#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ktm n GLY 27 N 0.00 5.31 3.75 0.00 0.00 -1.26 -5.00 105.19 107.99 3ktm n GLY 27 Ca 0.00 -2.31 -0.40 0.00 0.00 0.00 0.00 46.02 43.30 3ktm n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ktm s LEU 28 N -3.49 4.57 0.46 0.99 1.43 -1.26 -5.06 118.68 116.33 3ktm s LEU 28 Ca 0.52 2.00 -0.01 0.00 -1.03 0.00 0.00 54.13 55.61 3ktm s LEU 28 Cb 0.36 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.97 3ktm s LEU 28 CO -0.30 -0.00 0.70 -0.76 0.23 0.00 0.00 176.35 176.22 3ktm s LEU 29 N -0.85 3.62 0.24 1.79 1.43 -1.26 -5.03 118.68 118.61 3ktm s LEU 29 Ca 0.44 0.41 -0.22 0.00 -1.03 0.00 0.00 54.13 53.73 3ktm s LEU 29 Cb -0.27 -3.29 -0.09 0.00 0.03 0.00 0.00 46.19 42.57 3ktm s LEU 29 CO 0.34 -0.71 0.79 0.00 0.23 0.00 0.00 176.35 177.00 3ktm s ALA 30 N -2.61 3.36 0.09 4.21 0.00 -0.38 -4.98 121.76 121.46 3ktm s ALA 30 Ca 0.48 0.29 -0.34 0.00 0.00 0.00 0.00 51.96 52.40 3ktm s ALA 30 Cb -0.10 -2.94 -0.13 0.00 0.00 0.00 0.00 23.12 19.95 3ktm s ALA 30 CO 0.39 0.28 1.69 -1.91 0.00 0.00 0.00 175.76 176.22 3ktm n GLU 31 N 0.80 2.26 -2.13 0.00 2.13 -1.26 -4.57 120.64 117.88 3ktm n GLU 31 Ca -0.02 0.82 -0.40 0.00 0.66 0.00 0.00 57.16 58.23 3ktm n GLU 31 Cb 0.50 -2.63 -0.01 0.00 0.27 0.00 0.00 31.44 29.57 3ktm n GLU 31 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 3ktm s PRO 32 N 1.97 4.14 -0.03 5.31 0.04 -1.26 -4.88 135.00 140.29 3ktm s PRO 32 Ca 0.83 2.12 -0.29 0.00 0.04 0.00 0.00 61.00 63.69 3ktm s PRO 32 Cb -0.65 -2.87 0.10 0.00 0.04 0.00 0.00 34.50 31.13 3ktm s PRO 32 CO 0.41 -0.34 0.89 1.14 0.04 0.00 0.00 177.00 179.14 3ktm s GLN 33 N -2.07 0.81 0.07 4.56 -2.07 -1.26 -1.68 119.66 118.01 3ktm s GLN 33 Ca 0.54 -0.19 0.08 0.00 -1.82 0.00 0.00 55.36 53.98 3ktm s GLN 33 Cb -0.37 0.37 -0.03 0.00 -1.09 0.00 0.00 33.01 31.89 3ktm s GLN 33 CO 0.48 -0.33 -0.23 0.96 -1.32 0.00 0.00 175.29 174.85 3ktm s ILE 34 N -2.63 1.87 -0.03 3.63 -5.25 -0.36 -0.23 121.20 118.20 3ktm s ILE 34 Ca 0.03 -1.38 0.04 0.00 -0.99 0.00 0.00 60.65 58.34 3ktm s ILE 34 Cb -0.01 -1.63 -0.00 0.00 2.95 0.00 0.00 42.46 43.77 3ktm s ILE 34 CO -0.06 0.18 -0.13 0.00 -1.79 0.00 0.00 174.94 173.14 3ktm s ALA 35 N -0.90 1.18 0.19 2.27 0.00 0.87 -0.26 121.76 125.11 3ktm s ALA 35 Ca 0.09 -0.52 0.11 0.00 0.00 0.00 0.00 51.96 51.63 3ktm s ALA 35 Cb -0.09 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 3ktm s ALA 35 CO 0.03 0.22 -0.22 -1.64 0.00 0.00 0.00 175.76 174.15 3ktm s MET 36 N 0.02 1.47 -0.41 0.00 -1.94 -1.26 -0.39 119.30 116.80 3ktm s MET 36 Ca -0.02 -1.52 0.07 0.00 -1.71 0.00 0.00 55.69 52.52 3ktm s MET 36 Cb -0.09 -1.71 0.17 0.00 2.01 0.00 0.00 34.83 35.21 3ktm s MET 36 CO 0.01 0.36 0.57 0.12 -0.01 0.00 0.00 175.02 176.07 3ktm s PHE 37 N -1.83 -1.38 0.06 -0.03 5.36 -1.26 -4.88 117.98 114.02 3ktm s PHE 37 Ca 0.20 -0.05 -0.31 0.00 -0.96 0.00 0.00 56.93 55.82 3ktm s PHE 37 Cb -0.07 0.14 -0.16 0.00 -0.34 0.00 0.00 43.02 42.59 3ktm s PHE 37 CO 0.09 -1.13 0.76 0.00 -1.46 0.00 0.00 175.22 173.48 3ktm n GLY 39 N 1.46 0.60 3.30 0.00 0.00 -1.26 -5.03 105.19 104.25 3ktm n GLY 39 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.94 1.20 0.28 1.61 1.81 -0.70 -4.84 118.95 117.37 3ktm s ARG 40 Ca 0.00 -1.42 -0.28 0.00 -1.72 0.00 0.00 55.73 52.31 3ktm s ARG 40 Cb 0.00 0.33 -0.09 0.00 -0.45 0.00 0.00 34.95 34.73 3ktm s ARG 40 CO 0.00 -0.42 0.94 -0.51 -0.68 0.00 0.00 175.30 174.63 3ktm s LEU 41 N -3.07 4.51 0.78 2.53 1.43 0.51 -4.01 118.68 121.37 3ktm s LEU 41 Ca 0.28 1.89 -0.15 0.00 -1.03 0.00 0.00 54.13 55.13 3ktm s LEU 41 Cb 0.05 -3.79 0.02 0.00 0.03 0.00 0.00 46.19 42.50 3ktm s LEU 41 CO 0.07 0.06 0.84 0.59 0.23 0.00 0.00 176.35 178.14 3ktm n ASN 42 N 1.07 -0.17 -4.40 2.29 3.02 -0.88 -4.62 115.26 111.57 3ktm n ASN 42 Ca -0.00 0.57 -0.28 0.00 -0.03 0.00 0.00 54.58 54.84 3ktm n ASN 42 Cb 0.48 -1.36 -0.12 0.00 -0.61 0.00 0.00 39.78 38.17 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 -3.46 1.44 0.02 3.52 -1.94 0.48 -1.69 119.30 117.67 3ktm s MET 43 Ca 0.69 -1.42 -0.03 0.00 -1.71 0.00 0.00 55.69 53.22 3ktm s MET 43 Cb -0.31 -1.86 -0.01 0.00 2.01 0.00 0.00 34.83 34.65 3ktm s MET 43 CO 0.55 0.42 0.04 -3.38 -0.01 0.00 0.00 175.02 172.64 3ktm s HIS 44 N -1.33 0.21 -0.04 -0.03 -3.43 -0.24 -0.09 115.29 110.34 3ktm s HIS 44 Ca 0.17 -0.47 -0.30 0.00 -0.80 0.00 0.00 55.06 53.66 3ktm s HIS 44 Cb -0.09 -0.16 -0.03 0.00 -1.43 0.00 0.00 32.58 30.87 3ktm s HIS 44 CO 0.08 -0.27 1.09 1.41 -2.00 0.00 0.00 174.74 175.05 3ktm s MET 45 N -1.88 4.43 -0.61 -0.38 1.75 0.68 -0.92 119.30 122.37 3ktm s MET 45 Ca -0.12 1.54 -0.28 0.00 -1.25 0.00 0.00 55.69 55.59 3ktm s MET 45 Cb -0.06 -3.50 0.02 0.00 2.84 0.00 0.00 34.83 34.13 3ktm s MET 45 CO -0.02 -0.30 1.33 1.21 -0.65 0.00 0.00 175.02 176.59 3ktm s ASN 46 N 1.20 6.21 0.18 1.11 3.84 -0.43 -4.59 114.94 122.46 3ktm s ASN 46 Ca 0.53 0.06 0.13 0.00 0.21 0.00 0.00 52.86 53.79 3ktm s ASN 46 Cb -0.23 -2.55 0.70 0.00 -0.55 0.00 0.00 41.25 38.62 3ktm s ASN 46 CO 0.23 -1.69 1.40 1.33 -2.79 0.00 0.00 177.10 175.58 3ktm n VAL 47 N 6.70 1.40 -0.01 -5.21 0.24 -1.26 -1.32 118.33 118.86 3ktm n VAL 47 Ca 0.09 0.61 -0.11 0.00 -2.04 0.00 0.00 64.34 62.89 3ktm n VAL 47 Cb 0.49 -1.60 -0.14 0.00 -1.47 0.00 0.00 33.84 31.12 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 0.05 -0.00 7.34 7.50 -1.89 -1.00 115.11 127.11 3ktm h GLN 48 Ca 0.00 -0.09 0.00 0.00 0.50 0.00 0.00 58.65 59.06 3ktm h GLN 48 Cb 0.02 0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.59 3ktm h GLN 48 CO 0.00 0.65 -0.02 0.27 -1.50 0.00 0.00 178.83 178.23 3ktm n ASN 49 N -3.14 0.84 0.00 1.46 0.23 -1.11 -4.93 115.26 108.61 3ktm n ASN 49 Ca -0.18 -0.92 0.00 0.00 -0.53 0.00 0.00 54.58 52.94 3ktm n ASN 49 Cb 1.05 0.27 0.00 0.00 -2.08 0.00 0.00 39.78 39.02 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 0.35 0.57 3.86 4.83 0.00 -0.44 -5.02 105.19 109.34 3ktm n GLY 50 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.41 3.15 0.33 1.61 1.02 -1.25 -4.83 119.74 119.36 3ktm s LYS 51 Ca 0.00 -0.71 -0.26 0.00 0.02 0.00 0.00 55.97 55.02 3ktm s LYS 51 Cb 0.00 -2.81 -0.09 0.00 -0.52 0.00 0.00 37.83 34.40 3ktm s LYS 51 CO 0.00 0.52 1.01 -1.58 -0.92 0.00 0.00 175.35 174.38 3ktm s TRP 52 N -1.68 3.55 0.18 3.18 0.52 -1.26 -1.32 118.94 122.10 3ktm s TRP 52 Ca 0.32 1.73 0.08 0.00 0.02 0.00 0.00 56.10 58.26 3ktm s TRP 52 Cb -0.11 -3.07 -0.04 0.00 -1.15 0.00 0.00 33.47 29.09 3ktm s TRP 52 CO 0.26 -0.21 -0.17 -0.51 0.02 0.00 0.00 176.95 176.33 3ktm s ASP 53 N -1.40 2.68 0.85 2.95 1.01 -0.10 -4.88 116.67 117.78 3ktm s ASP 53 Ca 0.51 -0.91 -0.10 0.00 0.71 0.00 0.00 52.55 52.76 3ktm s ASP 53 Cb -0.23 -0.16 0.16 0.00 1.01 0.00 0.00 42.92 43.70 3ktm s ASP 53 CO 0.29 -0.07 1.18 -0.55 0.21 0.00 0.00 175.17 176.24 3ktm s SER 54 N -2.86 3.71 0.13 0.27 0.15 -1.26 -1.08 113.70 112.76 3ktm s SER 54 Ca 0.18 0.06 -0.31 0.00 0.70 0.00 0.00 55.95 56.58 3ktm s SER 54 Cb -0.04 -0.28 -0.10 0.00 -1.71 0.00 0.00 66.02 63.89 3ktm s SER 54 CO 0.07 -2.32 1.81 -0.62 1.20 0.00 0.00 173.24 173.38 3ktm s ASP 55 N -4.80 6.44 0.28 5.45 2.15 -0.68 -4.73 116.67 120.77 3ktm s ASP 55 Ca 0.70 2.74 0.01 0.00 0.43 0.00 0.00 52.55 56.43 3ktm s ASP 55 Cb -0.05 -2.57 0.56 0.00 -0.30 0.00 0.00 42.92 40.56 3ktm s ASP 55 CO 0.49 -0.99 1.82 -0.65 -0.17 0.00 0.00 175.17 175.67 3ktm h PRO 56 N 8.43 0.87 -0.00 4.34 0.11 -1.94 -1.05 132.00 142.76 3ktm h PRO 56 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ktm h PRO 56 Cb 1.21 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3ktm h PRO 56 CO 0.95 0.57 -0.22 -1.13 -0.21 0.00 0.00 178.00 177.97 3ktm n SER 57 N -4.68 0.66 -2.08 -2.05 3.41 -1.26 -4.94 113.62 102.67 3ktm n SER 57 Ca 0.19 -0.58 -0.18 0.00 -0.26 0.00 0.00 58.87 58.03 3ktm n SER 57 Cb 0.39 0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.36 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 1.35 -0.38 0.00 5.00 0.00 -0.40 -4.83 105.19 105.92 3ktm n GLY 58 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -4.02 0.00 -2.28 2.61 -2.24 -1.26 -0.41 114.28 106.67 3ktm n THR 59 Ca -0.22 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 3ktm n THR 59 Cb 0.66 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 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 -0.36 4.41 0.49 -0.78 -0.14 -1.26 -4.99 119.74 117.11 3ktm s LYS 60 Ca 0.00 1.96 0.02 0.00 -1.36 0.00 0.00 55.97 56.59 3ktm s LYS 60 Cb 0.00 -3.24 -0.02 0.00 -1.68 0.00 0.00 37.83 32.89 3ktm s LYS 60 CO 0.00 -0.24 0.01 0.99 -0.76 0.00 0.00 175.35 175.35 3ktm s THR 61 N 0.40 1.24 0.15 2.17 2.01 -1.26 -2.07 115.64 118.28 3ktm s THR 61 Ca 0.57 -2.00 -0.32 0.00 0.31 0.00 0.00 61.69 60.26 3ktm s THR 61 Cb -0.34 -2.30 -0.17 0.00 0.01 0.00 0.00 72.50 69.70 3ktm s THR 61 CO 0.35 0.00 0.78 0.00 -0.69 0.00 0.00 174.62 175.06 3ktm s ILE 63 N -0.64 4.78 -0.07 0.00 1.09 -1.26 -5.00 121.20 120.10 3ktm s ILE 63 Ca 0.72 -1.06 0.10 0.00 -1.10 0.00 0.00 60.65 59.30 3ktm s ILE 63 Cb -0.99 -3.50 0.15 0.00 -1.06 0.00 0.00 42.46 37.06 3ktm s ILE 63 CO 0.56 -0.20 1.05 -0.90 -0.10 0.00 0.00 174.94 175.35 3ktm n ASP 64 N -0.76 1.87 -4.00 3.58 5.75 -1.26 -4.99 116.55 116.73 3ktm n ASP 64 Ca -0.08 -2.50 -0.10 0.00 -0.01 0.00 0.00 54.79 52.10 3ktm n ASP 64 Cb 0.56 -0.24 -0.11 0.00 -1.03 0.00 0.00 41.12 40.30 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 -1.81 0.19 0.09 2.12 -4.23 -1.26 -5.03 115.64 105.70 3ktm s THR 65 Ca 0.17 -0.97 -0.21 0.00 -1.18 0.00 0.00 61.69 59.49 3ktm s THR 65 Cb 0.14 -0.36 -0.11 0.00 1.34 0.00 0.00 72.50 73.51 3ktm s THR 65 CO 0.02 -0.50 1.65 0.11 -0.54 0.00 0.00 174.62 175.36 3ktm h LYS 66 N 4.57 0.19 -0.98 3.99 1.79 -1.96 -0.24 116.57 123.93 3ktm h LYS 66 Ca -0.33 -0.03 0.17 0.00 -2.18 0.00 0.00 60.65 58.29 3ktm h LYS 66 Cb 1.21 -0.03 -0.09 0.00 -1.58 0.00 0.00 32.23 31.73 3ktm h LYS 66 CO 0.42 0.24 0.61 0.93 -1.08 0.00 0.00 179.45 180.57 3ktm h GLU 67 N 0.08 0.74 -0.29 3.15 4.39 -1.96 0.18 114.58 120.87 3ktm h GLU 67 Ca 0.04 -0.04 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 3ktm h GLU 67 Cb 0.12 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 3ktm h GLU 67 CO -0.01 0.49 -0.42 0.78 -1.16 0.00 0.00 179.01 178.69 3ktm h GLY 68 N 0.76 0.78 0.93 -3.84 0.00 -1.78 -0.94 103.07 98.99 3ktm h GLY 68 Ca 0.53 -0.81 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 3ktm h GLY 68 CO -0.30 0.73 0.05 -2.22 0.00 0.00 0.00 176.54 174.80 3ktm h ILE 69 N 0.58 1.09 -0.39 2.60 1.08 0.90 -0.86 117.51 122.50 3ktm h ILE 69 Ca 0.04 -0.25 0.04 0.00 -0.39 0.00 0.00 64.86 64.31 3ktm h ILE 69 Cb 0.96 1.08 -0.04 0.00 -3.07 0.00 0.00 36.82 35.75 3ktm h ILE 69 CO 0.09 0.08 0.16 0.25 -0.69 0.00 0.00 178.15 178.03 3ktm h LEU 70 N 0.06 0.19 -1.06 1.44 5.85 -0.65 -1.29 115.31 119.84 3ktm h LEU 70 Ca 0.03 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 3ktm h LEU 70 Cb 0.08 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3ktm h LEU 70 CO -0.01 0.15 0.30 1.56 -0.34 0.00 0.00 178.44 180.10 3ktm h GLN 71 N 0.33 0.96 -0.32 1.25 4.20 -0.92 -2.14 115.11 118.46 3ktm h GLN 71 Ca 0.18 -0.14 -0.09 0.00 0.06 0.00 0.00 58.65 58.65 3ktm h GLN 71 Cb 0.14 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 3ktm h GLN 71 CO -0.16 0.76 -0.19 -0.92 -0.67 0.00 0.00 178.83 177.65 3ktm h TYR 72 N 0.95 0.66 0.25 2.96 3.20 -0.59 -2.30 116.97 122.10 3ktm h TYR 72 Ca 0.23 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 3ktm h TYR 72 Cb 0.14 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.24 3ktm h TYR 72 CO 0.01 0.75 -0.12 0.00 -1.64 0.00 0.00 178.16 177.16 3ktm h GLN 74 N -0.34 0.70 -0.43 0.00 4.20 -1.33 -0.60 115.11 117.31 3ktm h GLN 74 Ca -0.03 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 3ktm h GLN 74 Cb 0.26 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 3ktm h GLN 74 CO 0.05 0.46 0.02 1.49 -0.67 0.00 0.00 178.83 180.18 3ktm h GLU 75 N 0.72 0.75 0.00 1.46 4.81 -0.94 -2.75 114.58 118.63 3ktm h GLU 75 Ca 0.36 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3ktm h GLU 75 Cb 0.45 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.76 3ktm h GLU 75 CO -0.14 0.81 -0.46 1.33 -0.73 0.00 0.00 179.01 179.82 3ktm n VAL 76 N -4.42 0.01 -2.98 0.32 0.24 -0.89 -4.07 118.33 106.54 3ktm n VAL 76 Ca -0.00 -0.01 -0.23 0.00 -2.04 0.00 0.00 64.34 62.06 3ktm n VAL 76 Cb 0.28 0.18 -0.03 0.00 -1.47 0.00 0.00 33.84 32.80 3ktm n VAL 76 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 3ktm n TYR 77 N -1.51 2.63 -0.20 6.34 4.01 -0.28 -4.93 117.16 123.22 3ktm n TYR 77 Ca 0.06 -3.83 0.16 0.00 -0.16 0.00 0.00 57.90 54.12 3ktm n TYR 77 Cb 0.34 -0.43 0.49 0.00 -0.31 0.00 0.00 39.34 39.42 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 0.44 -0.08 -0.72 0.13 -1.63 -1.85 132.00 131.25 3ktm h PRO 78 Ca 0.12 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3ktm h PRO 78 Cb 0.71 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.74 3ktm h PRO 78 CO 0.70 0.29 0.00 0.39 -0.23 0.00 0.00 178.00 179.16 3ktm n GLU 79 N -4.50 1.30 -4.34 0.86 1.02 -1.26 -4.85 120.64 108.86 3ktm n GLU 79 Ca 0.16 -0.45 -0.29 0.00 -0.02 0.00 0.00 57.16 56.56 3ktm n GLU 79 Cb 0.56 -1.29 -0.12 0.00 -0.02 0.00 0.00 31.44 30.57 3ktm n GLU 79 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3ktm s LEU 80 N -1.48 2.53 -0.92 -4.62 1.43 -0.70 -5.07 118.68 109.86 3ktm s LEU 80 Ca 0.26 -0.65 -0.17 0.00 -1.03 0.00 0.00 54.13 52.54 3ktm s LEU 80 Cb 0.13 -1.39 0.17 0.00 0.03 0.00 0.00 46.19 45.12 3ktm s LEU 80 CO 0.21 0.18 1.03 -1.58 0.23 0.00 0.00 176.35 176.41 3ktm s GLN 81 N -2.14 3.65 -0.24 1.70 0.74 -1.26 -4.97 119.66 117.14 3ktm s GLN 81 Ca 0.17 -2.08 -0.25 0.00 0.05 0.00 0.00 55.36 53.25 3ktm s GLN 81 Cb -0.10 -4.76 -0.01 0.00 1.10 0.00 0.00 33.01 29.24 3ktm s GLN 81 CO 0.08 -1.60 0.83 0.42 -0.55 0.00 0.00 175.29 174.47 3ktm s ILE 82 N 1.69 4.84 -0.53 -2.34 1.01 -1.26 0.70 121.20 125.32 3ktm s ILE 82 Ca 0.29 1.58 0.05 0.00 0.00 0.00 0.00 60.65 62.57 3ktm s ILE 82 Cb -0.06 -4.12 0.10 0.00 0.01 0.00 0.00 42.46 38.38 3ktm s ILE 82 CO -0.09 -0.07 0.93 0.35 0.00 0.00 0.00 174.94 176.06 3ktm n THR 83 N 5.21 0.58 -3.67 2.92 -2.24 0.18 -4.91 114.28 112.35 3ktm n THR 83 Ca 0.06 -0.79 0.04 0.00 -2.27 0.00 0.00 64.05 61.08 3ktm n THR 83 Cb 0.48 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 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 -0.76 -0.01 0.06 3.42 3.84 -1.16 -5.00 114.94 115.32 3ktm s ASN 84 Ca 0.09 -0.03 -0.04 0.00 0.21 0.00 0.00 52.86 53.08 3ktm s ASN 84 Cb 0.05 0.03 -0.02 0.00 -0.55 0.00 0.00 41.25 40.76 3ktm s ASN 84 CO 0.07 -0.06 0.06 0.68 -2.79 0.00 0.00 177.10 175.06 3ktm s VAL 85 N -2.07 0.17 -0.27 -5.21 -7.23 -1.26 -0.68 120.40 103.85 3ktm s VAL 85 Ca 0.19 -1.40 -0.23 0.00 -1.81 0.00 0.00 61.98 58.73 3ktm s VAL 85 Cb 0.06 -1.24 0.09 0.00 0.56 0.00 0.00 36.38 35.85 3ktm s VAL 85 CO -0.05 -0.77 0.80 0.54 -0.31 0.00 0.00 175.10 175.30 3ktm s VAL 86 N -3.42 0.00 0.43 1.32 0.11 -1.02 -3.37 120.40 114.46 3ktm s VAL 86 Ca 0.02 0.00 -0.25 0.00 -2.93 0.00 0.00 61.98 58.82 3ktm s VAL 86 Cb 0.04 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.81 3ktm s VAL 86 CO -0.08 0.00 1.29 -1.61 -3.33 0.00 0.00 175.10 171.37 3ktm s GLU 87 N 0.56 3.85 0.87 1.54 8.01 -1.26 -0.06 118.70 132.20 3ktm s GLU 87 Ca -0.01 2.12 -0.11 0.00 0.01 0.00 0.00 54.97 56.97 3ktm s GLU 87 Cb -0.05 -2.65 0.11 0.00 -4.31 0.00 0.00 34.13 27.23 3ktm s GLU 87 CO -0.04 -0.58 1.09 0.00 0.01 0.00 0.00 175.26 175.74 3ktm s ALA 88 N -1.30 1.71 0.10 5.21 0.00 -0.45 -4.77 121.76 122.26 3ktm s ALA 88 Ca 0.59 -0.04 -0.09 0.00 0.00 0.00 0.00 51.96 52.42 3ktm s ALA 88 Cb -0.37 -3.19 -0.17 0.00 0.00 0.00 0.00 23.12 19.39 3ktm s ALA 88 CO 0.47 -2.21 1.25 -0.91 0.00 0.00 0.00 175.76 174.35 3ktm h ASN 89 N -1.45 0.74 -4.25 0.00 2.35 -1.94 -3.46 115.58 107.58 3ktm h ASN 89 Ca -0.48 -0.59 -0.63 0.00 -0.55 0.00 0.00 56.30 54.04 3ktm h ASN 89 Cb 1.28 -0.23 -0.25 0.00 0.05 0.00 0.00 38.32 39.16 3ktm h ASN 89 CO 0.55 1.39 -0.86 -1.10 -1.65 0.00 0.00 177.43 175.76 3ktm s GLN 90 N -3.31 1.52 0.79 0.81 1.11 -1.26 -5.12 119.66 114.20 3ktm s GLN 90 Ca -0.08 -1.06 -0.10 0.00 0.01 0.00 0.00 55.36 54.13 3ktm s GLN 90 Cb 0.08 -1.71 0.07 0.00 -1.01 0.00 0.00 33.01 30.44 3ktm s GLN 90 CO 0.90 0.43 1.10 -1.25 0.01 0.00 0.00 175.29 176.48 3ktm s PRO 91 N -1.34 2.08 0.11 2.91 0.04 -1.26 -4.61 135.00 132.92 3ktm s PRO 91 Ca 0.10 1.21 0.05 0.00 0.04 0.00 0.00 61.00 62.39 3ktm s PRO 91 Cb -0.09 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.54 3ktm s PRO 91 CO 0.02 -1.78 -0.12 0.08 0.04 0.00 0.00 177.00 175.24 3ktm s VAL 92 N -2.87 1.11 -0.30 -0.36 1.01 0.77 -4.90 120.40 114.86 3ktm s VAL 92 Ca 0.62 -1.66 -0.17 0.00 0.00 0.00 0.00 61.98 60.77 3ktm s VAL 92 Cb -0.18 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 3ktm s VAL 92 CO 0.56 -0.49 0.47 -0.89 0.00 0.00 0.00 175.10 174.76 3ktm s THR 93 N -2.27 5.08 -0.20 3.92 2.01 -1.26 -1.37 115.64 121.55 3ktm s THR 93 Ca 0.07 0.58 -0.00 0.00 0.31 0.00 0.00 61.69 62.64 3ktm s THR 93 Cb -0.04 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.64 3ktm s THR 93 CO 0.01 -0.01 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.16 3ktm s ILE 94 N 2.27 2.51 0.49 1.82 1.01 -0.55 -4.93 121.20 123.83 3ktm s ILE 94 Ca 0.18 -0.87 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 3ktm s ILE 94 Cb -0.16 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 3ktm s ILE 94 CO 0.11 0.44 0.82 -1.10 0.00 0.00 0.00 174.94 175.21 3ktm s GLN 95 N 1.34 3.59 -0.62 2.79 -0.21 -1.26 -2.01 119.66 123.27 3ktm s GLN 95 Ca 0.04 0.33 -0.16 0.00 0.02 0.00 0.00 55.36 55.59 3ktm s GLN 95 Cb -0.14 -2.33 0.02 0.00 1.00 0.00 0.00 33.01 31.56 3ktm s GLN 95 CO -0.09 -0.23 0.64 0.09 -2.12 0.00 0.00 175.29 173.58 3ktm n ASN 96 N -2.17 -6.05 -4.90 5.90 4.13 -1.25 -5.00 115.26 105.92 3ktm n ASN 96 Ca 0.02 -0.30 -0.29 0.00 1.68 0.00 0.00 54.58 55.69 3ktm n ASN 96 Cb 0.55 -2.86 0.04 0.00 -1.54 0.00 0.00 39.78 35.97 3ktm n ASN 96 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 3ktm s TRP 97 N -2.41 3.29 0.22 3.10 0.52 -1.25 -4.83 118.94 117.58 3ktm s TRP 97 Ca 0.17 0.90 0.11 0.00 0.02 0.00 0.00 56.10 57.30 3ktm s TRP 97 Cb -0.03 -2.97 -0.05 0.00 -1.15 0.00 0.00 33.47 29.28 3ktm s TRP 97 CO 0.85 -1.08 -0.18 0.00 0.02 0.00 0.00 176.95 176.56 3ktm s LYS 99 N -3.04 3.40 0.09 0.00 1.02 -1.16 -0.36 119.74 119.69 3ktm s LYS 99 Ca 0.25 -0.70 -0.31 0.00 0.02 0.00 0.00 55.97 55.23 3ktm s LYS 99 Cb -0.07 -2.90 -0.17 0.00 -0.52 0.00 0.00 37.83 34.17 3ktm s LYS 99 CO 0.13 0.47 0.72 -2.13 -0.92 0.00 0.00 175.35 173.63 3ktm n ARG 100 N -0.98 0.00 0.00 1.68 0.63 -1.26 -1.20 116.66 115.54 3ktm n ARG 100 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 3ktm n ARG 100 Cb 0.56 -1.13 0.00 0.00 0.45 0.00 0.00 32.46 32.33 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 1.59 2.57 3.90 5.14 0.00 0.45 -4.53 105.19 114.30 3ktm n GLY 101 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 3ktm n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ktm n ARG 102 N -2.00 -5.54 -0.09 1.61 1.74 -0.34 -4.88 116.66 107.16 3ktm n ARG 102 Ca 0.00 0.60 -0.10 0.00 -0.77 0.00 0.00 57.85 57.58 3ktm n ARG 102 Cb 0.00 -5.48 -0.16 0.00 -1.02 0.00 0.00 32.46 25.81 3ktm n ARG 102 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3ktm n LYS 103 N -4.67 0.68 -4.02 5.56 4.01 -1.26 -4.81 118.16 113.65 3ktm n LYS 103 Ca 0.02 0.03 -0.32 0.00 -0.51 0.00 0.00 58.31 57.53 3ktm n LYS 103 Cb 0.53 -1.55 -0.15 0.00 -0.51 0.00 0.00 35.03 33.35 3ktm n LYS 103 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 3ktm s GLN 104 N -2.50 1.83 -0.05 1.97 -0.21 -1.26 -4.97 119.66 114.48 3ktm s GLN 104 Ca -0.10 -1.65 0.07 0.00 0.02 0.00 0.00 55.36 53.69 3ktm s GLN 104 Cb 0.06 -3.11 0.10 0.00 1.00 0.00 0.00 33.01 31.06 3ktm s GLN 104 CO 0.83 -0.80 0.97 0.00 -2.12 0.00 0.00 175.29 174.17 3ktm s LYS 106 N -1.33 3.38 0.36 0.00 1.02 -1.26 -3.91 119.74 118.00 3ktm s LYS 106 Ca 0.11 -0.34 -0.05 0.00 0.02 0.00 0.00 55.97 55.71 3ktm s LYS 106 Cb 0.10 -3.90 0.02 0.00 -0.52 0.00 0.00 37.83 33.52 3ktm s LYS 106 CO 0.01 -0.86 0.56 0.95 -0.92 0.00 0.00 175.35 175.09 3ktm s THR 107 N 2.59 0.00 0.04 2.17 -4.23 -1.26 -4.95 115.64 109.99 3ktm s THR 107 Ca 0.20 -1.45 -0.30 0.00 -1.18 0.00 0.00 61.69 58.95 3ktm s THR 107 Cb -0.15 -2.73 -0.06 0.00 1.34 0.00 0.00 72.50 70.90 3ktm s THR 107 CO 0.16 0.00 1.29 -1.38 -0.54 0.00 0.00 174.62 174.16 3ktm s HIS 108 N -2.78 3.20 0.67 3.99 -3.43 -1.26 -3.75 115.29 111.93 3ktm s HIS 108 Ca 0.27 1.08 -0.17 0.00 -0.80 0.00 0.00 55.06 55.45 3ktm s HIS 108 Cb -0.02 -3.54 -0.03 0.00 -1.43 0.00 0.00 32.58 27.56 3ktm s HIS 108 CO 0.19 -1.83 0.77 -2.30 -2.00 0.00 0.00 174.74 169.57 3ktm n PRO 109 N 4.54 0.53 -4.30 -0.38 -0.02 -1.26 -4.71 135.00 129.39 3ktm n PRO 109 Ca 0.11 0.22 -0.18 0.00 -2.02 0.00 0.00 63.50 61.63 3ktm n PRO 109 Cb 0.45 -2.02 -0.13 0.00 -0.02 0.00 0.00 33.50 31.78 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 -1.76 0.97 -0.45 6.00 3.76 -0.85 -4.95 115.29 118.00 3ktm s HIS 110 Ca 0.71 -0.30 -0.18 0.00 -0.15 0.00 0.00 55.06 55.14 3ktm s HIS 110 Cb -0.38 -0.59 0.04 0.00 1.11 0.00 0.00 32.58 32.76 3ktm s HIS 110 CO 0.52 -0.00 0.52 0.12 -0.85 0.00 0.00 174.74 175.05 3ktm s PHE 111 N -0.70 3.12 0.08 1.40 5.99 -1.26 -1.48 117.98 125.13 3ktm s PHE 111 Ca 0.00 -0.42 0.04 0.00 0.00 0.00 0.00 56.93 56.55 3ktm s PHE 111 Cb -0.07 -3.18 -0.03 0.00 0.00 0.00 0.00 43.02 39.75 3ktm s PHE 111 CO 0.01 -0.83 -0.12 0.14 -0.00 0.00 0.00 175.22 174.42 3ktm s VAL 112 N 2.34 0.98 -0.39 3.12 -7.23 -0.47 -4.89 120.40 113.86 3ktm s VAL 112 Ca 0.14 -1.43 -0.18 0.00 -1.81 0.00 0.00 61.98 58.70 3ktm s VAL 112 Cb -0.18 -1.14 0.01 0.00 0.56 0.00 0.00 36.38 35.63 3ktm s VAL 112 CO 0.13 -0.39 0.48 -0.63 -0.31 0.00 0.00 175.10 174.39 3ktm s ILE 113 N -1.79 5.04 1.07 -0.62 1.01 -1.26 -0.16 121.20 124.49 3ktm s ILE 113 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.55 3ktm s ILE 113 Cb -0.07 -4.00 0.23 0.00 0.01 0.00 0.00 42.46 38.63 3ktm s ILE 113 CO 0.01 -0.33 1.06 -2.84 0.00 0.00 0.00 174.94 172.85 3ktm s PRO 114 N 2.31 -0.19 -0.12 2.79 0.02 -1.26 -4.78 135.00 133.77 3ktm s PRO 114 Ca 0.16 0.76 0.03 0.00 0.02 0.00 0.00 61.00 61.96 3ktm s PRO 114 Cb -0.16 -1.65 0.00 0.00 0.02 0.00 0.00 34.50 32.72 3ktm s PRO 114 CO 0.14 -3.21 -0.22 0.71 -0.33 0.00 0.00 177.00 174.09 3ktm s TYR 115 N -2.69 2.63 -0.03 6.54 1.51 0.64 -1.34 117.35 124.61 3ktm s TYR 115 Ca 0.67 -1.13 -0.27 0.00 -1.01 0.00 0.00 57.07 55.32 3ktm s TYR 115 Cb -0.22 -1.77 -0.03 0.00 -0.11 0.00 0.00 41.96 39.83 3ktm s TYR 115 CO 0.61 -0.48 0.85 1.03 -1.11 0.00 0.00 175.55 176.45 3ktm s ARG 116 N 0.54 4.51 -0.58 -0.62 0.52 0.91 -1.22 118.95 123.01 3ktm s ARG 116 Ca -0.13 1.18 -0.22 0.00 -0.52 0.00 0.00 55.73 56.03 3ktm s ARG 116 Cb -0.17 -3.45 0.06 0.00 0.52 0.00 0.00 34.95 31.91 3ktm s ARG 116 CO 0.04 0.01 0.88 0.00 0.02 0.00 0.00 175.30 176.26 3ktm s LEU 118 N 3.69 4.33 -0.05 0.00 1.43 0.15 -4.65 118.68 123.59 3ktm s LEU 118 Ca 0.24 1.79 -0.04 0.00 -1.03 0.00 0.00 54.13 55.09 3ktm s LEU 118 Cb -0.16 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 3ktm s LEU 118 CO 0.14 -0.43 0.14 -0.69 0.23 0.00 0.00 176.35 175.74 3ktm s VAL 119 N 1.46 5.27 0.00 -1.59 1.01 -1.26 -0.64 120.40 124.64 3ktm s VAL 119 Ca 0.54 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.43 3ktm s VAL 119 Cb -0.24 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.75 3ktm s VAL 119 CO 0.25 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.40 3ktm n GLY 120 N 1.37 2.69 3.72 4.51 0.00 0.22 -4.60 105.19 113.09 3ktm n GLY 120 Ca -0.14 -0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 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 4.56 0.13 1.61 2.12 -1.26 -4.65 118.70 121.22 3ktm s GLU 121 Ca 0.00 1.31 -0.30 0.00 0.36 0.00 0.00 54.97 56.34 3ktm s GLU 121 Cb 0.00 -3.43 -0.07 0.00 0.26 0.00 0.00 34.13 30.89 3ktm s GLU 121 CO 0.00 0.05 1.17 0.12 -0.54 0.00 0.00 175.26 176.06 3ktm s PHE 122 N 0.69 3.48 -0.01 5.30 5.36 -1.26 -5.04 117.98 126.48 3ktm s PHE 122 Ca 0.48 1.42 0.01 0.00 -0.96 0.00 0.00 56.93 57.87 3ktm s PHE 122 Cb -0.21 -3.38 0.01 0.00 -0.34 0.00 0.00 43.02 39.10 3ktm s PHE 122 CO 0.26 -1.08 -0.01 0.08 -1.46 0.00 0.00 175.22 173.02 3ktm s VAL 123 N 0.38 0.16 0.38 3.12 1.01 -1.26 -5.07 120.40 119.13 3ktm s VAL 123 Ca 0.54 -0.01 -0.26 0.00 0.00 0.00 0.00 61.98 62.25 3ktm s VAL 123 Cb -0.30 -0.19 -0.11 0.00 0.00 0.00 0.00 36.38 35.78 3ktm s VAL 123 CO 0.33 0.08 1.12 -1.20 0.00 0.00 0.00 175.10 175.43 3ktm n SER 124 N 3.47 1.82 -4.73 3.32 7.64 -1.26 -4.94 113.62 118.93 3ktm n SER 124 Ca -0.18 1.11 -0.33 0.00 1.01 0.00 0.00 58.87 60.47 3ktm n SER 124 Cb 0.56 -1.40 0.09 0.00 -1.01 0.00 0.00 64.21 62.45 3ktm n SER 124 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3ktm s ASP 125 N -0.58 4.37 -0.16 6.43 1.01 -1.26 -4.98 116.67 121.49 3ktm s ASP 125 Ca 0.60 2.20 -0.18 0.00 0.71 0.00 0.00 52.55 55.88 3ktm s ASP 125 Cb -0.58 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 40.75 3ktm s ASP 125 CO 0.59 -2.14 0.50 0.00 0.21 0.00 0.00 175.17 174.33 3ktm s ALA 126 N -2.21 3.51 -0.10 5.23 0.00 -1.26 -5.00 121.76 121.92 3ktm s ALA 126 Ca 0.71 -0.30 -0.03 0.00 0.00 0.00 0.00 51.96 52.34 3ktm s ALA 126 Cb -0.25 -2.74 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 3ktm s ALA 126 CO 0.46 -0.24 0.00 -0.51 0.00 0.00 0.00 175.76 175.47 3ktm s LEU 127 N 1.17 3.55 -0.14 0.00 1.43 -1.26 -5.09 118.68 118.34 3ktm s LEU 127 Ca 0.25 0.10 -0.23 0.00 -1.03 0.00 0.00 54.13 53.22 3ktm s LEU 127 Cb -0.15 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.22 3ktm s LEU 127 CO 0.10 0.33 0.69 -0.22 0.23 0.00 0.00 176.35 177.48 3ktm s LEU 128 N -0.60 4.22 -0.60 1.79 2.96 -1.26 -5.02 118.68 120.18 3ktm s LEU 128 Ca 0.10 1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 54.93 3ktm s LEU 128 Cb -0.12 -3.03 0.15 0.00 0.50 0.00 0.00 46.19 43.70 3ktm s LEU 128 CO 0.02 -0.24 0.50 -0.69 -1.32 0.00 0.00 176.35 174.63 3ktm s VAL 129 N 1.53 4.75 1.06 1.68 1.01 -1.26 -4.98 120.40 124.19 3ktm s VAL 129 Ca 0.34 -2.03 -0.12 0.00 0.00 0.00 0.00 61.98 60.16 3ktm s VAL 129 Cb -0.17 -4.05 0.22 0.00 0.00 0.00 0.00 36.38 32.39 3ktm s VAL 129 CO 0.13 -0.88 1.07 -2.16 0.00 0.00 0.00 175.10 173.26 3ktm s PRO 130 N 0.94 -0.05 0.10 2.72 0.04 -1.26 -4.86 135.00 132.63 3ktm s PRO 130 Ca 0.09 0.73 -0.35 0.00 0.04 0.00 0.00 61.00 61.51 3ktm s PRO 130 Cb -0.22 -1.66 -0.15 0.00 0.04 0.00 0.00 34.50 32.50 3ktm s PRO 130 CO -0.02 -3.11 1.51 -3.47 0.04 0.00 0.00 177.00 171.95 3ktm n ASP 131 N -4.47 2.50 0.00 6.66 4.64 -1.26 -1.71 116.55 122.91 3ktm n ASP 131 Ca 0.05 1.09 0.00 0.00 -1.38 0.00 0.00 54.79 54.55 3ktm n ASP 131 Cb 0.55 -1.32 0.00 0.00 -1.04 0.00 0.00 41.12 39.32 3ktm n ASP 131 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 3ktm n LYS 132 N 3.32 0.00 -3.14 -0.67 5.02 -1.26 -4.93 118.16 116.50 3ktm n LYS 132 Ca 0.18 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.28 3ktm n LYS 132 Cb 0.24 -2.61 0.01 0.00 -0.02 0.00 0.00 35.03 32.65 3ktm n LYS 132 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ktm s LYS 134 N -4.38 0.87 -0.25 0.00 1.02 -0.58 -4.84 119.74 111.58 3ktm s LYS 134 Ca 0.50 -1.01 -0.11 0.00 0.02 0.00 0.00 55.97 55.37 3ktm s LYS 134 Cb -0.10 -0.89 -0.05 0.00 -0.52 0.00 0.00 37.83 36.27 3ktm s LYS 134 CO 0.34 0.20 0.17 0.12 -0.92 0.00 0.00 175.35 175.26 3ktm s PHE 135 N -1.36 3.30 0.14 3.18 2.19 -1.26 -1.24 117.98 122.93 3ktm s PHE 135 Ca 0.00 0.22 0.05 0.00 0.33 0.00 0.00 56.93 57.52 3ktm s PHE 135 Cb -0.09 -2.30 -0.04 0.00 -1.31 0.00 0.00 43.02 39.27 3ktm s PHE 135 CO 0.03 0.02 -0.10 -0.51 1.83 0.00 0.00 175.22 176.48 3ktm s LEU 136 N 1.20 2.52 -0.06 6.12 1.43 0.83 -5.00 118.68 125.71 3ktm s LEU 136 Ca 0.08 -0.99 -0.14 0.00 -1.03 0.00 0.00 54.13 52.04 3ktm s LEU 136 Cb -0.14 -0.36 0.03 0.00 0.03 0.00 0.00 46.19 45.75 3ktm s LEU 136 CO 0.06 -0.32 0.34 -1.38 0.23 0.00 0.00 176.35 175.28 3ktm s HIS 137 N -3.23 -0.28 -0.03 0.29 -3.43 -1.26 0.34 115.29 107.69 3ktm s HIS 137 Ca 0.16 0.57 0.01 0.00 -0.80 0.00 0.00 55.06 55.00 3ktm s HIS 137 Cb 0.02 0.12 0.02 0.00 -1.43 0.00 0.00 32.58 31.31 3ktm s HIS 137 CO 0.01 -0.31 -0.02 -1.14 -2.00 0.00 0.00 174.74 171.28 3ktm s GLN 138 N -0.70 0.47 -0.04 -0.38 0.74 0.11 -4.99 119.66 114.87 3ktm s GLN 138 Ca -0.08 0.00 -0.00 0.00 0.05 0.00 0.00 55.36 55.33 3ktm s GLN 138 Cb -0.04 -0.58 0.03 0.00 1.10 0.00 0.00 33.01 33.52 3ktm s GLN 138 CO 0.03 -0.10 0.02 -1.83 -0.55 0.00 0.00 175.29 172.85 3ktm s GLU 139 N 0.91 0.24 -0.34 1.67 1.03 -1.26 -0.19 118.70 120.76 3ktm s GLU 139 Ca -0.10 0.15 0.03 0.00 0.03 0.00 0.00 54.97 55.07 3ktm s GLU 139 Cb -0.13 -0.54 0.09 0.00 -0.80 0.00 0.00 34.13 32.75 3ktm s GLU 139 CO -0.01 -0.20 0.05 1.03 -1.33 0.00 0.00 175.26 174.80 3ktm s ARG 140 N 1.39 1.71 0.00 -4.83 1.81 -0.15 -4.98 118.95 113.89 3ktm s ARG 140 Ca -0.05 -1.77 0.06 0.00 -1.72 0.00 0.00 55.73 52.25 3ktm s ARG 140 Cb -0.13 -3.22 0.27 0.00 -0.45 0.00 0.00 34.95 31.41 3ktm s ARG 140 CO -0.03 -0.90 1.09 -1.33 -0.68 0.00 0.00 175.30 173.46 3ktm n MET 141 N 4.34 0.05 0.00 3.54 2.81 -1.26 -2.07 117.12 124.53 3ktm n MET 141 Ca -0.00 0.31 0.11 0.00 -1.81 0.00 0.00 57.70 56.30 3ktm n MET 141 Cb 0.42 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.39 3ktm n MET 141 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3ktm n ASP 142 N -1.38 1.47 -4.55 7.83 3.85 -1.26 -4.97 116.55 117.54 3ktm n ASP 142 Ca 0.02 -1.21 -0.27 0.00 -0.71 0.00 0.00 54.79 52.62 3ktm n ASP 142 Cb 0.05 0.71 -0.10 0.00 -1.35 0.00 0.00 41.12 40.43 3ktm n ASP 142 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3ktm s VAL 143 N -2.74 3.07 -0.39 2.12 0.11 -0.88 -5.09 120.40 116.60 3ktm s VAL 143 Ca 0.13 -1.72 0.02 0.00 -2.93 0.00 0.00 61.98 57.48 3ktm s VAL 143 Cb 0.17 -2.52 0.15 0.00 -1.53 0.00 0.00 36.38 32.66 3ktm s VAL 143 CO 0.72 -0.12 0.28 0.00 -3.33 0.00 0.00 175.10 172.65 3ktm s GLU 145 N 0.49 2.49 0.85 0.00 0.41 -0.84 -4.81 118.70 117.28 3ktm s GLU 145 Ca 0.25 -1.48 -0.12 0.00 -0.41 0.00 0.00 54.97 53.21 3ktm s GLU 145 Cb -0.10 -2.68 0.13 0.00 -1.78 0.00 0.00 34.13 29.69 3ktm s GLU 145 CO -0.09 -0.65 1.19 -0.08 -0.49 0.00 0.00 175.26 175.14 3ktm s THR 146 N -2.56 2.06 0.03 3.63 -1.32 -1.26 -0.79 115.64 115.44 3ktm s THR 146 Ca 0.59 -0.09 -0.22 0.00 -1.21 0.00 0.00 61.69 60.76 3ktm s THR 146 Cb -0.07 -2.96 -0.15 0.00 -1.51 0.00 0.00 72.50 67.80 3ktm s THR 146 CO 0.37 0.00 1.40 -0.74 -2.21 0.00 0.00 174.62 173.44 3ktm h HIS 147 N -1.17 0.26 -0.82 9.09 -0.00 -1.96 -2.87 115.15 117.67 3ktm h HIS 147 Ca -0.44 -0.06 0.12 0.00 -0.00 0.00 0.00 60.37 59.99 3ktm h HIS 147 Cb 1.28 -0.06 -0.08 0.00 -0.00 0.00 0.00 27.41 28.55 3ktm h HIS 147 CO -0.31 0.55 0.43 1.25 -0.00 0.00 0.00 177.93 179.84 3ktm h LEU 148 N -0.11 0.55 0.01 0.26 5.85 -1.95 0.18 115.31 120.09 3ktm h LEU 148 Ca 0.03 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.84 3ktm h LEU 148 Cb 0.48 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 3ktm h LEU 148 CO 0.01 0.27 -0.08 -0.74 -0.34 0.00 0.00 178.44 177.56 3ktm h HIS 149 N 0.66 -0.20 -0.20 1.25 2.76 -1.92 -1.89 115.15 115.60 3ktm h HIS 149 Ca 0.43 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.52 3ktm h HIS 149 Cb 0.53 0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 3ktm h HIS 149 CO -0.09 -0.13 -0.22 -1.49 -1.30 0.00 0.00 177.93 174.70 3ktm h TRP 150 N -0.14 0.40 -0.57 5.26 -0.00 -1.13 -0.17 115.95 119.60 3ktm h TRP 150 Ca 0.03 -0.07 -0.03 0.00 -0.00 0.00 0.00 58.89 58.81 3ktm h TRP 150 Cb 0.18 -0.10 -0.03 0.00 -0.00 0.00 0.00 29.16 29.21 3ktm h TRP 150 CO -0.14 0.57 0.22 1.25 -0.00 0.00 0.00 178.44 180.34 3ktm h HIS 151 N 0.33 0.88 -0.26 0.49 2.76 -0.77 -1.55 115.15 117.03 3ktm h HIS 151 Ca 0.05 -0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 58.13 3ktm h HIS 151 Cb 0.58 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 29.27 3ktm h HIS 151 CO 0.01 0.71 0.06 1.15 -1.30 0.00 0.00 177.93 178.57 3ktm h THR 152 N 0.79 1.21 -0.55 6.26 2.02 -0.76 0.20 112.91 122.09 3ktm h THR 152 Ca 0.19 -0.70 0.09 0.00 0.77 0.00 0.00 66.41 66.75 3ktm h THR 152 Cb 0.21 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 3ktm h THR 152 CO -0.01 0.23 0.37 0.58 0.37 0.00 0.00 175.52 177.05 3ktm h VAL 153 N 0.26 0.91 -0.00 3.16 2.07 -0.85 0.66 116.25 122.45 3ktm h VAL 153 Ca 0.08 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 3ktm h VAL 153 Cb 0.28 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3ktm h VAL 153 CO 0.00 0.07 -0.09 0.00 0.02 0.00 0.00 177.57 177.57 3ktm h ALA 154 N 1.72 0.02 -0.36 1.67 0.00 -0.81 -2.23 119.26 119.27 3ktm h ALA 154 Ca 0.25 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.78 3ktm h ALA 154 Cb 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 3ktm h ALA 154 CO -0.06 -0.04 0.15 -0.22 0.00 0.00 0.00 179.25 179.07 3ktm h LYS 155 N -0.66 0.31 -0.63 0.00 3.64 -0.41 -2.11 116.57 116.70 3ktm h LYS 155 Ca -0.01 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.28 3ktm h LYS 155 Cb 0.85 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.57 3ktm h LYS 155 CO 0.02 0.20 0.10 1.49 -2.27 0.00 0.00 179.45 178.99 3ktm h GLU 156 N 0.32 1.04 -0.34 1.90 4.81 -0.98 -1.37 114.58 119.94 3ktm h GLU 156 Ca 0.16 -0.27 -0.06 0.00 -0.13 0.00 0.00 59.36 59.06 3ktm h GLU 156 Cb 0.10 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 3ktm h GLU 156 CO -0.14 0.95 -0.02 1.15 -0.73 0.00 0.00 179.01 180.22 3ktm h THR 157 N 0.97 1.21 -0.07 0.32 2.02 -0.99 0.81 112.91 117.18 3ktm h THR 157 Ca 0.19 -0.85 -0.21 0.00 0.77 0.00 0.00 66.41 66.31 3ktm h THR 157 Cb 0.42 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3ktm h THR 157 CO 0.01 0.29 -0.83 0.00 0.37 0.00 0.00 175.52 175.36 3ktm h SER 159 N 0.35 -0.10 -0.28 0.00 0.02 -0.62 0.48 113.55 113.40 3ktm h SER 159 Ca -0.06 -0.06 0.08 0.00 -0.84 0.00 0.00 61.79 60.91 3ktm h SER 159 Cb 1.44 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 64.00 3ktm h SER 159 CO 0.15 -0.00 0.56 -0.33 -1.14 0.00 0.00 176.83 176.08 3ktm h GLU 160 N -0.18 0.00 -0.43 3.45 5.08 -0.89 1.06 114.58 122.66 3ktm h GLU 160 Ca -0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3ktm h GLU 160 Cb 0.15 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 3ktm h GLU 160 CO 0.02 0.00 0.05 1.63 -1.00 0.00 0.00 179.01 179.71 3ktm n LYS 161 N -3.19 3.43 -3.87 2.33 5.02 -0.79 -4.94 118.16 116.14 3ktm n LYS 161 Ca 0.05 -3.00 -0.27 0.00 -2.02 0.00 0.00 58.31 53.07 3ktm n LYS 161 Cb 0.69 -2.01 0.02 0.00 -0.02 0.00 0.00 35.03 33.70 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 -0.25 -2.73 -4.03 4.39 7.64 0.37 -4.98 113.62 114.04 3ktm n SER 162 Ca 0.28 -0.85 -0.22 0.00 1.01 0.00 0.00 58.87 59.09 3ktm n SER 162 Cb 1.07 -3.72 -0.09 0.00 -1.01 0.00 0.00 64.21 60.47 3ktm n SER 162 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3ktm s THR 163 N -3.53 0.48 0.00 0.44 -4.23 0.09 -4.55 115.64 104.35 3ktm s THR 163 Ca 0.34 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.92 3ktm s THR 163 Cb -0.17 -2.47 -0.03 0.00 1.34 0.00 0.00 72.50 71.16 3ktm s THR 163 CO 0.84 0.00 -0.19 0.21 -0.54 0.00 0.00 174.62 174.94 3ktm s ASN 164 N -3.47 3.66 -0.22 3.99 2.47 0.21 -3.37 114.94 118.22 3ktm s ASN 164 Ca 0.32 -0.38 -0.29 0.00 0.42 0.00 0.00 52.86 52.92 3ktm s ASN 164 Cb 0.04 -0.60 -0.01 0.00 -1.45 0.00 0.00 41.25 39.23 3ktm s ASN 164 CO 0.17 0.29 1.32 -0.22 -3.72 0.00 0.00 177.10 174.95 3ktm s LEU 165 N -1.06 4.04 -0.19 3.21 2.96 -1.26 0.71 118.68 127.09 3ktm s LEU 165 Ca 0.13 1.50 -0.01 0.00 -0.22 0.00 0.00 54.13 55.53 3ktm s LEU 165 Cb -0.10 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.83 3ktm s LEU 165 CO 0.02 -0.94 0.08 1.57 -1.32 0.00 0.00 176.35 175.77 3ktm n HIS 166 N 7.21 0.61 -3.50 5.38 -0.00 0.68 -4.93 115.22 120.67 3ktm n HIS 166 Ca 0.15 0.13 -0.10 0.00 -0.00 0.00 0.00 57.72 57.90 3ktm n HIS 166 Cb 0.46 -1.08 -0.02 0.00 -0.00 0.00 0.00 29.99 29.34 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 -6.70 -0.48 0.24 0.26 3.68 -1.22 -5.00 116.67 107.45 3ktm s ASP 167 Ca -0.27 -0.08 -0.22 0.00 2.13 0.00 0.00 52.55 54.11 3ktm s ASP 167 Cb 0.08 0.57 0.03 0.00 -1.45 0.00 0.00 42.92 42.15 3ktm s ASP 167 CO 0.69 -0.94 0.76 -0.72 0.13 0.00 0.00 175.17 175.09 3ktm s TYR 168 N -3.63 -0.21 0.11 -5.34 1.13 -1.26 -1.16 117.35 107.00 3ktm s TYR 168 Ca 0.03 -0.20 -0.18 0.00 -1.41 0.00 0.00 57.07 55.31 3ktm s TYR 168 Cb -0.02 0.68 0.04 0.00 -1.10 0.00 0.00 41.96 41.57 3ktm s TYR 168 CO -0.09 -1.12 0.45 0.20 -2.51 0.00 0.00 175.55 172.47 3ktm s GLY 169 N -2.91 -0.35 0.53 5.49 0.00 0.22 -4.98 107.32 105.33 3ktm s GLY 169 Ca 0.10 0.16 -0.16 0.00 0.00 0.00 0.00 44.72 44.83 3ktm s GLY 169 CO 0.04 -0.12 0.99 1.06 0.00 0.00 0.00 173.10 175.08 3ktm s MET 170 N -3.48 3.88 0.11 2.90 -1.94 -1.26 -1.27 119.30 118.24 3ktm s MET 170 Ca 0.01 0.92 0.05 0.00 -1.71 0.00 0.00 55.69 54.95 3ktm s MET 170 Cb 0.01 -2.13 -0.04 0.00 2.01 0.00 0.00 34.83 34.69 3ktm s MET 170 CO -0.10 -0.33 -0.12 -0.51 -0.01 0.00 0.00 175.02 173.96 3ktm s LEU 171 N -4.27 2.41 -0.64 -0.03 1.43 -0.92 -4.60 118.68 112.06 3ktm s LEU 171 Ca 0.58 -0.82 -0.17 0.00 -1.03 0.00 0.00 54.13 52.69 3ktm s LEU 171 Cb -0.10 -0.41 0.03 0.00 0.03 0.00 0.00 46.19 45.73 3ktm s LEU 171 CO 0.35 -0.21 0.64 0.18 0.23 0.00 0.00 176.35 177.54 3ktm n LEU 172 N 0.52 -2.91 -4.77 1.79 4.77 -1.26 -2.43 117.00 112.71 3ktm n LEU 172 Ca -0.16 -0.47 -0.40 0.00 -0.03 0.00 0.00 56.01 54.96 3ktm n LEU 172 Cb 0.57 -1.86 0.01 0.00 -2.33 0.00 0.00 43.42 39.81 3ktm n LEU 172 CO 0.27 -0.08 1.05 -2.16 -1.33 0.00 0.00 177.39 175.14 3ktm s PRO 173 N -3.62 3.75 0.00 3.23 0.04 -1.26 -0.54 135.00 136.60 3ktm s PRO 173 Ca 0.18 2.37 0.00 0.00 0.04 0.00 0.00 61.00 63.59 3ktm s PRO 173 Cb -0.02 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.83 3ktm s PRO 173 CO 0.87 -0.75 0.59 0.00 0.04 0.00 0.00 177.00 177.76 3ktm n GLY 175 N -0.13 -0.76 3.60 0.00 0.00 -1.08 -4.93 105.19 101.89 3ktm n GLY 175 Ca 0.00 -1.03 -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 3.43 -1.29 -0.61 1.09 -1.26 -2.01 121.20 118.55 3ktm s ILE 176 Ca 0.00 0.44 -0.09 0.00 -1.10 0.00 0.00 60.65 59.90 3ktm s ILE 176 Cb 0.00 -3.57 0.01 0.00 -1.06 0.00 0.00 42.46 37.84 3ktm s ILE 176 CO 0.00 -0.35 1.13 -0.67 -0.10 0.00 0.00 174.94 174.95 3ktm n ASP 177 N 10.31 -6.17 -3.93 3.58 -0.08 -1.22 -4.91 116.55 114.14 3ktm n ASP 177 Ca 0.23 -0.52 -0.20 0.00 -1.51 0.00 0.00 54.79 52.80 3ktm n ASP 177 Cb 0.46 -4.83 -0.16 0.00 2.34 0.00 0.00 41.12 38.94 3ktm n ASP 177 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 3ktm s LYS 178 N -6.25 0.92 0.13 -0.67 -0.14 -0.85 -4.19 119.74 108.68 3ktm s LYS 178 Ca 0.56 -0.17 0.03 0.00 -1.36 0.00 0.00 55.97 55.03 3ktm s LYS 178 Cb -0.25 -0.88 -0.04 0.00 -1.68 0.00 0.00 37.83 34.99 3ktm s LYS 178 CO 0.70 -0.03 -0.09 -0.06 -0.76 0.00 0.00 175.35 175.11 3ktm s PHE 179 N 0.71 1.10 -2.05 3.18 0.40 0.03 0.15 117.98 121.51 3ktm s PHE 179 Ca -0.10 -0.82 0.22 0.00 -0.60 0.00 0.00 56.93 55.62 3ktm s PHE 179 Cb -0.13 -0.59 0.53 0.00 0.51 0.00 0.00 43.02 43.34 3ktm s PHE 179 CO 0.01 -0.02 1.45 0.54 0.70 0.00 0.00 175.22 177.90 3ktm n ARG 180 N -0.12 2.62 -3.20 0.44 1.74 0.30 -1.99 116.66 116.44 3ktm n ARG 180 Ca -0.11 -2.45 -0.02 0.00 -0.77 0.00 0.00 57.85 54.50 3ktm n ARG 180 Cb 0.61 -1.52 0.01 0.00 -1.02 0.00 0.00 32.46 30.54 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 1.48 0.75 3.35 -0.13 0.00 -1.09 -0.97 105.19 108.58 3ktm n GLY 181 Ca 0.21 -1.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.19 0.02 -0.06 1.61 0.11 0.73 -2.18 120.40 118.45 3ktm s VAL 182 Ca 0.17 -0.21 0.05 0.00 -2.93 0.00 0.00 61.98 59.06 3ktm s VAL 182 Cb -0.02 -0.72 -0.01 0.00 -1.53 0.00 0.00 36.38 34.10 3ktm s VAL 182 CO 0.04 -0.11 -0.21 -1.83 -3.33 0.00 0.00 175.10 169.65 3ktm s GLU 183 N -0.77 2.27 0.23 1.54 -1.05 -0.40 0.04 118.70 120.56 3ktm s GLU 183 Ca -0.08 -0.77 -0.10 0.00 -0.15 0.00 0.00 54.97 53.86 3ktm s GLU 183 Cb -0.03 -1.91 -0.01 0.00 -0.44 0.00 0.00 34.13 31.73 3ktm s GLU 183 CO 0.04 0.30 0.39 -0.59 0.95 0.00 0.00 175.26 176.35 3ktm s PHE 184 N -0.01 0.53 -0.16 4.83 -0.71 0.15 -0.61 117.98 122.01 3ktm s PHE 184 Ca -0.06 -0.86 0.01 0.00 -1.04 0.00 0.00 56.93 54.98 3ktm s PHE 184 Cb -0.13 0.01 0.02 0.00 -1.21 0.00 0.00 43.02 41.71 3ktm s PHE 184 CO 0.04 -0.89 -0.16 0.08 -1.34 0.00 0.00 175.22 172.94 3ktm s VAL 185 N -4.04 1.71 -0.03 -2.49 1.01 -0.30 -0.12 120.40 116.14 3ktm s VAL 185 Ca 0.25 -0.73 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3ktm s VAL 185 Cb 0.01 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.75 3ktm s VAL 185 CO 0.09 0.48 0.28 0.00 0.00 0.00 0.00 175.10 175.94 3ktm n PRO 188 N -0.24 2.59 0.12 0.00 -0.02 -1.26 0.67 135.00 136.86 3ktm n PRO 188 Ca -0.07 0.93 -0.13 0.00 -2.02 0.00 0.00 63.50 62.20 3ktm n PRO 188 Cb 0.63 -2.72 -0.06 0.00 -0.02 0.00 0.00 33.50 31.33 3ktm n PRO 188 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3ktm h LEU 189 N 5.56 -0.95 -1.84 2.45 3.38 -1.90 -3.43 115.31 118.58 3ktm h LEU 189 Ca -0.45 0.11 -0.40 0.00 0.09 0.00 0.00 57.88 57.23 3ktm h LEU 189 Cb 1.23 0.36 0.08 0.00 0.09 0.00 0.00 40.66 42.42 3ktm h LEU 189 CO 0.86 -0.42 -0.82 0.00 0.09 0.00 0.00 178.44 178.15 3ktm n ALA 190 N -2.71 -2.06 -2.38 1.53 0.00 -1.26 -4.97 120.51 108.66 3ktm n ALA 190 Ca -0.07 -0.14 -0.29 0.00 0.00 0.00 0.00 53.44 52.95 3ktm n ALA 190 Cb 0.33 -2.26 -0.15 0.00 0.00 0.00 0.00 19.45 17.37 3ktm n ALA 190 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ktm s ILE 191 N -3.60 1.87 -0.50 0.00 -1.09 -1.26 -5.10 121.20 111.52 3ktm s ILE 191 Ca 0.04 -1.09 -0.25 0.00 -2.23 0.00 0.00 60.65 57.12 3ktm s ILE 191 Cb -0.01 -1.57 0.03 0.00 -1.58 0.00 0.00 42.46 39.34 3ktm s ILE 191 CO 0.80 0.45 0.93 -0.70 -1.23 0.00 0.00 174.94 175.19 3ktm s GLU 192 N -0.75 3.44 0.66 2.79 2.56 -1.26 -5.03 118.70 121.12 3ktm s GLU 192 Ca 0.09 -0.02 -0.08 0.00 0.00 0.00 0.00 54.97 54.96 3ktm s GLU 192 Cb -0.09 -3.98 0.15 0.00 2.00 0.00 0.00 34.13 32.21 3ktm s GLU 192 CO -0.00 -1.33 0.90 0.41 -0.56 0.00 0.00 175.26 174.68 3ktm n GLY 193 N 5.01 -0.70 3.57 -1.50 0.00 -1.26 -5.12 105.19 105.19 3ktm n GLY 193 Ca 0.04 -1.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 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 -4.90 1.05 0.33 1.61 1.70 -1.26 -5.18 118.95 112.30 3ktm s ARG 194 Ca 0.54 -0.46 0.03 0.00 -0.47 0.00 0.00 55.73 55.37 3ktm s ARG 194 Cb -0.02 0.44 -0.04 0.00 -0.57 0.00 0.00 34.95 34.76 3ktm s ARG 194 CO 0.37 -0.47 0.13 0.15 -1.08 0.00 0.00 175.30 174.40 3ktm s LYS 195 N -3.32 1.68 -0.06 3.89 1.02 -1.26 -5.16 119.74 116.53 3ktm s LYS 195 Ca 0.06 -1.97 0.03 0.00 0.02 0.00 0.00 55.97 54.12 3ktm s LYS 195 Cb -0.01 -0.40 -0.02 0.00 -0.52 0.00 0.00 37.83 36.88 3ktm s LYS 195 CO -0.06 -0.39 -0.16 -1.17 -0.92 0.00 0.00 175.35 172.64 3ktm s LEU 196 N -3.45 2.60 -0.37 3.17 2.96 -1.26 -5.08 118.68 117.25 3ktm s LEU 196 Ca 0.33 -0.28 -0.11 0.00 -0.22 0.00 0.00 54.13 53.85 3ktm s LEU 196 Cb 0.05 -1.53 0.02 0.00 0.50 0.00 0.00 46.19 45.24 3ktm s LEU 196 CO 0.16 0.29 0.20 0.00 -1.32 0.00 0.00 176.35 175.69 3ktm s ALA 197 N -0.43 3.28 0.06 5.97 0.00 -1.26 -5.07 121.76 124.31 3ktm s ALA 197 Ca 0.05 -1.68 0.03 0.00 0.00 0.00 0.00 51.96 50.36 3ktm s ALA 197 Cb -0.12 -2.58 -0.03 0.00 0.00 0.00 0.00 23.12 20.39 3ktm s ALA 197 CO 0.02 -1.33 -0.09 0.00 0.00 0.00 0.00 175.76 174.36 3ktm s ALA 198 N 1.57 0.76 -2.00 0.00 0.00 -1.26 -5.37 121.76 115.45 3ktm s ALA 198 Ca 0.02 -0.88 0.15 0.00 0.00 0.00 0.00 51.96 51.26 3ktm s ALA 198 Cb -0.19 0.02 0.90 0.00 0.00 0.00 0.00 23.12 23.85 3ktm s ALA 198 CO 0.07 0.01 1.31 0.00 0.00 0.00 0.00 175.76 177.15