#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ka9 s GLU 2 N 0.00 2.35 0.17 0.03 0.41 0.34 -4.82 118.70 117.18 2ka9 s GLU 2 Ca 0.00 -0.88 0.10 0.00 -0.41 0.00 0.00 54.97 53.78 2ka9 s GLU 2 Cb 0.00 -2.40 -0.04 0.00 -1.78 0.00 0.00 34.13 29.90 2ka9 s GLU 2 CO 0.00 0.55 -0.16 0.71 -0.49 0.00 0.00 175.26 175.87 2ka9 s TYR 3 N -1.12 2.51 -0.02 1.61 1.51 -1.26 -0.06 117.35 120.52 2ka9 s TYR 3 Ca 0.20 -0.27 -0.26 0.00 -1.01 0.00 0.00 57.07 55.72 2ka9 s TYR 3 Cb -0.11 -1.26 0.06 0.00 -0.11 0.00 0.00 41.96 40.54 2ka9 s TYR 3 CO 0.11 0.48 0.59 -1.21 -1.11 0.00 0.00 175.55 174.41 2ka9 s GLU 4 N -2.60 1.00 -0.20 -0.62 0.41 0.19 -4.89 118.70 111.98 2ka9 s GLU 4 Ca 0.22 0.07 -0.04 0.00 -0.41 0.00 0.00 54.97 54.80 2ka9 s GLU 4 Cb -0.09 0.46 0.08 0.00 -1.78 0.00 0.00 34.13 32.81 2ka9 s GLU 4 CO 0.12 -0.32 0.16 -1.83 -0.49 0.00 0.00 175.26 172.90 2ka9 s GLU 5 N -1.53 0.14 0.00 1.61 -1.05 -1.26 0.12 118.70 116.72 2ka9 s GLU 5 Ca -0.10 0.02 0.00 0.00 -0.15 0.00 0.00 54.97 54.74 2ka9 s GLU 5 Cb -0.01 -1.44 0.00 0.00 -0.44 0.00 0.00 34.13 32.24 2ka9 s GLU 5 CO 0.06 -0.70 0.00 0.44 0.95 0.00 0.00 175.26 176.01 2ka9 n ILE 6 N 5.30 0.00 -3.79 1.83 -0.00 0.19 -4.98 119.36 117.90 2ka9 n ILE 6 Ca -0.06 0.00 -0.13 0.00 -0.00 0.00 0.00 62.75 62.56 2ka9 n ILE 6 Cb 0.49 0.00 -0.13 0.00 -0.00 0.00 0.00 39.64 39.99 2ka9 n ILE 6 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 2ka9 s THR 7 N -1.13 -0.02 -0.65 7.28 -4.23 -1.26 -0.59 115.64 115.04 2ka9 s THR 7 Ca 0.00 0.07 -0.02 0.00 -1.18 0.00 0.00 61.69 60.56 2ka9 s THR 7 Cb 0.00 -0.21 0.17 0.00 1.34 0.00 0.00 72.50 73.80 2ka9 s THR 7 CO 0.00 0.03 0.47 -0.22 -0.54 0.00 0.00 174.62 174.36 2ka9 s LEU 8 N 0.52 5.19 -0.17 4.79 2.96 0.98 -4.70 118.68 128.25 2ka9 s LEU 8 Ca -0.04 -3.01 -0.25 0.00 -0.22 0.00 0.00 54.13 50.61 2ka9 s LEU 8 Cb -0.05 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 2ka9 s LEU 8 CO -0.02 -0.33 0.82 -0.70 -1.32 0.00 0.00 176.35 174.80 2ka9 s GLU 9 N -0.29 4.30 -0.95 1.98 2.12 -1.26 -2.47 118.70 122.13 2ka9 s GLU 9 Ca 0.18 0.99 -0.22 0.00 0.36 0.00 0.00 54.97 56.28 2ka9 s GLU 9 Cb -0.19 -3.57 -0.25 0.00 0.26 0.00 0.00 34.13 30.39 2ka9 s GLU 9 CO -0.04 -0.31 2.38 -2.13 -0.54 0.00 0.00 175.26 174.62 2ka9 n ARG 10 N 5.16 0.00 0.19 4.30 0.63 0.39 -4.64 116.66 122.70 2ka9 n ARG 10 Ca 0.04 0.00 0.18 0.00 -0.92 0.00 0.00 57.85 57.15 2ka9 n ARG 10 Cb 0.49 -1.26 0.81 0.00 0.45 0.00 0.00 32.46 32.95 2ka9 n ARG 10 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 2ka9 h GLY 11 N 11.04 0.00 0.00 5.14 0.00 -1.87 -3.45 103.07 113.94 2ka9 h GLY 11 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2ka9 h GLY 11 CO 1.40 0.00 0.00 0.70 0.00 0.00 0.00 176.54 178.64 2ka9 n ASN 12 N -3.50 0.00 -1.53 0.19 4.13 -1.26 -4.94 115.26 108.35 2ka9 n ASN 12 Ca 0.03 0.00 -0.12 0.00 1.68 0.00 0.00 54.58 56.17 2ka9 n ASN 12 Cb 0.45 0.00 0.18 0.00 -1.54 0.00 0.00 39.78 38.88 2ka9 n ASN 12 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2ka9 n SER 13 N -0.31 3.07 0.00 6.41 3.41 -1.26 -5.04 113.62 119.90 2ka9 n SER 13 Ca 0.00 -3.75 0.00 0.00 -0.26 0.00 0.00 58.87 54.86 2ka9 n SER 13 Cb 0.00 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.25 2ka9 n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ka9 n GLY 14 N -1.11 0.36 0.08 5.00 0.00 -1.26 -4.98 105.19 103.27 2ka9 n GLY 14 Ca 0.42 -1.74 -0.17 0.00 0.00 0.00 0.00 46.02 44.53 2ka9 n GLY 14 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ka9 h LEU 15 N 0.00 0.00 -0.78 0.99 4.07 -1.93 -3.14 115.31 114.52 2ka9 h LEU 15 Ca 0.00 -0.76 0.00 0.00 0.08 0.00 0.00 57.88 57.20 2ka9 h LEU 15 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2ka9 h LEU 15 CO 0.00 1.20 0.00 0.61 -1.08 0.00 0.00 178.44 179.17 2ka9 n GLY 16 N 1.54 0.75 3.75 0.83 0.00 -1.26 0.13 105.19 110.93 2ka9 n GLY 16 Ca -0.19 -0.65 -0.05 0.00 0.00 0.00 0.00 46.02 45.13 2ka9 n GLY 16 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ka9 s PHE 17 N -2.26 -0.17 -0.06 1.61 -0.12 -1.26 -1.55 117.98 114.17 2ka9 s PHE 17 Ca 0.00 -0.16 0.02 0.00 -0.05 0.00 0.00 56.93 56.74 2ka9 s PHE 17 Cb 0.00 0.65 0.01 0.00 -0.63 0.00 0.00 43.02 43.05 2ka9 s PHE 17 CO 0.00 -0.90 -0.11 -1.54 -0.05 0.00 0.00 175.22 172.62 2ka9 s SER 18 N -2.90 1.62 0.31 1.98 1.04 -0.10 -4.94 113.70 110.71 2ka9 s SER 18 Ca 0.11 -0.27 0.11 0.00 0.48 0.00 0.00 55.95 56.38 2ka9 s SER 18 Cb -0.02 -0.76 -0.06 0.00 0.10 0.00 0.00 66.02 65.28 2ka9 s SER 18 CO 0.02 0.02 -0.15 0.27 0.98 0.00 0.00 173.24 174.38 2ka9 s ILE 19 N 0.70 2.34 -0.10 -1.02 -4.36 -1.26 0.10 121.20 117.60 2ka9 s ILE 19 Ca -0.14 -2.31 -0.30 0.00 -0.26 0.00 0.00 60.65 57.64 2ka9 s ILE 19 Cb -0.16 -2.46 0.10 0.00 1.25 0.00 0.00 42.46 41.20 2ka9 s ILE 19 CO 0.03 -0.31 0.85 0.00 0.24 0.00 0.00 174.94 175.76 2ka9 s ALA 20 N -2.57 -1.85 0.00 2.27 0.00 -1.21 -4.89 121.76 113.51 2ka9 s ALA 20 Ca 0.31 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.69 2ka9 s ALA 20 Cb -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 23.12 22.79 2ka9 s ALA 20 CO 0.16 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.95 2ka9 n GLY 21 N 0.70 0.54 0.00 0.00 0.00 -1.26 -3.78 105.19 101.40 2ka9 n GLY 21 Ca -0.14 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2ka9 n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ka9 n GLY 22 N 0.00 3.36 0.33 -0.02 0.00 -1.25 -4.37 105.19 103.23 2ka9 n GLY 22 Ca 0.00 -1.47 0.17 0.00 0.00 0.00 0.00 46.02 44.72 2ka9 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ka9 h THR 23 N 0.00 0.00 0.00 2.61 1.03 -0.24 -2.23 112.91 114.08 2ka9 h THR 23 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 66.41 66.16 2ka9 h THR 23 Cb 0.00 0.76 -0.04 0.00 -1.07 0.00 0.00 68.15 67.80 2ka9 h THR 23 CO 0.00 0.00 -1.47 0.47 -0.01 0.00 0.00 175.52 174.51 2ka9 n ASP 24 N -2.90 1.88 -3.87 0.00 9.92 -1.26 -4.73 116.55 115.58 2ka9 n ASP 24 Ca -0.02 0.43 -0.30 0.00 -0.53 0.00 0.00 54.79 54.37 2ka9 n ASP 24 Cb 0.26 -0.90 -0.10 0.00 -0.64 0.00 0.00 41.12 39.74 2ka9 n ASP 24 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2ka9 n ASN 25 N -4.41 3.44 -4.47 -2.24 6.94 -0.98 -5.09 115.26 108.45 2ka9 n ASN 25 Ca -0.33 -3.24 -0.44 0.00 -0.02 0.00 0.00 54.58 50.55 2ka9 n ASN 25 Cb 0.66 -0.81 -0.01 0.00 -2.36 0.00 0.00 39.78 37.26 2ka9 n ASN 25 CO 0.00 0.00 0.00 -2.65 -1.03 0.00 0.00 177.26 173.58 2ka9 n PRO 26 N 1.83 0.60 0.21 -0.53 -0.02 -0.88 -3.80 135.00 132.42 2ka9 n PRO 26 Ca 0.22 0.21 0.14 0.00 -2.02 0.00 0.00 63.50 62.06 2ka9 n PRO 26 Cb 0.36 -1.43 0.47 0.00 -0.02 0.00 0.00 33.50 32.87 2ka9 n PRO 26 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2ka9 h HIS 27 N 1.16 0.00 0.00 6.00 -0.00 -1.79 -3.28 115.15 117.24 2ka9 h HIS 27 Ca -0.37 0.00 -0.14 0.00 -0.00 0.00 0.00 60.37 59.86 2ka9 h HIS 27 Cb 1.40 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.78 2ka9 h HIS 27 CO 0.40 0.00 -1.56 0.44 -0.00 0.00 0.00 177.93 177.21 2ka9 n ILE 28 N -2.83 0.53 -0.12 6.26 -5.35 -1.26 -4.95 119.36 111.64 2ka9 n ILE 28 Ca 0.03 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.16 2ka9 n ILE 28 Cb 0.37 -0.70 0.00 0.00 -1.74 0.00 0.00 39.64 37.57 2ka9 n ILE 28 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ka9 n GLY 29 N 2.45 1.72 1.37 3.28 0.00 -1.24 -4.96 105.19 107.82 2ka9 n GLY 29 Ca -0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 2ka9 n GLY 29 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ka9 n ASP 30 N 0.14 -0.21 -3.08 1.61 -0.08 -1.26 -5.05 116.55 108.61 2ka9 n ASP 30 Ca 0.00 -0.95 0.03 0.00 -1.51 0.00 0.00 54.79 52.37 2ka9 n ASP 30 Cb 0.03 0.09 -0.00 0.00 2.34 0.00 0.00 41.12 43.58 2ka9 n ASP 30 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2ka9 s ASP 31 N -0.17 -1.00 0.55 1.67 2.15 -1.26 -5.02 116.67 113.59 2ka9 s ASP 31 Ca 0.01 -0.16 0.27 0.00 0.43 0.00 0.00 52.55 53.10 2ka9 s ASP 31 Cb 0.05 1.46 1.46 0.00 -0.30 0.00 0.00 42.92 45.58 2ka9 s ASP 31 CO -0.01 -0.15 1.97 1.55 -0.17 0.00 0.00 175.17 178.36 2ka9 h PRO 32 N 6.99 0.00 -7.24 4.34 0.13 -1.85 -3.42 132.00 130.94 2ka9 h PRO 32 Ca -0.02 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.67 2ka9 h PRO 32 Cb 1.19 0.00 0.19 0.00 0.13 0.00 0.00 31.00 32.51 2ka9 h PRO 32 CO 0.02 0.00 0.08 -1.12 -0.23 0.00 0.00 178.00 176.76 2ka9 s SER 33 N -5.88 1.59 0.15 1.44 0.01 -1.26 -1.52 113.70 108.22 2ka9 s SER 33 Ca -0.05 1.34 0.10 0.00 1.31 0.00 0.00 55.95 58.65 2ka9 s SER 33 Cb 0.19 -2.08 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 2ka9 s SER 33 CO 0.68 -3.80 -0.20 -0.63 0.41 0.00 0.00 173.24 169.69 2ka9 s ILE 34 N -2.68 2.62 -0.01 1.44 1.09 -1.26 -4.30 121.20 118.09 2ka9 s ILE 34 Ca 0.67 -1.75 -0.04 0.00 -1.10 0.00 0.00 60.65 58.44 2ka9 s ILE 34 Cb -0.22 -2.23 0.00 0.00 -1.06 0.00 0.00 42.46 38.95 2ka9 s ILE 34 CO 0.62 -0.00 0.08 0.72 -0.10 0.00 0.00 174.94 176.25 2ka9 s PHE 35 N -1.37 0.00 0.57 3.97 -0.71 -1.25 -3.66 117.98 115.53 2ka9 s PHE 35 Ca 0.19 0.00 -0.18 0.00 -1.04 0.00 0.00 56.93 55.90 2ka9 s PHE 35 Cb -0.09 -0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.64 2ka9 s PHE 35 CO 0.10 -0.13 1.10 0.42 -1.34 0.00 0.00 175.22 175.37 2ka9 s ILE 36 N -0.58 3.34 -0.27 -4.49 1.01 0.35 -3.34 121.20 117.22 2ka9 s ILE 36 Ca -0.07 0.76 -0.04 0.00 0.00 0.00 0.00 60.65 61.30 2ka9 s ILE 36 Cb -0.04 -3.27 -0.15 0.00 0.01 0.00 0.00 42.46 39.00 2ka9 s ILE 36 CO 0.00 -0.26 -0.27 0.35 0.00 0.00 0.00 174.94 174.77 2ka9 n THR 37 N -1.62 1.51 -3.57 2.92 -2.24 0.29 -2.09 114.28 109.48 2ka9 n THR 37 Ca 0.11 -0.50 -0.12 0.00 -2.27 0.00 0.00 64.05 61.26 2ka9 n THR 37 Cb 0.52 -1.60 -0.05 0.00 -2.10 0.00 0.00 70.33 67.09 2ka9 n THR 37 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2ka9 s LYS 38 N -2.52 0.70 -0.06 -0.78 0.00 -1.23 -4.78 119.74 111.08 2ka9 s LYS 38 Ca -0.36 0.22 -0.01 0.00 0.00 0.00 0.00 55.97 55.81 2ka9 s LYS 38 Cb 0.11 0.33 -0.03 0.00 0.00 0.00 0.00 37.83 38.24 2ka9 s LYS 38 CO 0.56 -0.21 0.02 0.42 0.00 0.00 0.00 175.35 176.14 2ka9 s ILE 39 N -1.01 4.44 -0.24 3.79 1.01 -1.26 -0.93 121.20 127.00 2ka9 s ILE 39 Ca -0.04 -0.30 -0.25 0.00 0.00 0.00 0.00 60.65 60.07 2ka9 s ILE 39 Cb -0.01 -2.91 -0.00 0.00 0.01 0.00 0.00 42.46 39.54 2ka9 s ILE 39 CO 0.03 0.53 0.85 -0.63 0.00 0.00 0.00 174.94 175.72 2ka9 s ILE 40 N -0.98 4.82 -0.89 2.92 1.01 -0.60 -4.94 121.20 122.55 2ka9 s ILE 40 Ca 0.16 1.61 -0.23 0.00 0.00 0.00 0.00 60.65 62.18 2ka9 s ILE 40 Cb -0.11 -4.14 -0.19 0.00 0.01 0.00 0.00 42.46 38.03 2ka9 s ILE 40 CO 0.05 -0.09 2.13 -2.65 0.00 0.00 0.00 174.94 174.38 2ka9 n PRO 41 N 6.04 0.24 0.00 2.79 -0.02 -1.26 -1.96 135.00 140.83 2ka9 n PRO 41 Ca 0.06 -1.17 0.00 0.00 -2.02 0.00 0.00 63.50 60.38 2ka9 n PRO 41 Cb 0.47 -3.44 0.00 0.00 -0.02 0.00 0.00 33.50 30.51 2ka9 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ka9 n GLY 42 N 6.19 1.68 3.28 -1.23 0.00 -1.26 -5.15 105.19 108.70 2ka9 n GLY 42 Ca 0.41 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 2ka9 n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ka9 n GLY 43 N 0.00 -3.16 0.24 -0.02 0.00 -0.83 -4.90 105.19 96.51 2ka9 n GLY 43 Ca 0.00 -1.43 0.14 0.00 0.00 0.00 0.00 46.02 44.73 2ka9 n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ka9 h ALA 44 N -3.21 0.99 -0.02 4.61 0.00 -0.45 -3.31 119.26 117.87 2ka9 h ALA 44 Ca -0.47 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.44 2ka9 h ALA 44 Cb 1.29 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.02 2ka9 h ALA 44 CO 0.33 0.04 -0.44 0.00 0.00 0.00 0.00 179.25 179.18 2ka9 h ALA 45 N 1.97 -0.70 0.00 0.00 0.00 -1.67 0.76 119.26 119.63 2ka9 h ALA 45 Ca -0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2ka9 h ALA 45 Cb 0.83 0.78 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 2ka9 h ALA 45 CO 0.00 -0.98 -0.19 0.00 0.00 0.00 0.00 179.25 178.09 2ka9 h ALA 46 N -0.07 1.52 -0.11 0.00 0.00 -1.85 0.76 119.26 119.50 2ka9 h ALA 46 Ca 0.05 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.62 2ka9 h ALA 46 Cb 0.66 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2ka9 h ALA 46 CO -0.33 0.24 -0.62 0.37 0.00 0.00 0.00 179.25 178.91 2ka9 h GLN 47 N 0.00 0.40 0.00 0.00 4.15 -1.21 -3.05 115.11 115.40 2ka9 h GLN 47 Ca -0.00 -0.28 -0.04 0.00 0.77 0.00 0.00 58.65 59.10 2ka9 h GLN 47 Cb 0.38 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 2ka9 h GLN 47 CO 0.02 0.89 -1.05 -0.44 -1.93 0.00 0.00 178.83 176.33 2ka9 h ASP 48 N 0.29 0.00 -3.28 -0.69 3.32 0.13 -3.50 116.42 112.70 2ka9 h ASP 48 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2ka9 h ASP 48 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 2ka9 h ASP 48 CO 0.11 0.13 -0.06 0.61 -1.72 0.00 0.00 179.24 178.31 2ka9 n GLY 49 N 1.22 -0.74 2.04 2.75 0.00 0.26 -4.80 105.19 105.93 2ka9 n GLY 49 Ca -0.02 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 2ka9 n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ka9 n ARG 50 N -0.52 2.10 0.00 1.61 5.12 -1.10 -4.91 116.66 118.96 2ka9 n ARG 50 Ca 0.01 -2.52 0.00 0.00 -1.93 0.00 0.00 57.85 53.42 2ka9 n ARG 50 Cb 0.08 -1.99 0.00 0.00 -1.16 0.00 0.00 32.46 29.40 2ka9 n ARG 50 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 2ka9 n LEU 51 N -0.78 0.00 -4.74 0.55 -0.00 -1.26 -4.53 117.00 106.24 2ka9 n LEU 51 Ca 0.50 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 56.10 2ka9 n LEU 51 Cb 1.30 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 44.73 2ka9 n LEU 51 CO 0.53 0.00 1.02 0.54 -0.00 0.00 0.00 177.39 179.48 2ka9 n ARG 52 N 0.00 2.28 -0.12 1.47 5.12 -1.26 -4.92 116.66 119.24 2ka9 n ARG 52 Ca 0.00 0.81 -0.13 0.00 -1.93 0.00 0.00 57.85 56.60 2ka9 n ARG 52 Cb 0.00 -2.53 -0.03 0.00 -1.16 0.00 0.00 32.46 28.74 2ka9 n ARG 52 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 2ka9 h VAL 53 N 2.48 1.28 0.00 1.55 -1.51 -1.80 -2.90 116.25 115.35 2ka9 h VAL 53 Ca -0.49 -1.51 0.00 0.00 -1.23 0.00 0.00 66.70 63.47 2ka9 h VAL 53 Cb 1.27 1.40 0.00 0.00 -2.13 0.00 0.00 31.29 31.83 2ka9 h VAL 53 CO 0.62 0.50 0.31 -0.55 -1.23 0.00 0.00 177.57 177.21 2ka9 h ASN 54 N 0.69 0.00 -3.00 4.19 7.08 -1.73 1.01 115.58 123.82 2ka9 h ASN 54 Ca 0.06 0.00 -0.42 0.00 -3.08 0.00 0.00 56.30 52.86 2ka9 h ASN 54 Cb 0.92 0.00 0.22 0.00 -2.08 0.00 0.00 38.32 37.38 2ka9 h ASN 54 CO 0.09 0.00 -0.15 -0.90 -2.08 0.00 0.00 177.43 174.39 2ka9 n ASP 55 N -2.38 -2.37 -3.92 6.14 5.75 -1.10 -4.56 116.55 114.12 2ka9 n ASP 55 Ca -0.01 -0.33 -0.26 0.00 -0.01 0.00 0.00 54.79 54.18 2ka9 n ASP 55 Cb 0.34 -1.17 -0.17 0.00 -1.03 0.00 0.00 41.12 39.09 2ka9 n ASP 55 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2ka9 s SER 56 N -2.44 1.97 -0.68 -1.12 0.15 -1.17 -3.27 113.70 107.13 2ka9 s SER 56 Ca 0.67 -0.27 -0.26 0.00 0.70 0.00 0.00 55.95 56.79 2ka9 s SER 56 Cb -0.22 -0.78 -0.08 0.00 -1.71 0.00 0.00 66.02 63.22 2ka9 s SER 56 CO 0.64 -0.09 2.25 0.27 1.20 0.00 0.00 173.24 177.51 2ka9 s ILE 57 N 1.48 3.13 0.51 6.45 -4.36 -1.24 -1.58 121.20 125.59 2ka9 s ILE 57 Ca 0.00 -0.03 0.31 0.00 -0.26 0.00 0.00 60.65 60.67 2ka9 s ILE 57 Cb -0.13 -3.31 0.34 0.00 1.25 0.00 0.00 42.46 40.60 2ka9 s ILE 57 CO -0.05 -0.30 2.18 0.17 0.24 0.00 0.00 174.94 177.18 2ka9 h LEU 58 N 19.91 0.00 -7.00 0.37 8.10 -0.57 -3.24 115.31 132.87 2ka9 h LEU 58 Ca -0.11 0.00 0.01 0.00 0.11 0.00 0.00 57.88 57.90 2ka9 h LEU 58 Cb 1.12 0.00 -0.24 0.00 -0.44 0.00 0.00 40.66 41.10 2ka9 h LEU 58 CO 1.12 0.05 0.30 0.12 -4.11 0.00 0.00 178.44 175.93 2ka9 s PHE 59 N -4.36 -0.62 0.39 0.17 2.19 0.40 -3.05 117.98 113.10 2ka9 s PHE 59 Ca -0.04 1.50 0.06 0.00 0.33 0.00 0.00 56.93 58.78 2ka9 s PHE 59 Cb 0.14 0.32 0.06 0.00 -1.31 0.00 0.00 43.02 42.23 2ka9 s PHE 59 CO 0.55 -0.31 0.49 1.55 1.83 0.00 0.00 175.22 179.33 2ka9 n VAL 60 N 2.38 0.00 -0.04 3.12 3.14 0.18 0.14 118.33 127.25 2ka9 n VAL 60 Ca -0.13 -1.35 0.01 0.00 -2.96 0.00 0.00 64.34 59.90 2ka9 n VAL 60 Cb 0.55 -0.57 0.02 0.00 -1.06 0.00 0.00 33.84 32.78 2ka9 n VAL 60 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2ka9 n ASN 61 N -2.41 -0.05 -0.70 6.55 3.02 -0.78 -2.78 115.26 118.10 2ka9 n ASN 61 Ca 0.09 0.20 -0.03 0.00 -0.03 0.00 0.00 54.58 54.81 2ka9 n ASN 61 Cb 0.41 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.49 2ka9 n ASN 61 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2ka9 n GLU 62 N -4.19 0.00 -5.01 3.52 2.13 -1.26 -4.95 120.64 110.88 2ka9 n GLU 62 Ca 0.02 -0.47 -0.29 0.00 0.66 0.00 0.00 57.16 57.08 2ka9 n GLU 62 Cb 0.06 0.27 -0.15 0.00 0.27 0.00 0.00 31.44 31.89 2ka9 n GLU 62 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2ka9 s VAL 63 N 0.00 1.92 -1.18 6.31 1.01 -1.12 -5.06 120.40 122.28 2ka9 s VAL 63 Ca 0.00 -1.16 -0.20 0.00 0.00 0.00 0.00 61.98 60.62 2ka9 s VAL 63 Cb 0.00 -1.62 0.07 0.00 0.00 0.00 0.00 36.38 34.83 2ka9 s VAL 63 CO 0.00 0.43 1.61 -0.62 0.00 0.00 0.00 175.10 176.51 2ka9 s ASP 64 N -0.87 6.70 -0.35 3.32 2.15 -1.26 -0.64 116.67 125.73 2ka9 s ASP 64 Ca 0.10 -2.05 0.03 0.00 0.43 0.00 0.00 52.55 51.05 2ka9 s ASP 64 Cb -0.09 -2.57 0.48 0.00 -0.30 0.00 0.00 42.92 40.44 2ka9 s ASP 64 CO 0.00 -1.30 1.71 1.33 -0.17 0.00 0.00 175.17 176.75 2ka9 n VAL 65 N 6.54 2.68 1.03 1.11 0.24 -1.25 -4.29 118.33 124.40 2ka9 n VAL 65 Ca 0.42 -1.49 0.08 0.00 -2.04 0.00 0.00 64.34 61.30 2ka9 n VAL 65 Cb 0.48 -0.66 0.25 0.00 -1.47 0.00 0.00 33.84 32.44 2ka9 n VAL 65 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2ka9 n ARG 66 N -0.69 1.77 0.00 7.34 1.85 -1.17 -4.33 116.66 121.42 2ka9 n ARG 66 Ca 0.45 -1.18 0.00 0.00 -1.00 0.00 0.00 57.85 56.11 2ka9 n ARG 66 Cb 1.32 -1.32 0.00 0.00 -1.05 0.00 0.00 32.46 31.40 2ka9 n ARG 66 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2ka9 n GLU 67 N 0.43 0.00 -4.72 2.89 1.02 -1.26 -4.19 120.64 114.81 2ka9 n GLU 67 Ca 0.14 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.94 2ka9 n GLU 67 Cb 0.31 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.61 2ka9 n GLU 67 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2ka9 s VAL 68 N 0.00 3.48 1.05 2.62 -7.23 -1.26 -4.59 120.40 114.47 2ka9 s VAL 68 Ca 0.00 -0.56 -0.18 0.00 -1.81 0.00 0.00 61.98 59.43 2ka9 s VAL 68 Cb 0.00 -2.40 0.03 0.00 0.56 0.00 0.00 36.38 34.57 2ka9 s VAL 68 CO 0.00 0.60 -0.09 0.35 -0.31 0.00 0.00 175.10 175.64 2ka9 n THR 69 N 2.25 0.00 -0.06 5.32 -2.24 -1.26 -1.57 114.28 116.71 2ka9 n THR 69 Ca -0.18 -0.25 -0.08 0.00 -2.27 0.00 0.00 64.05 61.28 2ka9 n THR 69 Cb 0.53 -0.50 -0.01 0.00 -2.10 0.00 0.00 70.33 68.24 2ka9 n THR 69 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2ka9 h HIS 70 N -1.73 0.09 -0.87 4.78 2.76 -1.85 -2.13 115.15 116.21 2ka9 h HIS 70 Ca -0.48 0.02 0.11 0.00 -2.20 0.00 0.00 60.37 57.81 2ka9 h HIS 70 Cb 1.34 -0.00 -0.08 0.00 1.55 0.00 0.00 27.41 30.22 2ka9 h HIS 70 CO 0.21 0.02 0.50 1.03 -1.30 0.00 0.00 177.93 178.40 2ka9 h SER 71 N 0.15 0.71 -0.32 3.26 0.87 -1.94 0.13 113.55 116.40 2ka9 h SER 71 Ca 0.12 0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 2ka9 h SER 71 Cb 0.12 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2ka9 h SER 71 CO -0.16 0.38 0.15 0.00 -0.53 0.00 0.00 176.83 176.68 2ka9 h ALA 72 N 1.49 1.58 -0.24 6.23 0.00 -1.72 0.23 119.26 126.83 2ka9 h ALA 72 Ca 0.43 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 55.06 2ka9 h ALA 72 Cb 0.44 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2ka9 h ALA 72 CO -0.27 0.33 -0.56 0.00 0.00 0.00 0.00 179.25 178.75 2ka9 h ALA 73 N 1.66 0.39 -0.44 0.00 0.00 -0.33 -1.34 119.26 119.20 2ka9 h ALA 73 Ca 0.13 -0.52 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 2ka9 h ALA 73 Cb 0.09 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2ka9 h ALA 73 CO -0.01 0.61 0.02 0.28 0.00 0.00 0.00 179.25 180.15 2ka9 h VAL 74 N 0.55 1.23 -0.13 0.00 2.07 -0.08 -1.38 116.25 118.52 2ka9 h VAL 74 Ca -0.00 -0.90 -0.12 0.00 0.82 0.00 0.00 66.70 66.50 2ka9 h VAL 74 Cb 1.18 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 2ka9 h VAL 74 CO 0.12 0.32 -0.44 -0.33 0.02 0.00 0.00 177.57 177.26 2ka9 h GLU 75 N 0.67 0.30 -0.29 1.57 5.08 -0.42 0.43 114.58 121.92 2ka9 h GLU 75 Ca 0.14 -0.15 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 2ka9 h GLU 75 Cb 0.38 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 2ka9 h GLU 75 CO 0.01 0.69 -0.25 0.00 -1.00 0.00 0.00 179.01 178.46 2ka9 h ALA 76 N 1.29 0.42 0.00 3.43 0.00 -0.58 0.39 119.26 124.22 2ka9 h ALA 76 Ca 0.02 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2ka9 h ALA 76 Cb 0.88 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 2ka9 h ALA 76 CO 0.07 0.40 -0.58 1.37 0.00 0.00 0.00 179.25 180.51 2ka9 h LEU 77 N 0.43 0.00 -0.12 0.00 8.10 -1.18 0.56 115.31 123.09 2ka9 h LEU 77 Ca 0.05 0.00 -0.12 0.00 0.11 0.00 0.00 57.88 57.92 2ka9 h LEU 77 Cb 0.80 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.03 2ka9 h LEU 77 CO 0.06 0.58 -0.40 0.50 -4.11 0.00 0.00 178.44 175.07 2ka9 h LYS 78 N 0.00 0.49 -0.88 0.17 3.64 0.05 -3.12 116.57 116.92 2ka9 h LYS 78 Ca -0.01 -0.36 -0.41 0.00 -1.27 0.00 0.00 60.65 58.60 2ka9 h LYS 78 Cb 1.30 0.06 -0.25 0.00 -0.41 0.00 0.00 32.23 32.94 2ka9 h LYS 78 CO 0.08 0.99 0.50 -1.91 -2.27 0.00 0.00 179.45 176.83 2ka9 n GLU 79 N -4.31 2.61 0.09 1.90 2.13 0.13 -4.37 120.64 118.82 2ka9 n GLU 79 Ca -0.07 -3.05 -0.03 0.00 0.66 0.00 0.00 57.16 54.67 2ka9 n GLU 79 Cb 0.54 -2.16 -0.06 0.00 0.27 0.00 0.00 31.44 30.03 2ka9 n GLU 79 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ka9 h ALA 80 N 1.44 0.52 -0.07 4.31 0.00 -0.81 -3.48 119.26 121.17 2ka9 h ALA 80 Ca 0.51 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2ka9 h ALA 80 Cb 2.64 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 20.35 2ka9 h ALA 80 CO 0.96 0.98 0.00 0.41 0.00 0.00 0.00 179.25 181.60 2ka9 n GLY 81 N 1.31 1.81 0.00 0.00 0.00 -1.26 -3.81 105.19 103.24 2ka9 n GLY 81 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2ka9 n GLY 81 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ka9 n SER 82 N 8.35 0.43 -3.23 1.61 7.64 -1.26 -4.86 113.62 122.30 2ka9 n SER 82 Ca 0.00 -1.19 -0.03 0.00 1.01 0.00 0.00 58.87 58.66 2ka9 n SER 82 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 2ka9 n SER 82 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ka9 s ILE 83 N -0.19 -0.84 -0.23 0.44 1.01 -1.25 0.15 121.20 120.28 2ka9 s ILE 83 Ca 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 60.65 60.40 2ka9 s ILE 83 Cb 0.00 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 41.96 2ka9 s ILE 83 CO 0.00 -0.14 -0.01 0.68 0.00 0.00 0.00 174.94 175.47 2ka9 s VAL 84 N 2.13 3.53 -0.61 2.92 -7.23 -1.03 -4.91 120.40 115.20 2ka9 s VAL 84 Ca 0.14 -0.51 -0.23 0.00 -1.81 0.00 0.00 61.98 59.57 2ka9 s VAL 84 Cb -0.09 -2.65 0.06 0.00 0.56 0.00 0.00 36.38 34.26 2ka9 s VAL 84 CO -0.15 0.36 0.92 -0.60 -0.31 0.00 0.00 175.10 175.32 2ka9 s ARG 85 N 1.49 3.18 -0.10 4.82 3.52 -1.26 -0.02 118.95 130.58 2ka9 s ARG 85 Ca 0.05 -0.67 -0.04 0.00 -0.13 0.00 0.00 55.73 54.94 2ka9 s ARG 85 Cb -0.15 -4.16 -0.04 0.00 -1.56 0.00 0.00 34.95 29.04 2ka9 s ARG 85 CO -0.02 -1.65 0.06 -0.51 -0.81 0.00 0.00 175.30 172.37 2ka9 s LEU 86 N 3.88 3.95 -0.30 -0.88 1.02 0.24 -1.87 118.68 124.71 2ka9 s LEU 86 Ca 0.24 0.29 -0.07 0.00 0.02 0.00 0.00 54.13 54.61 2ka9 s LEU 86 Cb -0.16 -1.93 0.01 0.00 0.02 0.00 0.00 46.19 44.13 2ka9 s LEU 86 CO 0.13 0.39 0.09 -0.31 0.02 0.00 0.00 176.35 176.67 2ka9 s TYR 87 N -0.92 3.16 0.39 0.29 1.51 0.37 -0.64 117.35 121.50 2ka9 s TYR 87 Ca 0.14 -0.94 0.08 0.00 -1.01 0.00 0.00 57.07 55.34 2ka9 s TYR 87 Cb -0.12 -2.27 -0.06 0.00 -0.11 0.00 0.00 41.96 39.40 2ka9 s TYR 87 CO 0.03 -0.57 0.09 0.14 -1.11 0.00 0.00 175.55 174.14 2ka9 s VAL 88 N 1.51 2.33 -0.20 0.71 -7.23 0.31 0.10 120.40 117.94 2ka9 s VAL 88 Ca 0.03 -1.85 -0.04 0.00 -1.81 0.00 0.00 61.98 58.31 2ka9 s VAL 88 Cb -0.17 -2.94 0.08 0.00 0.56 0.00 0.00 36.38 33.91 2ka9 s VAL 88 CO 0.03 -0.06 0.18 -0.04 -0.31 0.00 0.00 175.10 174.90 2ka9 s MET 89 N -3.80 0.15 -0.09 4.82 -1.94 -0.61 0.52 119.30 118.35 2ka9 s MET 89 Ca 0.38 0.06 -0.02 0.00 -1.71 0.00 0.00 55.69 54.40 2ka9 s MET 89 Cb 0.04 -1.39 -0.03 0.00 2.01 0.00 0.00 34.83 35.46 2ka9 s MET 89 CO 0.21 -0.70 -0.01 -0.98 -0.01 0.00 0.00 175.02 173.53 2ka9 s ARG 90 N 2.25 3.00 0.29 2.03 1.70 0.91 -3.06 118.95 126.07 2ka9 s ARG 90 Ca 0.06 -0.44 -0.28 0.00 -0.47 0.00 0.00 55.73 54.59 2ka9 s ARG 90 Cb -0.16 -2.77 -0.09 0.00 -0.57 0.00 0.00 34.95 31.36 2ka9 s ARG 90 CO -0.13 0.66 1.00 1.03 -1.08 0.00 0.00 175.30 176.78 2ka9 s ARG 91 N -0.78 4.65 -0.24 3.89 0.52 -1.26 0.13 118.95 125.86 2ka9 s ARG 91 Ca 0.12 1.56 -0.16 0.00 -0.52 0.00 0.00 55.73 56.73 2ka9 s ARG 91 Cb -0.11 -3.07 -0.10 0.00 0.52 0.00 0.00 34.95 32.19 2ka9 s ARG 91 CO 0.02 0.30 -0.31 1.63 0.02 0.00 0.00 175.30 176.96 2ka9 n LYS 92 N 1.03 0.56 -2.71 3.54 4.76 -1.26 -4.73 118.16 119.35 2ka9 n LYS 92 Ca -0.00 0.28 -0.39 0.00 -2.87 0.00 0.00 58.31 55.33 2ka9 n LYS 92 Cb 0.47 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 32.18 2ka9 n LYS 92 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2ka9 n PRO 93 N -4.34 5.06 0.00 1.97 -0.04 -1.26 -5.02 135.00 131.37 2ka9 n PRO 93 Ca -0.39 -4.70 0.00 0.00 -0.04 0.00 0.00 63.50 58.38 2ka9 n PRO 93 Cb 0.74 -2.43 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 2ka9 n PRO 93 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2ka9 n PRO 94 N -0.03 1.51 -2.46 0.54 -0.04 -1.26 -4.81 135.00 128.45 2ka9 n PRO 94 Ca 0.44 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.87 2ka9 n PRO 94 Cb 0.28 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.75 2ka9 n PRO 94 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ka9 n ALA 95 N -3.00 -0.16 -0.62 0.55 0.00 -1.26 -4.83 120.51 111.19 2ka9 n ALA 95 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2ka9 n ALA 95 Cb 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2ka9 n ALA 95 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ka9 n GLU 96 N -1.09 -1.75 -4.92 0.00 1.02 -1.17 -4.88 120.64 107.84 2ka9 n GLU 96 Ca -0.01 1.28 -0.27 0.00 -0.02 0.00 0.00 57.16 58.14 2ka9 n GLU 96 Cb 0.51 -1.42 -0.16 0.00 -0.02 0.00 0.00 31.44 30.34 2ka9 n GLU 96 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2ka9 s LYS 97 N -4.10 1.95 -0.40 3.49 2.36 -1.25 -4.92 119.74 116.88 2ka9 s LYS 97 Ca 0.00 -0.67 -0.25 0.00 -2.55 0.00 0.00 55.97 52.50 2ka9 s LYS 97 Cb 0.00 -1.68 0.02 0.00 -1.05 0.00 0.00 37.83 35.12 2ka9 s LYS 97 CO 0.00 0.27 0.90 0.08 1.55 0.00 0.00 175.35 178.15 2ka9 s VAL 98 N 0.01 4.57 0.59 4.02 1.01 -1.26 0.01 120.40 129.35 2ka9 s VAL 98 Ca -0.04 0.99 -0.04 0.00 0.00 0.00 0.00 61.98 62.88 2ka9 s VAL 98 Cb -0.12 -4.35 0.02 0.00 0.00 0.00 0.00 36.38 31.93 2ka9 s VAL 98 CO 0.03 -0.62 0.88 -0.04 0.00 0.00 0.00 175.10 175.34 2ka9 s MET 99 N 3.51 2.74 -0.24 2.72 -1.94 0.24 -4.92 119.30 121.42 2ka9 s MET 99 Ca 0.37 -0.21 -0.02 0.00 -1.71 0.00 0.00 55.69 54.11 2ka9 s MET 99 Cb -0.11 -2.31 0.07 0.00 2.01 0.00 0.00 34.83 34.49 2ka9 s MET 99 CO 0.21 -0.76 0.06 -1.21 -0.01 0.00 0.00 175.02 173.31 2ka9 s GLU 100 N -4.96 0.68 0.20 2.03 8.01 -1.26 -1.67 118.70 121.73 2ka9 s GLU 100 Ca 0.55 -0.64 0.10 0.00 0.01 0.00 0.00 54.97 54.98 2ka9 s GLU 100 Cb -0.10 -2.03 -0.04 0.00 -4.31 0.00 0.00 34.13 27.64 2ka9 s GLU 100 CO 0.43 -0.77 -0.14 0.42 0.01 0.00 0.00 175.26 175.22 2ka9 s ILE 101 N 1.79 2.90 -0.22 -1.63 -1.09 -0.27 -4.96 121.20 117.71 2ka9 s ILE 101 Ca 0.03 -1.86 -0.07 0.00 -2.23 0.00 0.00 60.65 56.52 2ka9 s ILE 101 Cb -0.17 -2.44 -0.03 0.00 -1.58 0.00 0.00 42.46 38.24 2ka9 s ILE 101 CO -0.15 -0.16 0.05 -0.75 -1.23 0.00 0.00 174.94 172.70 2ka9 s LYS 102 N -2.91 3.72 -0.17 2.79 2.20 -1.26 0.12 119.74 124.22 2ka9 s LYS 102 Ca 0.25 -0.46 0.01 0.00 -0.36 0.00 0.00 55.97 55.40 2ka9 s LYS 102 Cb -0.08 -3.23 0.03 0.00 -1.51 0.00 0.00 37.83 33.04 2ka9 s LYS 102 CO 0.14 -0.03 -0.15 -1.17 -0.36 0.00 0.00 175.35 173.78 2ka9 s LEU 103 N 1.16 2.02 -0.04 5.43 0.20 0.12 -3.23 118.68 124.33 2ka9 s LEU 103 Ca 0.04 -0.65 -0.04 0.00 0.69 0.00 0.00 54.13 54.17 2ka9 s LEU 103 Cb -0.14 -1.30 -0.04 0.00 -0.43 0.00 0.00 46.19 44.28 2ka9 s LEU 103 CO 0.03 -0.06 0.17 0.27 -0.29 0.00 0.00 176.35 176.47 2ka9 s ILE 104 N 1.39 5.44 0.80 6.68 -4.36 -1.26 -1.68 121.20 128.22 2ka9 s ILE 104 Ca 0.03 -0.08 -0.11 0.00 -0.26 0.00 0.00 60.65 60.23 2ka9 s ILE 104 Cb -0.14 -3.50 0.07 0.00 1.25 0.00 0.00 42.46 40.14 2ka9 s ILE 104 CO -0.11 0.39 1.09 -0.75 0.24 0.00 0.00 174.94 175.80 2ka9 s LYS 105 N -1.73 2.07 0.09 0.37 2.20 0.28 -4.39 119.74 118.64 2ka9 s LYS 105 Ca 0.24 0.90 -0.01 0.00 -0.36 0.00 0.00 55.97 56.75 2ka9 s LYS 105 Cb -0.12 -1.89 -0.04 0.00 -1.51 0.00 0.00 37.83 34.26 2ka9 s LYS 105 CO 0.15 -1.70 -0.01 0.20 -0.36 0.00 0.00 175.35 173.63 2ka9 s GLY 106 N -3.60 0.71 0.29 5.54 0.00 0.41 -4.92 107.32 105.75 2ka9 s GLY 106 Ca 0.61 -1.33 0.02 0.00 0.00 0.00 0.00 44.72 44.02 2ka9 s GLY 106 CO 0.56 -1.36 1.86 -2.55 0.00 0.00 0.00 173.10 171.61 2ka9 h PRO 107 N 3.02 0.96 -0.74 2.90 0.11 -2.00 0.27 132.00 136.52 2ka9 h PRO 107 Ca -0.35 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 65.63 2ka9 h PRO 107 Cb 1.16 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 32.01 2ka9 h PRO 107 CO 0.64 0.64 0.10 1.63 -0.21 0.00 0.00 178.00 180.79 2ka9 n LYS 108 N -4.57 3.64 0.00 1.05 4.76 -1.26 -5.02 118.16 116.76 2ka9 n LYS 108 Ca 0.17 -2.42 0.00 0.00 -2.87 0.00 0.00 58.31 53.19 2ka9 n LYS 108 Cb 0.31 -2.06 0.00 0.00 -1.84 0.00 0.00 35.03 31.44 2ka9 n LYS 108 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ka9 n GLY 109 N 0.24 -0.62 0.05 0.72 0.00 0.95 -4.47 105.19 102.06 2ka9 n GLY 109 Ca 0.26 -2.00 0.12 0.00 0.00 0.00 0.00 46.02 44.41 2ka9 n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ka9 n LEU 110 N 0.00 0.60 -1.64 0.99 4.32 -1.26 0.15 117.00 120.17 2ka9 n LEU 110 Ca 0.00 0.28 -0.04 0.00 -0.02 0.00 0.00 56.01 56.23 2ka9 n LEU 110 Cb 0.00 -0.26 0.02 0.00 -1.62 0.00 0.00 43.42 41.56 2ka9 n LEU 110 CO 0.00 -0.04 0.02 0.61 -1.22 0.00 0.00 177.39 176.77 2ka9 n GLY 111 N 1.38 0.28 3.62 -0.72 0.00 -1.26 -3.44 105.19 105.05 2ka9 n GLY 111 Ca 0.05 -0.29 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 2ka9 n GLY 111 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ka9 s PHE 112 N -3.09 -0.10 -0.21 1.61 -0.71 -1.26 -3.72 117.98 110.51 2ka9 s PHE 112 Ca 0.02 0.13 -0.01 0.00 -1.04 0.00 0.00 56.93 56.03 2ka9 s PHE 112 Cb -0.00 0.50 0.01 0.00 -1.21 0.00 0.00 43.02 42.31 2ka9 s PHE 112 CO 0.17 -0.12 -0.12 0.45 -1.34 0.00 0.00 175.22 174.26 2ka9 s SER 113 N -1.55 3.78 0.18 1.98 0.15 0.55 -4.97 113.70 113.82 2ka9 s SER 113 Ca 0.08 -0.58 0.08 0.00 0.70 0.00 0.00 55.95 56.23 2ka9 s SER 113 Cb -0.01 -1.61 -0.04 0.00 -1.71 0.00 0.00 66.02 62.65 2ka9 s SER 113 CO -0.05 -0.03 -0.17 0.27 1.20 0.00 0.00 173.24 174.46 2ka9 s ILE 114 N 1.37 1.82 -0.22 6.45 -4.36 -1.26 0.46 121.20 125.46 2ka9 s ILE 114 Ca 0.05 -1.99 -0.10 0.00 -0.26 0.00 0.00 60.65 58.34 2ka9 s ILE 114 Cb -0.14 -1.89 0.08 0.00 1.25 0.00 0.00 42.46 41.76 2ka9 s ILE 114 CO -0.08 -0.38 0.51 0.00 0.24 0.00 0.00 174.94 175.23 2ka9 s ALA 115 N -2.26 -1.42 0.20 2.27 0.00 -0.25 -4.91 121.76 115.39 2ka9 s ALA 115 Ca 0.17 1.85 -0.16 0.00 0.00 0.00 0.00 51.96 53.83 2ka9 s ALA 115 Cb -0.05 -1.29 0.02 0.00 0.00 0.00 0.00 23.12 21.80 2ka9 s ALA 115 CO 0.07 -0.54 0.49 0.20 0.00 0.00 0.00 175.76 175.97 2ka9 s GLY 116 N 2.05 0.10 0.00 0.00 0.00 -1.26 -2.36 107.32 105.86 2ka9 s GLY 116 Ca -0.07 -0.44 0.00 0.00 0.00 0.00 0.00 44.72 44.21 2ka9 s GLY 116 CO -0.15 -0.40 0.00 0.61 0.00 0.00 0.00 173.10 173.15 2ka9 n GLY 117 N -0.33 1.25 3.83 0.20 0.00 0.30 -4.24 105.19 106.19 2ka9 n GLY 117 Ca -0.08 -0.56 -0.26 0.00 0.00 0.00 0.00 46.02 45.11 2ka9 n GLY 117 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ka9 s VAL 118 N 0.00 4.67 0.00 1.61 1.01 -1.26 -4.35 120.40 122.07 2ka9 s VAL 118 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2ka9 s VAL 118 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.99 2ka9 s VAL 118 CO 0.00 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.60 2ka9 n GLY 119 N -0.39 2.66 0.00 4.51 0.00 -1.26 0.11 105.19 110.82 2ka9 n GLY 119 Ca -0.08 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.10 2ka9 n GLY 119 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ka9 n ASN 120 N 0.23 0.00 -4.45 1.61 3.02 -1.26 -5.01 115.26 109.39 2ka9 n ASN 120 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2ka9 n ASN 120 Cb 0.00 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 2ka9 n ASN 120 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ka9 s GLN 121 N 0.00 3.06 0.44 3.52 1.03 -1.26 -4.49 119.66 121.96 2ka9 s GLN 121 Ca 0.00 -0.94 0.26 0.00 0.04 0.00 0.00 55.36 54.71 2ka9 s GLN 121 Cb 0.00 -3.87 1.39 0.00 0.03 0.00 0.00 33.01 30.56 2ka9 s GLN 121 CO 0.00 -0.66 1.76 1.12 -2.54 0.00 0.00 175.29 174.97 2ka9 h HIS 122 N 8.54 0.00 -3.12 9.60 2.07 -1.95 -3.38 115.15 126.92 2ka9 h HIS 122 Ca -0.28 0.00 -0.63 0.00 -2.85 0.00 0.00 60.37 56.62 2ka9 h HIS 122 Cb 1.13 0.00 -0.13 0.00 2.57 0.00 0.00 27.41 30.97 2ka9 h HIS 122 CO 0.58 0.00 0.47 0.42 -3.07 0.00 0.00 177.93 176.34 2ka9 s ILE 123 N -3.69 4.46 -0.70 6.12 1.01 -1.26 -4.97 121.20 122.17 2ka9 s ILE 123 Ca -0.03 0.04 -0.25 0.00 0.00 0.00 0.00 60.65 60.42 2ka9 s ILE 123 Cb 0.07 -4.52 -0.13 0.00 0.01 0.00 0.00 42.46 37.89 2ka9 s ILE 123 CO 0.23 -1.12 2.42 -0.81 0.00 0.00 0.00 174.94 175.66 2ka9 n PRO 124 N 7.29 0.67 -2.20 2.79 -0.04 -1.26 -1.84 135.00 140.41 2ka9 n PRO 124 Ca -0.01 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 2ka9 n PRO 124 Cb 0.47 -3.25 0.00 0.00 -0.04 0.00 0.00 33.50 30.68 2ka9 n PRO 124 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ka9 n GLY 125 N 6.37 0.73 2.49 0.55 0.00 -1.26 -5.05 105.19 109.02 2ka9 n GLY 125 Ca 0.46 -0.57 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 2ka9 n GLY 125 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ka9 s ASP 126 N -2.95 1.83 0.59 1.61 -1.08 -0.77 -4.97 116.67 110.93 2ka9 s ASP 126 Ca 0.00 -2.44 0.29 0.00 -0.52 0.00 0.00 52.55 49.89 2ka9 s ASP 126 Cb 0.00 -0.15 1.32 0.00 -1.46 0.00 0.00 42.92 42.63 2ka9 s ASP 126 CO 0.00 -0.23 1.69 0.78 0.52 0.00 0.00 175.17 177.93 2ka9 h ASN 127 N 6.35 0.00 -3.52 -0.34 2.35 -1.86 -3.39 115.58 115.18 2ka9 h ASN 127 Ca 0.14 0.00 -0.50 0.00 -0.55 0.00 0.00 56.30 55.39 2ka9 h ASN 127 Cb 0.97 0.00 0.21 0.00 0.05 0.00 0.00 38.32 39.55 2ka9 h ASN 127 CO 0.28 0.00 -0.31 -1.20 -1.65 0.00 0.00 177.43 174.56 2ka9 n SER 128 N -3.59 -1.28 -4.67 5.81 7.64 -1.26 0.11 113.62 116.38 2ka9 n SER 128 Ca 0.15 0.23 -0.38 0.00 1.01 0.00 0.00 58.87 59.89 2ka9 n SER 128 Cb 1.02 -1.27 -0.08 0.00 -1.01 0.00 0.00 64.21 62.87 2ka9 n SER 128 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ka9 s ILE 129 N -2.46 5.25 0.29 0.44 1.01 -1.10 -3.64 121.20 121.00 2ka9 s ILE 129 Ca 0.62 0.53 0.10 0.00 0.00 0.00 0.00 60.65 61.90 2ka9 s ILE 129 Cb -0.21 -3.65 -0.05 0.00 0.01 0.00 0.00 42.46 38.56 2ka9 s ILE 129 CO 0.64 0.28 -0.07 -0.31 0.00 0.00 0.00 174.94 175.49 2ka9 s TYR 130 N 1.21 2.52 0.09 3.97 1.51 -0.99 -0.15 117.35 125.50 2ka9 s TYR 130 Ca 0.15 -0.32 -0.12 0.00 -1.01 0.00 0.00 57.07 55.78 2ka9 s TYR 130 Cb -0.14 -1.21 -0.06 0.00 -0.11 0.00 0.00 41.96 40.44 2ka9 s TYR 130 CO 0.07 0.62 0.44 0.08 -1.11 0.00 0.00 175.55 175.65 2ka9 s VAL 131 N -2.44 5.02 -0.07 0.71 1.01 -0.42 -1.09 120.40 123.12 2ka9 s VAL 131 Ca 0.32 0.59 -0.03 0.00 0.00 0.00 0.00 61.98 62.86 2ka9 s VAL 131 Cb -0.04 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 2ka9 s VAL 131 CO 0.18 0.30 -0.09 1.07 0.00 0.00 0.00 175.10 176.56 2ka9 n THR 132 N 0.95 0.38 -3.83 3.92 5.66 0.17 -3.89 114.28 117.64 2ka9 n THR 132 Ca -0.08 -0.10 -0.12 0.00 -3.05 0.00 0.00 64.05 60.70 2ka9 n THR 132 Cb 0.52 -1.53 -0.11 0.00 -1.55 0.00 0.00 70.33 67.66 2ka9 n THR 132 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 2ka9 s LYS 133 N -2.13 0.33 -0.00 1.09 2.36 -1.02 -4.90 119.74 115.47 2ka9 s LYS 133 Ca -0.10 -0.02 0.01 0.00 -2.55 0.00 0.00 55.97 53.32 2ka9 s LYS 133 Cb 0.04 0.15 -0.00 0.00 -1.05 0.00 0.00 37.83 36.96 2ka9 s LYS 133 CO 0.12 -0.06 -0.04 0.42 1.55 0.00 0.00 175.35 177.34 2ka9 s ILE 134 N -0.53 0.32 0.81 5.43 1.01 -1.26 0.21 121.20 127.19 2ka9 s ILE 134 Ca -0.06 -0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.32 2ka9 s ILE 134 Cb -0.04 -0.27 0.11 0.00 0.01 0.00 0.00 42.46 42.27 2ka9 s ILE 134 CO 0.01 0.09 1.15 -0.63 0.00 0.00 0.00 174.94 175.56 2ka9 s ILE 135 N -0.08 2.10 0.16 2.92 1.01 -1.24 -5.01 121.20 121.06 2ka9 s ILE 135 Ca 0.01 -0.15 -0.11 0.00 0.00 0.00 0.00 60.65 60.41 2ka9 s ILE 135 Cb -0.02 -2.95 -0.07 0.00 0.01 0.00 0.00 42.46 39.43 2ka9 s ILE 135 CO -0.00 0.00 0.50 -0.70 0.00 0.00 0.00 174.94 174.74 2ka9 s GLU 136 N -5.52 3.83 -1.63 2.79 2.12 -1.26 -4.11 118.70 114.92 2ka9 s GLU 136 Ca 0.65 0.28 0.00 0.00 0.36 0.00 0.00 54.97 56.27 2ka9 s GLU 136 Cb -0.08 -2.84 0.00 0.00 0.26 0.00 0.00 34.13 31.47 2ka9 s GLU 136 CO 0.48 0.44 0.00 0.41 -0.54 0.00 0.00 175.26 176.05 2ka9 n GLY 137 N 0.42 0.01 3.95 -1.50 0.00 -1.26 -4.96 105.19 101.85 2ka9 n GLY 137 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 2ka9 n GLY 137 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ka9 s GLY 138 N -2.16 1.80 -0.01 -0.02 0.00 -1.26 -4.88 107.32 100.80 2ka9 s GLY 138 Ca 0.00 -1.38 -0.22 0.00 0.00 0.00 0.00 44.72 43.12 2ka9 s GLY 138 CO 0.00 -0.61 0.92 0.00 0.00 0.00 0.00 173.10 173.41 2ka9 h ALA 139 N -1.50 -0.79 -0.13 3.20 0.00 -1.84 -2.57 119.26 115.64 2ka9 h ALA 139 Ca -0.42 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.19 2ka9 h ALA 139 Cb 1.23 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 2ka9 h ALA 139 CO 0.35 -0.74 -0.47 0.00 0.00 0.00 0.00 179.25 178.40 2ka9 h ALA 140 N -1.19 0.97 0.76 0.00 0.00 -1.76 0.30 119.26 118.33 2ka9 h ALA 140 Ca -0.08 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2ka9 h ALA 140 Cb 0.61 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2ka9 h ALA 140 CO 0.13 0.64 -0.49 1.25 0.00 0.00 0.00 179.25 180.78 2ka9 h HIS 141 N 0.25 -1.32 -0.16 0.00 6.17 -1.81 1.38 115.15 119.67 2ka9 h HIS 141 Ca 0.02 -0.01 -0.18 0.00 0.71 0.00 0.00 60.37 60.91 2ka9 h HIS 141 Cb 0.92 0.48 0.01 0.00 2.52 0.00 0.00 27.41 31.34 2ka9 h HIS 141 CO 0.02 -0.72 -0.60 -0.22 0.71 0.00 0.00 177.93 177.12 2ka9 h LYS 142 N -1.18 0.69 0.00 5.26 1.63 -1.49 -1.39 116.57 120.09 2ka9 h LYS 142 Ca -0.10 -0.53 -0.00 0.00 -0.85 0.00 0.00 60.65 59.17 2ka9 h LYS 142 Cb 0.95 0.10 -0.00 0.00 -0.60 0.00 0.00 32.23 32.68 2ka9 h LYS 142 CO 0.08 1.15 -0.03 0.22 -3.45 0.00 0.00 179.45 177.42 2ka9 h ASP 143 N 0.38 0.00 0.45 4.20 1.82 -0.41 -3.37 116.42 119.48 2ka9 h ASP 143 Ca -0.03 -0.05 -0.11 0.00 -0.39 0.00 0.00 57.03 56.44 2ka9 h ASP 143 Cb 1.23 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.22 2ka9 h ASP 143 CO 0.13 0.54 -0.51 1.23 -1.61 0.00 0.00 179.24 179.02 2ka9 h GLY 144 N -1.00 0.08 -1.22 -0.78 0.00 0.15 -3.45 103.07 96.85 2ka9 h GLY 144 Ca -0.00 -0.09 -0.42 0.00 0.00 0.00 0.00 47.33 46.82 2ka9 h GLY 144 CO -0.00 0.08 -0.40 0.54 0.00 0.00 0.00 176.54 176.76 2ka9 n ARG 145 N -3.94 -1.48 -3.09 4.80 3.00 0.24 -4.86 116.66 111.33 2ka9 n ARG 145 Ca -0.02 1.20 -0.44 0.00 -0.01 0.00 0.00 57.85 58.58 2ka9 n ARG 145 Cb 0.53 -5.61 -0.01 0.00 0.00 0.00 0.00 32.46 27.37 2ka9 n ARG 145 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 2ka9 s LEU 146 N -4.87 5.55 1.15 0.55 2.34 -1.24 -5.03 118.68 117.13 2ka9 s LEU 146 Ca 0.00 -3.01 -0.16 0.00 0.06 0.00 0.00 54.13 51.02 2ka9 s LEU 146 Cb 0.00 -2.33 0.26 0.00 -0.56 0.00 0.00 46.19 43.56 2ka9 s LEU 146 CO 0.00 -0.65 1.06 0.00 -1.06 0.00 0.00 176.35 175.70 2ka9 s GLN 147 N 0.82 -0.81 -0.20 1.48 -2.07 -1.26 -4.71 119.66 112.90 2ka9 s GLN 147 Ca 0.36 0.37 -0.40 0.00 -1.82 0.00 0.00 55.36 53.88 2ka9 s GLN 147 Cb -0.06 -1.60 -0.16 0.00 -1.09 0.00 0.00 33.01 30.10 2ka9 s GLN 147 CO -0.04 -3.53 1.64 -0.89 -1.32 0.00 0.00 175.29 171.14 2ka9 n ILE 148 N -4.71 0.22 0.00 3.63 5.41 -1.26 -2.15 119.36 120.50 2ka9 n ILE 148 Ca 0.07 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.78 2ka9 n ILE 148 Cb 0.58 -1.08 0.00 0.00 -0.71 0.00 0.00 39.64 38.42 2ka9 n ILE 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ka9 n GLY 149 N 3.77 1.57 3.74 7.39 0.00 -1.25 -5.05 105.19 115.36 2ka9 n GLY 149 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 2ka9 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ka9 s ASP 150 N -1.24 6.60 -0.15 1.61 1.11 -0.91 -4.70 116.67 118.99 2ka9 s ASP 150 Ca 0.00 2.71 0.02 0.00 0.18 0.00 0.00 52.55 55.46 2ka9 s ASP 150 Cb 0.00 -2.62 0.01 0.00 1.07 0.00 0.00 42.92 41.38 2ka9 s ASP 150 CO 0.00 -0.75 -0.21 -1.59 1.18 0.00 0.00 175.17 173.80 2ka9 s LYS 151 N -0.25 3.05 -0.18 8.23 0.00 -1.26 -1.30 119.74 128.03 2ka9 s LYS 151 Ca 0.61 -0.84 -0.07 0.00 0.00 0.00 0.00 55.97 55.67 2ka9 s LYS 151 Cb -0.43 -2.47 -0.04 0.00 0.00 0.00 0.00 37.83 34.89 2ka9 s LYS 151 CO 0.43 -0.02 0.05 0.96 0.00 0.00 0.00 175.35 176.77 2ka9 s ILE 152 N 0.85 4.69 -2.87 3.79 -5.25 0.78 0.60 121.20 123.79 2ka9 s ILE 152 Ca -0.06 -0.07 0.24 0.00 -0.99 0.00 0.00 60.65 59.78 2ka9 s ILE 152 Cb -0.15 -3.11 0.23 0.00 2.95 0.00 0.00 42.46 42.37 2ka9 s ILE 152 CO -0.02 0.46 1.32 0.00 -1.79 0.00 0.00 174.94 174.90 2ka9 n LEU 153 N 3.60 2.73 -3.56 0.37 -0.00 0.30 -2.70 117.00 117.74 2ka9 n LEU 153 Ca -0.17 -0.91 0.03 0.00 -0.00 0.00 0.00 56.01 54.96 2ka9 n LEU 153 Cb 0.52 -0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.94 2ka9 n LEU 153 CO 0.35 0.46 1.21 0.00 -0.00 0.00 0.00 177.39 179.41 2ka9 s ALA 154 N -2.03 -2.48 -0.32 1.47 0.00 -1.22 -4.67 121.76 112.51 2ka9 s ALA 154 Ca 0.29 1.04 0.01 0.00 0.00 0.00 0.00 51.96 53.30 2ka9 s ALA 154 Cb 0.20 0.18 0.10 0.00 0.00 0.00 0.00 23.12 23.60 2ka9 s ALA 154 CO 0.32 -1.02 0.07 0.08 0.00 0.00 0.00 175.76 175.22 2ka9 s VAL 155 N -2.04 1.48 0.00 0.00 1.01 -0.64 -1.25 120.40 118.96 2ka9 s VAL 155 Ca 0.15 -1.80 0.00 0.00 0.00 0.00 0.00 61.98 60.33 2ka9 s VAL 155 Cb 0.07 -2.10 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2ka9 s VAL 155 CO -0.06 -0.63 0.00 0.59 0.00 0.00 0.00 175.10 175.00 2ka9 n ASN 156 N 4.59 0.00 -0.67 3.32 3.02 0.16 -1.68 115.26 124.01 2ka9 n ASN 156 Ca 0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.52 2ka9 n ASN 156 Cb 0.42 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 2ka9 n ASN 156 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2ka9 n SER 157 N 1.88 -0.44 -4.51 6.41 2.88 -1.26 -4.95 113.62 113.63 2ka9 n SER 157 Ca 0.00 -1.03 -0.27 0.00 -1.33 0.00 0.00 58.87 56.24 2ka9 n SER 157 Cb 0.00 0.13 -0.10 0.00 -0.75 0.00 0.00 64.21 63.49 2ka9 n SER 157 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2ka9 s VAL 158 N 0.00 2.86 -0.84 2.46 1.01 -0.67 -5.08 120.40 120.14 2ka9 s VAL 158 Ca 0.00 -1.80 0.01 0.00 0.00 0.00 0.00 61.98 60.19 2ka9 s VAL 158 Cb 0.00 -2.40 0.22 0.00 0.00 0.00 0.00 36.38 34.20 2ka9 s VAL 158 CO 0.00 -0.11 0.78 0.61 0.00 0.00 0.00 175.10 176.38 2ka9 n GLY 159 N 0.14 4.29 0.74 4.51 0.00 -1.26 -1.62 105.19 111.98 2ka9 n GLY 159 Ca -0.11 -2.63 0.00 0.00 0.00 0.00 0.00 46.02 43.28 2ka9 n GLY 159 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ka9 n LEU 160 N 1.94 1.78 -2.36 0.99 4.77 -1.26 -3.57 117.00 119.28 2ka9 n LEU 160 Ca 0.23 -0.89 -0.15 0.00 -0.03 0.00 0.00 56.01 55.17 2ka9 n LEU 160 Cb 0.37 -0.46 0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2ka9 n LEU 160 CO 0.38 0.34 0.10 -1.84 -1.33 0.00 0.00 177.39 175.04 2ka9 n GLU 161 N 0.28 2.85 -0.98 3.23 0.28 -1.26 -4.55 120.64 120.49 2ka9 n GLU 161 Ca 0.00 -3.93 -0.04 0.00 -0.16 0.00 0.00 57.16 53.03 2ka9 n GLU 161 Cb 0.34 -2.00 -0.04 0.00 1.43 0.00 0.00 31.44 31.16 2ka9 n GLU 161 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2ka9 n ASP 162 N -0.62 -0.50 0.00 -1.84 8.00 -1.23 -4.70 116.55 115.66 2ka9 n ASP 162 Ca 0.29 -1.84 0.00 0.00 0.71 0.00 0.00 54.79 53.96 2ka9 n ASP 162 Cb 0.88 0.14 0.00 0.00 -0.02 0.00 0.00 41.12 42.12 2ka9 n ASP 162 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2ka9 n VAL 163 N 0.08 0.00 0.00 2.53 0.31 -1.26 -5.11 118.33 114.87 2ka9 n VAL 163 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2ka9 n VAL 163 Cb 0.74 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 2ka9 n VAL 163 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2ka9 n MET 164 N -1.17 0.00 -0.03 5.55 2.81 -1.26 -4.65 117.12 118.36 2ka9 n MET 164 Ca 0.00 0.00 0.22 0.00 -1.81 0.00 0.00 57.70 56.11 2ka9 n MET 164 Cb 0.00 0.00 0.70 0.00 -0.71 0.00 0.00 33.22 33.21 2ka9 n MET 164 CO 0.00 0.00 0.00 1.12 1.51 0.00 0.00 175.97 178.60 2ka9 h HIS 165 N 0.00 0.00 -0.03 2.03 2.07 -0.51 -0.01 115.15 118.70 2ka9 h HIS 165 Ca 0.00 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.48 2ka9 h HIS 165 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2ka9 h HIS 165 CO 0.00 0.00 -0.14 0.93 -3.07 0.00 0.00 177.93 175.65 2ka9 h GLU 166 N 0.00 0.15 -0.37 5.12 5.08 -1.94 -0.52 114.58 122.10 2ka9 h GLU 166 Ca 0.28 -0.12 -0.13 0.00 -1.00 0.00 0.00 59.36 58.40 2ka9 h GLU 166 Cb 1.16 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2ka9 h GLU 166 CO -0.00 0.78 -0.28 0.22 -1.00 0.00 0.00 179.01 178.72 2ka9 h ASP 167 N -0.45 0.81 -0.24 1.42 1.82 -1.71 0.45 116.42 118.52 2ka9 h ASP 167 Ca -0.01 -0.32 -0.16 0.00 -0.39 0.00 0.00 57.03 56.15 2ka9 h ASP 167 Cb 0.81 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 40.59 2ka9 h ASP 167 CO 0.03 1.04 -0.45 0.00 -1.61 0.00 0.00 179.24 178.25 2ka9 h ALA 168 N 1.01 0.62 -0.22 -0.78 0.00 -1.11 0.24 119.26 119.02 2ka9 h ALA 168 Ca 0.08 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2ka9 h ALA 168 Cb 0.82 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2ka9 h ALA 168 CO 0.07 0.68 -0.04 0.28 0.00 0.00 0.00 179.25 180.23 2ka9 h VAL 169 N 0.64 1.28 0.00 0.00 2.07 -0.91 -0.90 116.25 118.44 2ka9 h VAL 169 Ca 0.04 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.48 2ka9 h VAL 169 Cb 1.02 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 2ka9 h VAL 169 CO 0.10 0.31 -0.29 0.00 0.02 0.00 0.00 177.57 177.72 2ka9 h ALA 170 N 0.75 1.29 0.00 1.67 0.00 -0.87 -2.19 119.26 119.90 2ka9 h ALA 170 Ca 0.06 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2ka9 h ALA 170 Cb 0.49 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2ka9 h ALA 170 CO 0.02 0.36 -0.49 0.00 0.00 0.00 0.00 179.25 179.14 2ka9 h ALA 171 N 1.71 0.75 0.23 0.00 0.00 -0.66 -0.87 119.26 120.43 2ka9 h ALA 171 Ca -0.00 -0.44 -0.33 0.00 0.00 0.00 0.00 54.91 54.13 2ka9 h ALA 171 Cb 0.60 -0.08 0.04 0.00 0.00 0.00 0.00 17.79 18.35 2ka9 h ALA 171 CO 0.04 0.61 -1.43 1.37 0.00 0.00 0.00 179.25 179.84 2ka9 h LEU 172 N 0.00 0.87 -0.48 0.00 8.10 -0.66 -3.11 115.31 120.03 2ka9 h LEU 172 Ca -0.00 -0.89 -0.11 0.00 0.11 0.00 0.00 57.88 56.98 2ka9 h LEU 172 Cb 1.25 -0.28 -0.02 0.00 -0.44 0.00 0.00 40.66 41.17 2ka9 h LEU 172 CO 0.06 1.69 -0.52 0.11 -4.11 0.00 0.00 178.44 175.68 2ka9 h LYS 173 N 0.18 0.00 -0.18 0.17 1.57 -1.45 -3.19 116.57 113.67 2ka9 h LYS 173 Ca -0.24 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.44 2ka9 h LYS 173 Cb 2.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.41 2ka9 h LYS 173 CO 0.27 0.52 -0.33 -0.91 -0.57 0.00 0.00 179.45 178.43 2ka9 h ASN 174 N 0.00 0.38 -1.87 0.86 2.35 -1.19 -3.45 115.58 112.66 2ka9 h ASN 174 Ca -0.01 -0.14 -0.18 0.00 -0.55 0.00 0.00 56.30 55.42 2ka9 h ASN 174 Cb 1.20 -0.10 0.11 0.00 0.05 0.00 0.00 38.32 39.57 2ka9 h ASN 174 CO 0.07 0.69 -0.09 0.35 -1.65 0.00 0.00 177.43 176.80 2ka9 n THR 175 N -4.08 0.00 -2.80 2.81 -2.24 -1.17 -5.01 114.28 101.79 2ka9 n THR 175 Ca -0.01 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.57 2ka9 n THR 175 Cb 0.44 -0.49 0.03 0.00 -2.10 0.00 0.00 70.33 68.21 2ka9 n THR 175 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2ka9 s TYR 176 N -1.74 2.89 0.18 4.78 5.04 -1.26 -4.97 117.35 122.27 2ka9 s TYR 176 Ca 0.33 -0.10 0.25 0.00 -2.44 0.00 0.00 57.07 55.12 2ka9 s TYR 176 Cb -0.06 -2.58 1.39 0.00 0.35 0.00 0.00 41.96 41.06 2ka9 s TYR 176 CO 0.28 -0.67 1.76 0.22 -1.34 0.00 0.00 175.55 175.79 2ka9 h ASP 177 N 0.28 0.00 -1.95 4.32 3.58 -1.93 -3.33 116.42 117.39 2ka9 h ASP 177 Ca -0.42 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 56.66 2ka9 h ASP 177 Cb 1.29 0.00 -0.31 0.00 1.72 0.00 0.00 39.33 42.03 2ka9 h ASP 177 CO 0.51 0.00 -0.69 -0.69 -2.88 0.00 0.00 179.24 175.49 2ka9 s VAL 178 N -3.71 -0.32 0.08 2.25 1.01 -1.26 0.10 120.40 118.56 2ka9 s VAL 178 Ca -0.03 -1.01 0.08 0.00 0.00 0.00 0.00 61.98 61.02 2ka9 s VAL 178 Cb 0.07 -0.68 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 2ka9 s VAL 178 CO 0.23 -0.59 -0.21 0.68 0.00 0.00 0.00 175.10 175.21 2ka9 s VAL 179 N 1.41 1.73 -0.15 2.92 -7.23 -0.68 -4.95 120.40 113.46 2ka9 s VAL 179 Ca 0.17 -1.44 -0.15 0.00 -1.81 0.00 0.00 61.98 58.75 2ka9 s VAL 179 Cb -0.15 -1.55 -0.05 0.00 0.56 0.00 0.00 36.38 35.19 2ka9 s VAL 179 CO -0.03 0.04 0.34 -0.72 -0.31 0.00 0.00 175.10 174.42 2ka9 s TYR 180 N -1.03 3.48 0.19 2.82 -0.85 -1.26 0.12 117.35 120.82 2ka9 s TYR 180 Ca 0.07 0.68 0.06 0.00 -0.52 0.00 0.00 57.07 57.37 2ka9 s TYR 180 Cb -0.10 -2.39 -0.04 0.00 0.38 0.00 0.00 41.96 39.81 2ka9 s TYR 180 CO 0.03 0.23 0.08 -0.48 -1.52 0.00 0.00 175.55 173.90 2ka9 s LEU 181 N 0.46 3.58 -0.35 -3.49 2.34 0.32 0.38 118.68 121.92 2ka9 s LEU 181 Ca 0.19 -0.28 -0.16 0.00 0.06 0.00 0.00 54.13 53.94 2ka9 s LEU 181 Cb -0.14 -2.18 -0.01 0.00 -0.56 0.00 0.00 46.19 43.30 2ka9 s LEU 181 CO 0.06 0.06 0.39 -0.75 -1.06 0.00 0.00 176.35 175.05 2ka9 s LYS 182 N -3.19 3.53 0.27 1.48 2.20 -0.38 -1.11 119.74 122.54 2ka9 s LYS 182 Ca 0.30 -0.40 0.06 0.00 -0.36 0.00 0.00 55.97 55.57 2ka9 s LYS 182 Cb -0.09 -3.82 -0.03 0.00 -1.51 0.00 0.00 37.83 32.38 2ka9 s LYS 182 CO 0.22 -0.57 0.33 0.08 -0.36 0.00 0.00 175.35 175.05 2ka9 s VAL 183 N 2.09 4.60 -0.06 4.02 1.01 -0.67 -0.54 120.40 130.86 2ka9 s VAL 183 Ca 0.13 -1.14 0.06 0.00 0.00 0.00 0.00 61.98 61.03 2ka9 s VAL 183 Cb -0.16 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.63 2ka9 s VAL 183 CO 0.12 -0.28 -0.25 0.00 0.00 0.00 0.00 175.10 174.69 2ka9 s ALA 184 N -2.10 2.19 0.06 5.51 0.00 0.20 0.81 121.76 128.43 2ka9 s ALA 184 Ca 0.37 -1.05 -0.21 0.00 0.00 0.00 0.00 51.96 51.07 2ka9 s ALA 184 Cb -0.08 -0.68 -0.06 0.00 0.00 0.00 0.00 23.12 22.29 2ka9 s ALA 184 CO 0.28 0.43 0.61 0.15 0.00 0.00 0.00 175.76 177.23 2ka9 s LYS 185 N -0.21 4.29 -0.96 0.00 1.02 0.10 -4.36 119.74 119.62 2ka9 s LYS 185 Ca -0.02 0.80 -0.27 0.00 0.02 0.00 0.00 55.97 56.50 2ka9 s LYS 185 Cb -0.13 -3.27 -0.24 0.00 -0.52 0.00 0.00 37.83 33.67 2ka9 s LYS 185 CO 0.03 0.54 2.02 -2.30 -0.92 0.00 0.00 175.35 174.73 2ka9 n PRO 186 N 2.03 0.30 0.00 -1.68 -0.02 -1.26 -3.79 135.00 130.58 2ka9 n PRO 186 Ca -0.09 -1.72 0.00 0.00 -2.02 0.00 0.00 63.50 59.67 2ka9 n PRO 186 Cb 0.51 -3.72 0.00 0.00 -0.02 0.00 0.00 33.50 30.26 2ka9 n PRO 186 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2ka9 n SER 187 N 17.70 0.00 -3.48 2.55 7.64 -1.26 -3.48 113.62 133.29 2ka9 n SER 187 Ca 0.42 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.92 2ka9 n SER 187 Cb 0.46 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.59 2ka9 n SER 187 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2ka9 n ASN 188 N -1.56 1.92 0.00 6.43 0.23 -1.26 -3.07 115.26 117.96 2ka9 n ASN 188 Ca 0.00 -2.52 0.00 0.00 -0.53 0.00 0.00 54.58 51.53 2ka9 n ASN 188 Cb 0.00 -0.82 0.00 0.00 -2.08 0.00 0.00 39.78 36.88 2ka9 n ASN 188 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33