ca 0.59 -0.13 -0.12 0.00 -0.15 0.00 0.00 55.06 55.26 3ktm s HIS 110 Cb -0.85 -0.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.65 3ktm s HIS 110 CO 0.46 -0.03 0.21 0.12 -0.85 0.00 0.00 174.74 174.65 3ktm s PHE 111 N -0.30 3.21 0.04 1.40 5.99 -1.26 0.05 117.98 127.12 3ktm s PHE 111 Ca -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 56.93 56.58 3ktm s PHE 111 Cb -0.03 -2.43 -0.03 0.00 0.00 0.00 0.00 43.02 40.53 3ktm s PHE 111 CO -0.00 -0.39 -0.04 0.14 -0.00 0.00 0.00 175.22 174.93 3ktm s VAL 112 N 1.69 0.24 -0.48 3.12 -7.23 0.62 -4.88 120.40 113.48 3ktm s VAL 112 Ca 0.06 -1.46 -0.19 0.00 -1.81 0.00 0.00 61.98 58.57 3ktm s VAL 112 Cb -0.17 -1.03 0.04 0.00 0.56 0.00 0.00 36.38 35.78 3ktm s VAL 112 CO 0.09 -0.78 0.60 -0.63 -0.31 0.00 0.00 175.10 174.08 3ktm s ILE 113 N -2.87 4.89 1.12 -0.62 1.01 -1.26 -0.56 121.20 122.90 3ktm s ILE 113 Ca -0.02 -0.30 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 3ktm s ILE 113 Cb 0.00 -4.24 0.25 0.00 0.01 0.00 0.00 42.46 38.49 3ktm s ILE 113 CO -0.06 -0.70 1.06 -2.84 0.00 0.00 0.00 174.94 172.40 3ktm s PRO 114 N 2.62 -0.52 -0.15 2.79 0.02 -1.26 -4.78 135.00 133.72 3ktm s PRO 114 Ca 0.17 0.56 0.00 0.00 0.02 0.00 0.00 61.00 61.75 3ktm s PRO 114 Cb -0.17 -1.62 -0.01 0.00 0.02 0.00 0.00 34.50 32.72 3ktm s PRO 114 CO 0.14 -3.38 -0.14 0.71 -0.33 0.00 0.00 177.00 173.99 3ktm s TYR 115 N -2.72 2.79 -0.10 6.54 1.51 0.90 -1.57 117.35 124.69 3ktm s TYR 115 Ca 0.67 -0.94 -0.26 0.00 -1.01 0.00 0.00 57.07 55.53 3ktm s TYR 115 Cb -0.21 -1.88 -0.02 0.00 -0.11 0.00 0.00 41.96 39.74 3ktm s TYR 115 CO 0.61 -0.41 0.84 1.03 -1.11 0.00 0.00 175.55 176.50 3ktm s ARG 116 N 0.72 4.40 -0.91 -0.62 0.52 0.71 -0.95 118.95 122.82 3ktm s ARG 116 Ca -0.06 1.09 -0.22 0.00 -0.52 0.00 0.00 55.73 56.02 3ktm s ARG 116 Cb -0.15 -3.51 0.08 0.00 0.52 0.00 0.00 34.95 31.88 3ktm s ARG 116 CO 0.01 -0.16 1.25 0.00 0.02 0.00 0.00 175.30 176.42 3ktm s LEU 118 N 4.10 4.35 -0.02 0.00 1.43 -0.47 -4.69 118.68 123.38 3ktm s LEU 118 Ca 0.37 2.91 0.02 0.00 -1.03 0.00 0.00 54.13 56.41 3ktm s LEU 118 Cb -0.05 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.52 3ktm s LEU 118 CO -0.05 -0.93 -0.07 -0.69 0.23 0.00 0.00 176.35 174.85 3ktm s VAL 119 N 0.40 3.69 0.00 -1.59 1.01 -1.26 -1.06 120.40 121.58 3ktm s VAL 119 Ca 0.67 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.99 3ktm s VAL 119 Cb -0.48 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3ktm s VAL 119 CO 0.42 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.61 3ktm n GLY 120 N 1.80 1.29 3.71 4.51 0.00 -0.20 -4.60 105.19 111.69 3ktm n GLY 120 Ca -0.16 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 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 4.24 0.32 1.61 2.12 -1.26 -4.69 118.70 121.04 3ktm s GLU 121 Ca 0.00 2.26 -0.29 0.00 0.36 0.00 0.00 54.97 57.30 3ktm s GLU 121 Cb 0.00 -3.32 -0.10 0.00 0.26 0.00 0.00 34.13 30.97 3ktm s GLU 121 CO 0.00 -0.59 1.40 0.12 -0.54 0.00 0.00 175.26 175.65 3ktm s PHE 122 N 1.59 2.91 -0.01 5.30 5.36 -1.26 -5.02 117.98 126.85 3ktm s PHE 122 Ca 0.69 1.21 -0.00 0.00 -0.96 0.00 0.00 56.93 57.87 3ktm s PHE 122 Cb -0.40 -3.82 0.02 0.00 -0.34 0.00 0.00 43.02 38.48 3ktm s PHE 122 CO 0.31 -2.45 0.02 0.08 -1.46 0.00 0.00 175.22 171.73 3ktm s VAL 123 N -0.75 -0.04 0.50 3.12 1.01 -1.26 -5.11 120.40 117.87 3ktm s VAL 123 Ca 0.53 0.14 -0.23 0.00 0.00 0.00 0.00 61.98 62.42 3ktm s VAL 123 Cb -0.42 -0.06 -0.07 0.00 0.00 0.00 0.00 36.38 35.83 3ktm s VAL 123 CO 0.52 0.06 1.37 -0.55 0.00 0.00 0.00 175.10 176.50 3ktm s SER 124 N 0.70 5.61 0.39 3.32 0.15 -1.26 -4.95 113.70 117.66 3ktm s SER 124 Ca -0.06 2.80 -0.27 0.00 0.70 0.00 0.00 55.95 59.12 3ktm s SER 124 Cb -0.08 -2.64 -0.10 0.00 -1.71 0.00 0.00 66.02 61.48 3ktm s SER 124 CO -0.02 -1.34 1.45 -1.81 1.20 0.00 0.00 173.24 172.71 3ktm s ASP 125 N -0.78 6.28 0.14 5.45 1.01 -1.26 -4.97 116.67 122.54 3ktm s ASP 125 Ca 0.66 2.97 -0.28 0.00 0.71 0.00 0.00 52.55 56.61 3ktm s ASP 125 Cb -0.41 -2.66 -0.07 0.00 1.01 0.00 0.00 42.92 40.79 3ktm s ASP 125 CO 0.51 -0.91 0.89 0.00 0.21 0.00 0.00 175.17 175.87 3ktm s ALA 126 N -1.15 3.32 0.02 5.23 0.00 -1.26 -4.95 121.76 122.97 3ktm s ALA 126 Ca 0.54 0.50 0.07 0.00 0.00 0.00 0.00 51.96 53.08 3ktm s ALA 126 Cb -0.45 -3.16 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 3ktm s ALA 126 CO 0.60 0.09 -0.21 -0.51 0.00 0.00 0.00 175.76 175.73 3ktm s LEU 127 N -0.47 2.42 -0.12 0.00 1.43 -1.26 -5.10 118.68 115.59 3ktm s LEU 127 Ca 0.42 -0.45 -0.24 0.00 -1.03 0.00 0.00 54.13 52.83 3ktm s LEU 127 Cb -0.23 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.53 3ktm s LEU 127 CO 0.29 0.28 0.74 -0.76 0.23 0.00 0.00 176.35 177.12 3ktm s LEU 128 N -1.19 4.25 -0.43 1.79 1.43 -1.26 -5.02 118.68 118.25 3ktm s LEU 128 Ca 0.13 1.15 -0.08 0.00 -1.03 0.00 0.00 54.13 54.30 3ktm s LEU 128 Cb -0.10 -3.12 0.10 0.00 0.03 0.00 0.00 46.19 43.10 3ktm s LEU 128 CO 0.03 -0.23 0.27 -0.69 0.23 0.00 0.00 176.35 175.96 3ktm s VAL 129 N 1.40 4.00 0.47 -1.59 1.01 -1.26 -4.92 120.40 119.51 3ktm s VAL 129 Ca 0.37 -1.67 -0.23 0.00 0.00 0.00 0.00 61.98 60.45 3ktm s VAL 129 Cb -0.17 -3.57 -0.07 0.00 0.00 0.00 0.00 36.38 32.57 3ktm s VAL 129 CO 0.16 -0.63 1.17 -2.16 0.00 0.00 0.00 175.10 173.63 3ktm s PRO 130 N 1.34 3.70 0.13 2.72 0.04 -1.26 -4.88 135.00 136.78 3ktm s PRO 130 Ca 0.05 1.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.57 3ktm s PRO 130 Cb -0.24 -2.36 -0.16 0.00 0.04 0.00 0.00 34.50 31.77 3ktm s PRO 130 CO -0.00 -0.60 0.64 -0.25 0.04 0.00 0.00 177.00 176.82 3ktm n ASP 131 N -0.59 -0.79 0.00 6.66 10.43 -1.26 -1.18 116.55 129.82 3ktm n ASP 131 Ca 0.08 1.05 0.00 0.00 2.57 0.00 0.00 54.79 58.49 3ktm n ASP 131 Cb 0.48 -0.86 0.00 0.00 1.84 0.00 0.00 41.12 42.58 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 1.06 0.00 -2.68 -1.24 4.01 -1.26 -4.99 118.16 113.06 3ktm n LYS 132 Ca 0.17 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.74 3ktm n LYS 132 Cb 0.18 -2.54 0.03 0.00 -0.51 0.00 0.00 35.03 32.19 3ktm n LYS 132 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3ktm s LYS 134 N -4.77 1.83 -0.21 0.00 -0.14 0.35 -4.88 119.74 111.92 3ktm s LYS 134 Ca 0.54 -0.90 -0.18 0.00 -1.36 0.00 0.00 55.97 54.07 3ktm s LYS 134 Cb -0.10 -1.82 -0.03 0.00 -1.68 0.00 0.00 37.83 34.19 3ktm s LYS 134 CO 0.40 0.49 0.52 0.12 -0.76 0.00 0.00 175.35 176.12 3ktm s PHE 135 N -0.62 3.36 0.12 3.18 2.19 -1.26 -1.22 117.98 123.73 3ktm s PHE 135 Ca 0.09 0.75 0.03 0.00 0.33 0.00 0.00 56.93 58.14 3ktm s PHE 135 Cb -0.09 -2.68 -0.04 0.00 -1.31 0.00 0.00 43.02 38.90 3ktm s PHE 135 CO -0.00 -0.12 -0.09 -0.51 1.83 0.00 0.00 175.22 176.33 3ktm s LEU 136 N 1.72 2.51 -0.07 6.12 1.43 -0.31 -5.00 118.68 125.08 3ktm s LEU 136 Ca 0.24 -1.00 -0.20 0.00 -1.03 0.00 0.00 54.13 52.14 3ktm s LEU 136 Cb -0.15 -0.22 0.04 0.00 0.03 0.00 0.00 46.19 45.89 3ktm s LEU 136 CO 0.09 -0.39 0.47 -1.38 0.23 0.00 0.00 176.35 175.38 3ktm s HIS 137 N -3.40 -0.42 -0.00 0.29 -3.43 -1.26 -0.11 115.29 106.95 3ktm s HIS 137 Ca 0.14 0.82 0.00 0.00 -0.80 0.00 0.00 55.06 55.22 3ktm s HIS 137 Cb 0.03 0.21 -0.00 0.00 -1.43 0.00 0.00 32.58 31.40 3ktm s HIS 137 CO -0.02 -0.42 -0.01 -1.14 -2.00 0.00 0.00 174.74 171.16 3ktm s GLN 138 N -0.83 0.08 0.17 -0.38 0.74 -0.14 -5.00 119.66 114.30 3ktm s GLN 138 Ca -0.09 -0.04 -0.13 0.00 0.05 0.00 0.00 55.36 55.15 3ktm s GLN 138 Cb -0.03 -0.08 0.01 0.00 1.10 0.00 0.00 33.01 34.01 3ktm s GLN 138 CO 0.05 0.02 0.40 -1.83 -0.55 0.00 0.00 175.29 173.38 3ktm s GLU 139 N -0.03 1.23 -0.21 1.67 1.03 -1.26 -0.67 118.70 120.45 3ktm s GLU 139 Ca 0.00 -0.98 -0.05 0.00 0.03 0.00 0.00 54.97 53.97 3ktm s GLU 139 Cb -0.00 0.45 0.11 0.00 -0.80 0.00 0.00 34.13 33.88 3ktm s GLU 139 CO -0.00 -0.49 0.38 1.03 -1.33 0.00 0.00 175.26 174.85 3ktm s ARG 140 N -3.90 0.31 0.15 -4.83 1.81 -0.70 -5.00 118.95 106.78 3ktm s ARG 140 Ca 0.12 0.76 0.14 0.00 -1.72 0.00 0.00 55.73 55.03 3ktm s ARG 140 Cb 0.01 -0.11 0.67 0.00 -0.45 0.00 0.00 34.95 35.08 3ktm s ARG 140 CO -0.03 -0.44 1.44 -1.33 -0.68 0.00 0.00 175.30 174.26 3ktm n MET 141 N 5.37 0.08 -0.10 3.54 2.81 -1.26 -2.15 117.12 125.41 3ktm n MET 141 Ca -0.06 0.47 0.12 0.00 -1.81 0.00 0.00 57.70 56.42 3ktm n MET 141 Cb 0.50 -1.71 0.26 0.00 -0.71 0.00 0.00 33.22 31.56 3ktm n MET 141 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3ktm n ASP 142 N -1.87 2.74 -4.12 7.83 10.43 -1.26 -4.95 116.55 125.35 3ktm n ASP 142 Ca 0.01 -1.88 -0.17 0.00 2.57 0.00 0.00 54.79 55.31 3ktm n ASP 142 Cb 0.09 -0.13 -0.12 0.00 1.84 0.00 0.00 41.12 42.80 3ktm n ASP 142 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3ktm s VAL 143 N -1.74 0.92 -0.34 2.53 0.11 -0.91 -5.11 120.40 115.86 3ktm s VAL 143 Ca 0.35 -1.08 -0.01 0.00 -2.93 0.00 0.00 61.98 58.30 3ktm s VAL 143 Cb 0.21 -0.89 0.12 0.00 -1.53 0.00 0.00 36.38 34.29 3ktm s VAL 143 CO 0.30 -0.17 0.18 0.00 -3.33 0.00 0.00 175.10 172.08 3ktm n GLU 145 N 4.43 0.94 -2.48 0.00 -0.58 -0.92 -4.81 120.64 117.22 3ktm n GLU 145 Ca 0.05 -2.72 -0.23 0.00 -0.42 0.00 0.00 57.16 53.84 3ktm n GLU 145 Cb 0.39 0.47 0.05 0.00 -0.57 0.00 0.00 31.44 31.78 3ktm n GLU 145 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3ktm s THR 146 N -2.22 2.62 0.17 2.62 -4.23 -1.26 -0.13 115.64 113.21 3ktm s THR 146 Ca 0.14 -0.48 -0.14 0.00 -1.18 0.00 0.00 61.69 60.03 3ktm s THR 146 Cb -0.01 -3.04 0.07 0.00 1.34 0.00 0.00 72.50 70.86 3ktm s THR 146 CO 0.09 -0.03 1.75 -0.74 -0.54 0.00 0.00 174.62 175.15 3ktm h HIS 147 N -0.18 0.28 -0.72 3.99 -0.00 -1.97 -1.69 115.15 114.88 3ktm h HIS 147 Ca -0.43 0.02 0.03 0.00 -0.00 0.00 0.00 60.37 59.99 3ktm h HIS 147 Cb 1.30 -0.06 -0.04 0.00 -0.00 0.00 0.00 27.41 28.61 3ktm h HIS 147 CO 0.36 0.10 0.45 1.25 -0.00 0.00 0.00 177.93 180.10 3ktm h LEU 148 N 0.33 0.75 0.41 0.26 5.85 -1.97 -0.50 115.31 120.44 3ktm h LEU 148 Ca 0.21 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 3ktm h LEU 148 Cb 0.21 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 3ktm h LEU 148 CO -0.22 0.52 -0.39 -0.74 -0.34 0.00 0.00 178.44 177.28 3ktm h HIS 149 N 0.89 -1.05 -0.20 1.25 2.76 -1.71 -1.83 115.15 115.26 3ktm h HIS 149 Ca 0.29 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.44 3ktm h HIS 149 Cb 0.01 0.40 -0.01 0.00 1.55 0.00 0.00 27.41 29.36 3ktm h HIS 149 CO -0.04 -0.54 0.02 -1.49 -1.30 0.00 0.00 177.93 174.58 3ktm h TRP 150 N -0.81 0.28 0.25 5.26 4.06 -1.23 -0.86 115.95 122.89 3ktm h TRP 150 Ca -0.04 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.89 3ktm h TRP 150 Cb 0.72 -0.09 0.00 0.00 -1.00 0.00 0.00 29.16 28.79 3ktm h TRP 150 CO -0.20 0.28 -0.13 1.25 -3.56 0.00 0.00 178.44 176.08 3ktm h HIS 151 N 0.28 -0.33 -0.85 0.49 2.76 -0.78 -1.17 115.15 115.55 3ktm h HIS 151 Ca 0.07 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.28 3ktm h HIS 151 Cb 0.16 0.11 -0.06 0.00 1.55 0.00 0.00 27.41 29.18 3ktm h HIS 151 CO 0.00 -0.20 0.54 1.15 -1.30 0.00 0.00 177.93 178.12 3ktm h THR 152 N -0.34 1.09 0.19 6.26 2.02 -0.74 0.62 112.91 122.00 3ktm h THR 152 Ca -0.03 -0.35 0.01 0.00 0.77 0.00 0.00 66.41 66.81 3ktm h THR 152 Cb 0.27 -0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.63 3ktm h THR 152 CO 0.05 0.19 -0.32 0.58 0.37 0.00 0.00 175.52 176.38 3ktm h VAL 153 N 1.02 0.32 -0.58 3.16 2.07 -0.77 0.15 116.25 121.62 3ktm h VAL 153 Ca 0.36 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.89 3ktm h VAL 153 Cb 0.09 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 3ktm h VAL 153 CO -0.14 0.00 0.38 0.00 0.02 0.00 0.00 177.57 177.82 3ktm h ALA 154 N 0.02 0.74 -0.09 1.67 0.00 -0.79 -0.41 119.26 120.38 3ktm h ALA 154 Ca 0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3ktm h ALA 154 Cb 0.59 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 3ktm h ALA 154 CO -0.15 0.15 0.05 -0.22 0.00 0.00 0.00 179.25 179.09 3ktm h LYS 155 N 0.76 0.13 -0.41 0.00 3.64 -0.52 -1.96 116.57 118.22 3ktm h LYS 155 Ca 0.22 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 3ktm h LYS 155 Cb -0.06 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 3ktm h LYS 155 CO -0.06 0.15 0.09 0.93 -2.27 0.00 0.00 179.45 178.29 3ktm h GLU 156 N 0.08 0.60 -0.69 1.90 4.39 -0.49 0.97 114.58 121.34 3ktm h GLU 156 Ca 0.03 -0.10 -0.07 0.00 0.34 0.00 0.00 59.36 59.56 3ktm h GLU 156 Cb 0.05 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 3ktm h GLU 156 CO -0.01 0.56 0.14 1.15 -1.16 0.00 0.00 179.01 179.69 3ktm h THR 157 N 0.59 1.26 0.04 1.13 2.02 -0.73 0.80 112.91 118.01 3ktm h THR 157 Ca 0.14 -1.01 -0.25 0.00 0.77 0.00 0.00 66.41 66.06 3ktm h THR 157 Cb 0.23 0.59 0.01 0.00 -1.74 0.00 0.00 68.15 67.24 3ktm h THR 157 CO -0.00 0.38 -1.04 0.00 0.37 0.00 0.00 175.52 175.23 3ktm h SER 159 N 0.22 0.28 -0.44 0.00 0.02 -0.59 0.43 113.55 113.47 3ktm h SER 159 Ca -0.11 0.01 0.09 0.00 -0.84 0.00 0.00 61.79 60.94 3ktm h SER 159 Cb 1.70 -0.05 -0.08 0.00 0.14 0.00 0.00 62.40 64.11 3ktm h SER 159 CO 0.18 0.20 -0.09 -0.33 -1.14 0.00 0.00 176.83 175.65 3ktm h GLU 160 N 0.37 0.02 0.00 3.45 5.08 -0.88 0.18 114.58 122.80 3ktm h GLU 160 Ca 0.14 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3ktm h GLU 160 Cb 0.03 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3ktm h GLU 160 CO -0.08 0.01 0.00 1.63 -1.00 0.00 0.00 179.01 179.57 3ktm n LYS 161 N -5.31 0.83 -3.36 2.33 5.02 -0.98 -4.85 118.16 111.83 3ktm n LYS 161 Ca 0.03 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.16 3ktm n LYS 161 Cb 0.24 -1.04 0.08 0.00 -0.02 0.00 0.00 35.03 34.29 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 -0.54 -4.08 -3.34 4.39 7.64 0.63 -5.02 113.62 113.30 3ktm n SER 162 Ca 0.01 -0.67 -0.20 0.00 1.01 0.00 0.00 58.87 59.02 3ktm n SER 162 Cb 0.01 -5.13 -0.08 0.00 -1.01 0.00 0.00 64.21 58.00 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 -3.74 0.00 -4.82 0.44 -2.24 0.10 -4.52 114.28 99.50 3ktm n THR 163 Ca -0.19 -2.44 -0.33 0.00 -2.27 0.00 0.00 64.05 58.82 3ktm n THR 163 Cb 0.65 1.17 -0.13 0.00 -2.10 0.00 0.00 70.33 69.92 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 -3.37 4.16 -0.34 3.42 0.01 0.10 -4.00 114.94 114.92 3ktm s ASN 164 Ca 0.37 -0.17 -0.26 0.00 -0.71 0.00 0.00 52.86 52.09 3ktm s ASN 164 Cb 0.02 -0.91 0.01 0.00 0.41 0.00 0.00 41.25 40.78 3ktm s ASN 164 CO 0.26 0.35 0.94 -0.22 -1.51 0.00 0.00 177.10 176.91 3ktm s LEU 165 N -0.78 4.00 -0.13 0.60 2.96 -1.26 0.17 118.68 124.23 3ktm s LEU 165 Ca 0.12 0.72 0.17 0.00 -0.22 0.00 0.00 54.13 54.92 3ktm s LEU 165 Cb -0.11 -3.30 -0.24 0.00 0.50 0.00 0.00 46.19 43.04 3ktm s LEU 165 CO 0.01 -0.81 0.29 1.57 -1.32 0.00 0.00 176.35 176.08 3ktm n HIS 166 N 6.68 0.29 -3.56 5.38 -0.00 -0.36 -4.98 115.22 118.66 3ktm n HIS 166 Ca 0.08 0.10 -0.09 0.00 -0.00 0.00 0.00 57.72 57.81 3ktm n HIS 166 Cb 0.48 -1.00 -0.04 0.00 -0.00 0.00 0.00 29.99 29.42 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 -5.56 -0.33 0.15 0.26 3.68 -1.25 -4.98 116.67 108.65 3ktm s ASP 167 Ca -0.08 0.24 -0.17 0.00 2.13 0.00 0.00 52.55 54.67 3ktm s ASP 167 Cb 0.07 0.29 0.04 0.00 -1.45 0.00 0.00 42.92 41.87 3ktm s ASP 167 CO 0.83 -0.38 0.46 -0.72 0.13 0.00 0.00 175.17 175.49 3ktm s TYR 168 N -1.72 -0.20 0.07 -5.34 1.13 -1.26 0.01 117.35 110.03 3ktm s TYR 168 Ca 0.02 -0.12 -0.15 0.00 -1.41 0.00 0.00 57.07 55.41 3ktm s TYR 168 Cb -0.01 0.33 0.02 0.00 -1.10 0.00 0.00 41.96 41.20 3ktm s TYR 168 CO -0.02 -0.79 0.34 0.20 -2.51 0.00 0.00 175.55 172.77 3ktm s GLY 169 N -2.83 -0.16 0.53 5.49 0.00 0.16 -4.96 107.32 105.55 3ktm s GLY 169 Ca 0.05 -0.01 -0.16 0.00 0.00 0.00 0.00 44.72 44.59 3ktm s GLY 169 CO -0.09 -0.25 1.00 1.06 0.00 0.00 0.00 173.10 174.83 3ktm s MET 170 N -2.97 3.83 0.09 2.90 -1.94 -1.26 -0.41 119.30 119.54 3ktm s MET 170 Ca -0.02 1.00 0.04 0.00 -1.71 0.00 0.00 55.69 55.00 3ktm s MET 170 Cb 0.00 -2.12 -0.03 0.00 2.01 0.00 0.00 34.83 34.70 3ktm s MET 170 CO -0.06 -0.38 -0.11 -0.51 -0.01 0.00 0.00 175.02 173.95 3ktm s LEU 171 N -4.17 2.37 -0.30 -0.03 1.43 -0.80 -4.54 118.68 112.64 3ktm s LEU 171 Ca 0.60 -0.75 -0.26 0.00 -1.03 0.00 0.00 54.13 52.69 3ktm s LEU 171 Cb -0.11 -0.37 0.04 0.00 0.03 0.00 0.00 46.19 45.78 3ktm s LEU 171 CO 0.33 -0.20 0.44 0.18 0.23 0.00 0.00 176.35 177.32 3ktm n LEU 172 N 0.77 -3.10 -4.77 1.79 7.99 -1.26 -2.59 117.00 115.84 3ktm n LEU 172 Ca -0.17 0.07 -0.39 0.00 -0.01 0.00 0.00 56.01 55.50 3ktm n LEU 172 Cb 0.57 -1.67 -0.03 0.00 -0.11 0.00 0.00 43.42 42.17 3ktm n LEU 172 CO 0.25 -0.59 0.85 -2.16 -1.51 0.00 0.00 177.39 174.23 3ktm s PRO 173 N -1.97 4.29 -0.01 3.23 0.04 -1.26 -0.67 135.00 138.64 3ktm s PRO 173 Ca 0.25 1.88 0.01 0.00 0.04 0.00 0.00 61.00 63.18 3ktm s PRO 173 Cb -0.03 -2.89 0.02 0.00 0.04 0.00 0.00 34.50 31.65 3ktm s PRO 173 CO 0.59 -0.13 0.86 0.00 0.04 0.00 0.00 177.00 178.35 3ktm n GLY 175 N -0.40 -0.30 3.55 0.00 0.00 -1.21 -4.96 105.19 101.87 3ktm n GLY 175 Ca 0.01 -1.08 -0.37 0.00 0.00 0.00 0.00 46.02 44.59 3ktm n GLY 175 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3ktm n ILE 176 N -0.44 -0.07 -3.38 -0.61 0.13 -1.26 -1.97 119.36 111.76 3ktm n ILE 176 Ca 0.00 -0.74 -0.18 0.00 -1.10 0.00 0.00 62.75 60.73 3ktm n ILE 176 Cb 0.00 -2.64 0.08 0.00 -0.84 0.00 0.00 39.64 36.24 3ktm n ILE 176 CO 0.00 0.00 0.00 -0.67 2.80 0.00 0.00 176.55 178.68 3ktm n ASP 177 N 15.47 -3.86 -3.89 9.51 2.03 -1.22 -4.90 116.55 129.68 3ktm n ASP 177 Ca 0.39 -0.52 -0.13 0.00 0.52 0.00 0.00 54.79 55.05 3ktm n ASP 177 Cb 0.51 -4.63 -0.14 0.00 -0.72 0.00 0.00 41.12 36.14 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 -5.67 0.09 0.03 -0.67 -0.14 -0.83 -4.47 119.74 108.08 3ktm s LYS 178 Ca 0.25 -0.06 -0.01 0.00 -1.36 0.00 0.00 55.97 54.79 3ktm s LYS 178 Cb -0.11 -0.07 -0.03 0.00 -1.68 0.00 0.00 37.83 35.94 3ktm s LYS 178 CO 0.66 0.02 -0.03 -0.06 -0.76 0.00 0.00 175.35 175.18 3ktm s PHE 179 N -0.08 0.38 -2.52 3.18 0.40 0.81 -1.42 117.98 118.73 3ktm s PHE 179 Ca -0.00 -0.79 0.27 0.00 -0.60 0.00 0.00 56.93 55.81 3ktm s PHE 179 Cb -0.01 -0.28 0.93 0.00 0.51 0.00 0.00 43.02 44.17 3ktm s PHE 179 CO -0.00 -0.28 1.68 0.54 0.70 0.00 0.00 175.22 177.85 3ktm n ARG 180 N 0.88 1.70 -2.88 0.44 1.74 0.15 -2.16 116.66 116.53 3ktm n ARG 180 Ca -0.19 -1.06 -0.02 0.00 -0.77 0.00 0.00 57.85 55.81 3ktm n ARG 180 Cb 0.58 -1.48 0.01 0.00 -1.02 0.00 0.00 32.46 30.55 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 1.20 0.93 3.25 -0.13 0.00 -1.14 -1.72 105.19 107.59 3ktm n GLY 181 Ca 0.18 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.28 0.01 -0.07 1.61 0.11 0.15 -1.91 120.40 118.01 3ktm s VAL 182 Ca 0.13 -0.06 0.02 0.00 -2.93 0.00 0.00 61.98 59.14 3ktm s VAL 182 Cb -0.02 -0.52 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 3ktm s VAL 182 CO 0.04 -0.03 -0.11 -1.83 -3.33 0.00 0.00 175.10 169.84 3ktm s GLU 183 N -0.00 2.80 0.27 1.54 -1.05 0.45 -0.97 118.70 121.74 3ktm s GLU 183 Ca -0.02 -0.63 -0.10 0.00 -0.15 0.00 0.00 54.97 54.07 3ktm s GLU 183 Cb -0.03 -2.53 -0.00 0.00 -0.44 0.00 0.00 34.13 31.13 3ktm s GLU 183 CO 0.01 0.55 0.47 -0.59 0.95 0.00 0.00 175.26 176.66 3ktm s PHE 184 N -0.53 0.52 -0.08 4.83 -0.71 0.84 0.36 117.98 123.21 3ktm s PHE 184 Ca 0.07 -0.87 0.02 0.00 -1.04 0.00 0.00 56.93 55.12 3ktm s PHE 184 Cb -0.12 0.13 0.01 0.00 -1.21 0.00 0.00 43.02 41.83 3ktm s PHE 184 CO 0.02 -1.03 -0.14 0.08 -1.34 0.00 0.00 175.22 172.81 3ktm s VAL 185 N -3.77 1.33 -0.03 -2.49 1.01 0.10 -1.16 120.40 115.38 3ktm s VAL 185 Ca 0.24 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3ktm s VAL 185 Cb -0.00 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.14 3ktm s VAL 185 CO 0.11 0.40 -0.04 0.00 0.00 0.00 0.00 175.10 175.57 3ktm s PRO 188 N -1.20 2.95 0.54 0.00 0.02 -1.26 0.02 135.00 136.06 3ktm s PRO 188 Ca 0.03 2.01 0.32 0.00 0.02 0.00 0.00 61.00 63.38 3ktm s PRO 188 Cb -0.08 -2.03 1.37 0.00 0.02 0.00 0.00 34.50 33.78 3ktm s PRO 188 CO 0.02 -1.27 1.99 -0.07 -0.33 0.00 0.00 177.00 177.33 3ktm h LEU 189 N 1.03 0.00 -7.00 -5.54 4.07 -1.91 -3.42 115.31 102.53 3ktm h LEU 189 Ca -0.51 0.00 0.05 0.00 0.08 0.00 0.00 57.88 57.51 3ktm h LEU 189 Cb 1.31 0.00 -0.15 0.00 1.08 0.00 0.00 40.66 42.90 3ktm h LEU 189 CO 0.55 0.05 0.38 0.00 -1.08 0.00 0.00 178.44 178.35 3ktm s ALA 190 N -3.74 -1.76 -0.13 1.53 0.00 -1.26 -2.28 121.76 114.12 3ktm s ALA 190 Ca 0.00 0.92 0.01 0.00 0.00 0.00 0.00 51.96 52.89 3ktm s ALA 190 Cb 0.10 0.44 0.02 0.00 0.00 0.00 0.00 23.12 23.68 3ktm s ALA 190 CO 0.55 -0.66 -0.16 0.42 0.00 0.00 0.00 175.76 175.92 3ktm s ILE 191 N -3.00 1.61 -1.52 0.00 1.01 0.17 -4.76 121.20 114.70 3ktm s ILE 191 Ca 0.02 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 59.84 3ktm s ILE 191 Cb -0.01 -1.48 0.11 0.00 0.01 0.00 0.00 42.46 41.09 3ktm s ILE 191 CO -0.08 0.46 0.74 -0.62 0.00 0.00 0.00 174.94 175.44 3ktm n GLU 192 N 4.47 -3.80 0.00 2.79 1.02 -1.26 -1.73 120.64 122.13 3ktm n GLU 192 Ca -0.18 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 3ktm n GLU 192 Cb 0.51 -5.22 0.00 0.00 -0.02 0.00 0.00 31.44 26.70 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 -1.38 3.09 3.70 0.62 0.00 -1.26 -5.04 105.19 104.92 3ktm n GLY 193 Ca 0.04 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 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 4.45 0.51 1.61 1.70 -0.71 -4.98 118.95 121.53 3ktm s ARG 194 Ca 0.00 1.29 -0.22 0.00 -0.47 0.00 0.00 55.73 56.33 3ktm s ARG 194 Cb 0.00 -3.51 -0.07 0.00 -0.57 0.00 0.00 34.95 30.80 3ktm s ARG 194 CO 0.00 -0.18 1.14 1.17 -1.08 0.00 0.00 175.30 176.34 3ktm n LYS 195 N 4.53 1.42 -3.80 3.89 4.81 -1.26 -0.66 118.16 127.08 3ktm n LYS 195 Ca 0.06 0.52 -0.36 0.00 -0.87 0.00 0.00 58.31 57.66 3ktm n LYS 195 Cb 0.50 -2.29 -0.12 0.00 0.02 0.00 0.00 35.03 33.14 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 -1.95 5.03 0.53 3.14 2.96 -0.97 -4.78 118.68 122.64 3ktm s LEU 196 Ca 0.69 -1.91 0.07 0.00 -0.22 0.00 0.00 54.13 52.75 3ktm s LEU 196 Cb -0.47 -1.81 0.04 0.00 0.50 0.00 0.00 46.19 44.45 3ktm s LEU 196 CO 0.52 -0.49 0.47 0.00 -1.32 0.00 0.00 176.35 175.53 3ktm s ALA 197 N 1.15 4.42 0.00 5.97 0.00 -1.26 -4.83 121.76 127.22 3ktm s ALA 197 Ca 0.06 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.48 3ktm s ALA 197 Cb -0.22 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 21.99 3ktm s ALA 197 CO -0.04 -0.49 0.00 0.00 0.00 0.00 0.00 175.76 175.23 3ktm n ALA 198 N -1.82 0.00 -2.48 0.00 0.00 -1.26 -5.16 120.51 109.79 3ktm n ALA 198 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.08 3ktm n ALA 198 Cb 0.63 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.02 3ktm n ALA 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ktm s ALA 199 N -0.29 3.60 0.00 0.00 0.00 -1.26 -5.07 121.76 118.74 3ktm s ALA 199 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 51.85 3ktm s ALA 199 Cb 0.00 -2.55 0.00 0.00 0.00 0.00 0.00 23.12 20.57 3ktm s ALA 199 CO 0.00 0.32 0.00 1.28 0.00 0.00 0.00 175.76 177.36 3ktm n LEU 200 N 2.30 0.00 0.00 0.00 4.77 -1.26 -5.27 117.00 117.53 3ktm n LEU 200 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3ktm n LEU 200 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3ktm n LEU 200 CO 0.40 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.84