#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 0.94 0.19 0.03 2.56 0.16 -4.73 118.70 117.85 2ka9 s GLU 2 Ca 0.00 -1.41 0.10 0.00 0.00 0.00 0.00 54.97 53.67 2ka9 s GLU 2 Cb 0.00 -0.25 -0.04 0.00 2.00 0.00 0.00 34.13 35.84 2ka9 s GLU 2 CO 0.00 -0.05 -0.22 0.71 -0.56 0.00 0.00 175.26 175.14 2ka9 s TYR 3 N -3.62 2.14 -0.13 5.30 1.51 -1.26 -1.63 117.35 119.66 2ka9 s TYR 3 Ca 0.16 -0.39 -0.04 0.00 -1.01 0.00 0.00 57.07 55.79 2ka9 s TYR 3 Cb 0.05 -1.06 0.07 0.00 -0.11 0.00 0.00 41.96 40.91 2ka9 s TYR 3 CO -0.02 0.45 0.23 -1.21 -1.11 0.00 0.00 175.55 173.90 2ka9 s GLU 4 N -2.74 0.13 -0.39 -0.62 0.41 -0.86 -4.96 118.70 109.67 2ka9 s GLU 4 Ca 0.19 0.61 0.02 0.00 -0.41 0.00 0.00 54.97 55.39 2ka9 s GLU 4 Cb -0.07 -0.29 0.11 0.00 -1.78 0.00 0.00 34.13 32.11 2ka9 s GLU 4 CO 0.09 -0.36 0.15 -1.21 -0.49 0.00 0.00 175.26 173.44 2ka9 s GLU 5 N 2.38 1.35 0.00 1.61 2.02 -1.25 -0.48 118.70 124.32 2ka9 s GLU 5 Ca 0.03 -1.86 0.00 0.00 0.02 0.00 0.00 54.97 53.16 2ka9 s GLU 5 Cb -0.13 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.37 2ka9 s GLU 5 CO -0.09 -1.03 0.00 0.44 0.02 0.00 0.00 175.26 174.60 2ka9 n ILE 6 N 4.01 0.00 -5.24 -1.63 -0.00 0.95 -4.95 119.36 112.50 2ka9 n ILE 6 Ca 0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 62.75 62.47 2ka9 n ILE 6 Cb 0.38 0.00 -0.16 0.00 -0.00 0.00 0.00 39.64 39.86 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 -1.28 2.11 -0.43 7.28 -4.23 -1.26 0.85 115.64 118.67 2ka9 s THR 7 Ca 0.00 -1.05 0.02 0.00 -1.18 0.00 0.00 61.69 59.49 2ka9 s THR 7 Cb 0.00 -1.77 0.13 0.00 1.34 0.00 0.00 72.50 72.20 2ka9 s THR 7 CO 0.00 0.57 0.22 -0.22 -0.54 0.00 0.00 174.62 174.65 2ka9 s LEU 8 N -0.14 2.95 0.74 4.79 2.96 0.99 -4.91 118.68 126.07 2ka9 s LEU 8 Ca -0.04 -2.56 -0.11 0.00 -0.22 0.00 0.00 54.13 51.20 2ka9 s LEU 8 Cb -0.14 -1.12 0.04 0.00 0.50 0.00 0.00 46.19 45.46 2ka9 s LEU 8 CO 0.04 -0.28 1.08 -1.83 -1.32 0.00 0.00 176.35 174.03 2ka9 s GLU 9 N 0.42 2.52 -0.75 1.98 1.03 -1.26 -2.54 118.70 120.09 2ka9 s GLU 9 Ca 0.16 1.01 -0.26 0.00 0.03 0.00 0.00 54.97 55.91 2ka9 s GLU 9 Cb -0.24 -1.94 -0.03 0.00 -0.80 0.00 0.00 34.13 31.13 2ka9 s GLU 9 CO -0.02 -1.41 1.86 0.50 -1.33 0.00 0.00 175.26 174.86 2ka9 s ARG 10 N -4.99 2.65 0.59 -4.83 3.52 0.19 -4.59 118.95 111.48 2ka9 s ARG 10 Ca 0.60 0.14 0.29 0.00 -0.13 0.00 0.00 55.73 56.63 2ka9 s ARG 10 Cb -0.15 -4.69 1.43 0.00 -1.56 0.00 0.00 34.95 29.97 2ka9 s ARG 10 CO 0.55 -2.96 1.84 0.78 -0.81 0.00 0.00 175.30 174.70 2ka9 h GLY 11 N 16.79 0.00 0.00 8.12 0.00 -1.88 -3.44 103.07 122.66 2ka9 h GLY 11 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2ka9 h GLY 11 CO 1.22 0.00 0.00 0.70 0.00 0.00 0.00 176.54 178.46 2ka9 n ASN 12 N -3.68 0.00 -1.52 0.19 3.02 -1.26 -4.91 115.26 107.10 2ka9 n ASN 12 Ca 0.10 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.54 2ka9 n ASN 12 Cb 0.76 0.00 0.18 0.00 -0.61 0.00 0.00 39.78 40.12 2ka9 n ASN 12 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2ka9 n SER 13 N -0.22 3.07 0.00 6.41 7.64 -1.26 -5.04 113.62 124.21 2ka9 n SER 13 Ca 0.00 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 56.13 2ka9 n SER 13 Cb 0.00 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 62.51 2ka9 n SER 13 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ka9 n GLY 14 N -1.11 0.05 0.09 0.23 0.00 -1.26 -4.98 105.19 98.21 2ka9 n GLY 14 Ca 0.42 -1.79 -0.18 0.00 0.00 0.00 0.00 46.02 44.46 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 0.08 -0.65 0.99 4.07 -1.92 -3.21 115.31 114.67 2ka9 h LEU 15 Ca 0.00 -0.80 0.00 0.00 0.08 0.00 0.00 57.88 57.16 2ka9 h LEU 15 Cb 0.00 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.71 2ka9 h LEU 15 CO 0.00 1.29 0.00 0.61 -1.08 0.00 0.00 178.44 179.26 2ka9 n GLY 16 N 1.57 0.47 3.56 0.83 0.00 -1.26 0.88 105.19 111.24 2ka9 n GLY 16 Ca -0.20 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.11 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 -0.96 -0.52 -0.22 1.61 -0.12 -1.26 -2.85 117.98 113.66 2ka9 s PHE 17 Ca 0.00 0.95 -0.10 0.00 -0.05 0.00 0.00 56.93 57.73 2ka9 s PHE 17 Cb 0.00 0.42 -0.05 0.00 -0.63 0.00 0.00 43.02 42.76 2ka9 s PHE 17 CO 0.00 -0.44 0.14 -1.12 -0.05 0.00 0.00 175.22 173.74 2ka9 s SER 18 N -0.96 6.04 0.28 1.98 0.01 0.27 -4.93 113.70 116.39 2ka9 s SER 18 Ca -0.05 0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.41 2ka9 s SER 18 Cb -0.01 -2.07 -0.06 0.00 0.21 0.00 0.00 66.02 64.09 2ka9 s SER 18 CO 0.04 0.11 -0.07 0.27 0.41 0.00 0.00 173.24 174.00 2ka9 s ILE 19 N 0.79 1.73 -0.09 1.44 -4.36 -1.26 -0.23 121.20 119.22 2ka9 s ILE 19 Ca 0.07 -2.15 -0.30 0.00 -0.26 0.00 0.00 60.65 58.01 2ka9 s ILE 19 Cb -0.13 -2.43 0.11 0.00 1.25 0.00 0.00 42.46 41.26 2ka9 s ILE 19 CO 0.02 -0.31 0.95 0.00 0.24 0.00 0.00 174.94 175.83 2ka9 s ALA 20 N -2.96 -1.89 0.00 2.27 0.00 -1.17 -4.92 121.76 113.09 2ka9 s ALA 20 Ca 0.29 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.59 2ka9 s ALA 20 Cb 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.98 2ka9 s ALA 20 CO 0.12 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.80 2ka9 n GLY 21 N 0.28 0.93 0.00 0.00 0.00 -1.26 -3.97 105.19 101.18 2ka9 n GLY 21 Ca -0.09 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.82 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 2.36 0.29 -0.02 0.00 -1.23 -3.89 105.19 102.70 2ka9 n GLY 22 Ca 0.00 -1.74 0.18 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.20 -2.42 112.91 112.93 2ka9 h THR 23 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 66.41 66.08 2ka9 h THR 23 Cb 0.00 0.77 -0.05 0.00 -1.07 0.00 0.00 68.15 67.80 2ka9 h THR 23 CO 0.00 0.00 -1.73 0.47 -0.01 0.00 0.00 175.52 174.25 2ka9 n ASP 24 N -2.78 1.90 -3.82 0.00 9.92 -1.26 -4.75 116.55 115.76 2ka9 n ASP 24 Ca -0.02 0.38 -0.28 0.00 -0.53 0.00 0.00 54.79 54.34 2ka9 n ASP 24 Cb 0.14 -0.91 -0.12 0.00 -0.64 0.00 0.00 41.12 39.59 2ka9 n ASP 24 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2ka9 n ASN 25 N -4.34 2.75 -4.56 -2.24 5.03 -1.03 -5.10 115.26 105.77 2ka9 n ASN 25 Ca -0.40 -3.15 -0.47 0.00 0.87 0.00 0.00 54.58 51.42 2ka9 n ASN 25 Cb 0.76 -0.73 -0.03 0.00 -1.02 0.00 0.00 39.78 38.76 2ka9 n ASN 25 CO 0.00 0.00 0.00 -2.65 -1.83 0.00 0.00 177.26 172.78 2ka9 n PRO 26 N 1.96 1.09 0.26 3.52 -0.02 -0.94 -3.56 135.00 137.30 2ka9 n PRO 26 Ca 0.22 0.38 0.14 0.00 -2.02 0.00 0.00 63.50 62.22 2ka9 n PRO 26 Cb 0.37 -1.79 0.60 0.00 -0.02 0.00 0.00 33.50 32.66 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 2.63 0.00 0.00 6.00 -0.00 -1.79 -3.22 115.15 118.77 2ka9 h HIS 27 Ca -0.40 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 59.79 2ka9 h HIS 27 Cb 1.35 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.73 2ka9 h HIS 27 CO 0.51 0.09 -1.71 0.44 -0.00 0.00 0.00 177.93 177.26 2ka9 n ILE 28 N -3.24 0.67 -0.54 6.26 -5.35 -1.26 -4.94 119.36 110.96 2ka9 n ILE 28 Ca 0.00 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 2ka9 n ILE 28 Cb 0.35 -0.65 0.00 0.00 -1.74 0.00 0.00 39.64 37.60 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 2.32 1.52 1.22 3.28 0.00 -1.22 -4.95 105.19 107.36 2ka9 n GLY 29 Ca -0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 46.02 45.61 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 0.55 -0.18 -3.13 1.61 -0.08 -1.26 -5.06 116.55 109.00 2ka9 n ASP 30 Ca 0.00 -0.81 0.03 0.00 -1.51 0.00 0.00 54.79 52.50 2ka9 n ASP 30 Cb 0.13 0.08 -0.00 0.00 2.34 0.00 0.00 41.12 43.66 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 -0.15 -1.29 0.62 1.67 2.15 -1.26 -5.01 116.67 113.40 2ka9 s ASP 31 Ca 0.01 -0.16 0.30 0.00 0.43 0.00 0.00 52.55 53.13 2ka9 s ASP 31 Cb 0.04 1.74 1.65 0.00 -0.30 0.00 0.00 42.92 46.05 2ka9 s ASP 31 CO -0.01 -0.20 1.99 1.55 -0.17 0.00 0.00 175.17 178.33 2ka9 h PRO 32 N 7.32 0.00 -6.86 4.34 0.13 -1.90 -3.42 132.00 131.61 2ka9 h PRO 32 Ca -0.01 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.63 2ka9 h PRO 32 Cb 1.19 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2ka9 h PRO 32 CO 0.07 0.00 0.42 0.45 -0.23 0.00 0.00 178.00 178.71 2ka9 s SER 33 N -5.08 7.16 0.27 1.44 0.15 -1.25 -3.07 113.70 113.32 2ka9 s SER 33 Ca -0.04 2.09 -0.04 0.00 0.70 0.00 0.00 55.95 58.66 2ka9 s SER 33 Cb 0.13 -2.60 -0.05 0.00 -1.71 0.00 0.00 66.02 61.78 2ka9 s SER 33 CO 0.44 -0.20 0.52 -0.63 1.20 0.00 0.00 173.24 174.56 2ka9 s ILE 34 N -1.39 5.06 0.18 6.45 1.01 -1.26 -4.72 121.20 126.53 2ka9 s ILE 34 Ca 0.49 -0.03 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 2ka9 s ILE 34 Cb -0.26 -3.73 -0.03 0.00 0.01 0.00 0.00 42.46 38.45 2ka9 s ILE 34 CO 0.33 -0.29 0.17 0.72 0.00 0.00 0.00 174.94 175.87 2ka9 s PHE 35 N -2.04 0.87 0.14 3.97 -0.71 -1.25 -3.02 117.98 115.94 2ka9 s PHE 35 Ca 0.43 -1.17 -0.01 0.00 -1.04 0.00 0.00 56.93 55.14 2ka9 s PHE 35 Cb -0.11 -0.38 -0.04 0.00 -1.21 0.00 0.00 43.02 41.28 2ka9 s PHE 35 CO 0.30 -0.65 0.32 0.42 -1.34 0.00 0.00 175.22 174.26 2ka9 s ILE 36 N -4.08 5.27 -0.14 -4.49 1.01 0.22 -3.06 121.20 115.94 2ka9 s ILE 36 Ca 0.29 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.63 2ka9 s ILE 36 Cb 0.06 -3.68 -0.11 0.00 0.01 0.00 0.00 42.46 38.73 2ka9 s ILE 36 CO 0.07 -0.03 -0.07 0.35 0.00 0.00 0.00 174.94 175.26 2ka9 n THR 37 N -0.22 0.83 -3.51 2.92 -2.24 0.68 -2.70 114.28 110.03 2ka9 n THR 37 Ca -0.05 -0.38 -0.13 0.00 -2.27 0.00 0.00 64.05 61.22 2ka9 n THR 37 Cb 0.53 -0.90 -0.04 0.00 -2.10 0.00 0.00 70.33 67.81 2ka9 n THR 37 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2ka9 s LYS 38 N -2.29 0.94 -0.04 -0.78 2.36 -1.23 -4.80 119.74 113.89 2ka9 s LYS 38 Ca -0.15 -0.06 0.02 0.00 -2.55 0.00 0.00 55.97 53.24 2ka9 s LYS 38 Cb 0.04 0.44 -0.03 0.00 -1.05 0.00 0.00 37.83 37.23 2ka9 s LYS 38 CO 0.39 -0.35 -0.08 0.42 1.55 0.00 0.00 175.35 177.28 2ka9 s ILE 39 N -2.18 3.58 -0.18 5.43 1.01 -1.26 0.93 121.20 128.54 2ka9 s ILE 39 Ca -0.02 -0.60 -0.24 0.00 0.00 0.00 0.00 60.65 59.78 2ka9 s ILE 39 Cb -0.01 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 2ka9 s ILE 39 CO -0.01 0.54 0.79 -0.63 0.00 0.00 0.00 174.94 175.62 2ka9 s ILE 40 N -0.85 4.91 -0.47 2.92 1.01 -1.13 -4.94 121.20 122.64 2ka9 s ILE 40 Ca 0.14 1.53 -0.12 0.00 0.00 0.00 0.00 60.65 62.20 2ka9 s ILE 40 Cb -0.11 -4.09 -0.12 0.00 0.01 0.00 0.00 42.46 38.15 2ka9 s ILE 40 CO 0.03 0.05 1.67 -2.65 0.00 0.00 0.00 174.94 174.04 2ka9 n PRO 41 N 5.19 1.02 0.06 2.79 -0.02 -1.26 -3.06 135.00 139.71 2ka9 n PRO 41 Ca 0.03 -1.20 0.00 0.00 -2.02 0.00 0.00 63.50 60.31 2ka9 n PRO 41 Cb 0.49 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 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 4.22 -0.93 3.50 -1.23 0.00 -1.26 -5.05 105.19 104.44 2ka9 n GLY 42 Ca 0.34 0.17 -0.29 0.00 0.00 0.00 0.00 46.02 46.24 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 -1.38 -1.67 0.30 -0.02 0.00 -1.17 -4.73 105.19 96.51 2ka9 n GLY 43 Ca 0.00 -1.04 0.17 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.47 1.25 0.68 4.61 0.00 -0.54 -2.33 119.26 120.48 2ka9 h ALA 44 Ca -0.57 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 2ka9 h ALA 44 Cb 1.32 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.11 2ka9 h ALA 44 CO 0.46 0.04 -0.33 0.00 0.00 0.00 0.00 179.25 179.42 2ka9 h ALA 45 N 1.97 -0.91 0.00 0.00 0.00 0.26 0.60 119.26 121.18 2ka9 h ALA 45 Ca -0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 2ka9 h ALA 45 Cb 0.13 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2ka9 h ALA 45 CO 0.00 -0.97 -0.33 0.00 0.00 0.00 0.00 179.25 177.96 2ka9 h ALA 46 N -0.74 1.27 -0.20 0.00 0.00 -1.69 0.93 119.26 118.82 2ka9 h ALA 46 Ca -0.09 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.33 2ka9 h ALA 46 Cb 0.73 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2ka9 h ALA 46 CO 0.15 0.41 -0.63 1.96 0.00 0.00 0.00 179.25 181.14 2ka9 h GLN 47 N 0.00 0.72 0.00 0.00 1.08 -1.21 -3.15 115.11 112.55 2ka9 h GLN 47 Ca -0.00 -0.51 -0.14 0.00 -1.45 0.00 0.00 58.65 56.55 2ka9 h GLN 47 Cb 0.66 0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 28.15 2ka9 h GLN 47 CO 0.04 1.13 -1.16 -0.44 -0.95 0.00 0.00 178.83 177.45 2ka9 h ASP 48 N 0.53 0.00 -6.14 1.46 3.32 0.55 -3.49 116.42 112.65 2ka9 h ASP 48 Ca -0.01 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.70 2ka9 h ASP 48 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2ka9 h ASP 48 CO 0.13 0.53 -0.76 0.61 -1.72 0.00 0.00 179.24 178.02 2ka9 n GLY 49 N 1.34 -0.84 0.00 2.75 0.00 0.32 -4.87 105.19 103.90 2ka9 n GLY 49 Ca -0.06 0.44 0.05 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.85 2.11 -4.16 1.61 3.00 -1.26 -5.04 116.66 111.07 2ka9 n ARG 50 Ca -0.21 -0.04 -0.11 0.00 -0.01 0.00 0.00 57.85 57.47 2ka9 n ARG 50 Cb 0.47 -1.13 -0.09 0.00 0.00 0.00 0.00 32.46 31.71 2ka9 n ARG 50 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.63 177.15 2ka9 s LEU 51 N -3.04 1.17 0.34 0.55 2.34 -1.26 -5.01 118.68 113.76 2ka9 s LEU 51 Ca 0.01 -1.28 0.07 0.00 0.06 0.00 0.00 54.13 52.99 2ka9 s LEU 51 Cb 0.08 0.55 -0.02 0.00 -0.56 0.00 0.00 46.19 46.24 2ka9 s LEU 51 CO 0.47 -0.85 0.34 -0.60 -1.06 0.00 0.00 176.35 174.64 2ka9 s ARG 52 N -4.11 2.82 -0.01 1.48 6.06 -1.26 -5.05 118.95 118.88 2ka9 s ARG 52 Ca 0.33 -1.23 -0.23 0.00 -2.50 0.00 0.00 55.73 52.10 2ka9 s ARG 52 Cb 0.06 -2.56 -0.19 0.00 0.06 0.00 0.00 34.95 32.32 2ka9 s ARG 52 CO 0.09 0.09 1.23 -0.39 -2.50 0.00 0.00 175.30 173.82 2ka9 h VAL 53 N 1.16 1.42 0.00 7.11 -1.51 -1.89 -3.21 116.25 119.33 2ka9 h VAL 53 Ca -0.45 -1.45 0.00 0.00 -1.23 0.00 0.00 66.70 63.58 2ka9 h VAL 53 Cb 1.25 2.22 0.00 0.00 -2.13 0.00 0.00 31.29 32.64 2ka9 h VAL 53 CO 0.57 0.40 0.00 0.59 -1.23 0.00 0.00 177.57 177.90 2ka9 n ASN 54 N -4.63 0.00 -4.90 4.19 3.02 -1.10 0.70 115.26 112.54 2ka9 n ASN 54 Ca -0.08 -0.16 -0.25 0.00 -0.03 0.00 0.00 54.58 54.06 2ka9 n ASN 54 Cb 0.37 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.61 2ka9 n ASN 54 CO 0.00 0.00 0.00 1.51 -2.62 0.00 0.00 177.26 176.15 2ka9 s ASP 55 N -1.95 4.83 -0.21 6.41 1.47 -1.22 -4.82 116.67 121.18 2ka9 s ASP 55 Ca 0.03 0.33 0.02 0.00 1.18 0.00 0.00 52.55 54.10 2ka9 s ASP 55 Cb 0.01 -0.99 0.04 0.00 -0.34 0.00 0.00 42.92 41.64 2ka9 s ASP 55 CO 0.02 -1.56 -0.16 -0.44 0.68 0.00 0.00 175.17 173.71 2ka9 s SER 56 N -4.52 3.60 -0.65 2.11 0.01 -0.93 -2.91 113.70 110.40 2ka9 s SER 56 Ca 0.60 -0.92 -0.26 0.00 1.31 0.00 0.00 55.95 56.68 2ka9 s SER 56 Cb -0.10 -1.48 -0.10 0.00 0.21 0.00 0.00 66.02 64.54 2ka9 s SER 56 CO 0.44 -0.08 2.40 0.27 0.41 0.00 0.00 173.24 176.68 2ka9 s ILE 57 N 1.23 3.02 0.29 1.44 -0.00 -1.17 -1.13 121.20 124.89 2ka9 s ILE 57 Ca -0.00 -0.00 0.14 0.00 -0.00 0.00 0.00 60.65 60.78 2ka9 s ILE 57 Cb -0.16 -3.05 0.07 0.00 -0.00 0.00 0.00 42.46 39.33 2ka9 s ILE 57 CO -0.10 -0.04 1.75 -0.07 -0.00 0.00 0.00 174.94 176.47 2ka9 h LEU 58 N 21.10 0.00 -7.12 0.37 3.38 -0.24 -3.30 115.31 129.50 2ka9 h LEU 58 Ca -0.11 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2ka9 h LEU 58 Cb 1.12 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.66 2ka9 h LEU 58 CO 1.08 0.44 0.02 -0.36 0.09 0.00 0.00 178.44 179.72 2ka9 s PHE 59 N -3.86 -0.63 -0.18 1.13 0.08 0.73 -3.18 117.98 112.08 2ka9 s PHE 59 Ca -0.02 1.41 -0.11 0.00 0.12 0.00 0.00 56.93 58.34 2ka9 s PHE 59 Cb 0.13 0.26 0.06 0.00 -0.57 0.00 0.00 43.02 42.90 2ka9 s PHE 59 CO 0.72 -0.39 0.43 0.08 -0.10 0.00 0.00 175.22 175.96 2ka9 s VAL 60 N -0.16 -0.02 -1.56 -0.44 1.01 -0.57 0.36 120.40 119.03 2ka9 s VAL 60 Ca -0.04 0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.87 2ka9 s VAL 60 Cb -0.03 -0.64 0.10 0.00 0.00 0.00 0.00 36.38 35.80 2ka9 s VAL 60 CO 0.03 0.03 0.94 -3.20 0.00 0.00 0.00 175.10 172.90 2ka9 n ASN 61 N 4.04 -4.42 -1.94 3.32 4.05 -1.13 0.14 115.26 119.31 2ka9 n ASN 61 Ca -0.22 -0.82 -0.19 0.00 0.45 0.00 0.00 54.58 53.80 2ka9 n ASN 61 Cb 0.56 -3.68 -0.03 0.00 1.23 0.00 0.00 39.78 37.86 2ka9 n ASN 61 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2ka9 n GLU 62 N -4.62 -1.45 -5.17 1.20 1.02 -1.26 -4.96 120.64 105.38 2ka9 n GLU 62 Ca 0.04 0.99 -0.31 0.00 -0.02 0.00 0.00 57.16 57.86 2ka9 n GLU 62 Cb 0.52 -5.47 -0.17 0.00 -0.02 0.00 0.00 31.44 26.31 2ka9 n GLU 62 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2ka9 s VAL 63 N -2.87 1.97 -0.62 2.62 1.01 0.12 -5.08 120.40 117.56 2ka9 s VAL 63 Ca 0.00 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 60.73 2ka9 s VAL 63 Cb 0.00 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.67 2ka9 s VAL 63 CO 0.00 0.54 1.70 1.51 0.00 0.00 0.00 175.10 178.86 2ka9 s ASP 64 N 0.23 5.55 -0.46 3.32 -4.77 -1.26 -1.50 116.67 117.77 2ka9 s ASP 64 Ca -0.14 0.22 0.03 0.00 -3.30 0.00 0.00 52.55 49.36 2ka9 s ASP 64 Cb -0.17 -2.54 0.44 0.00 -1.09 0.00 0.00 42.92 39.57 2ka9 s ASP 64 CO 0.07 -2.18 1.49 0.52 0.70 0.00 0.00 175.17 175.77 2ka9 n VAL 65 N 7.03 2.91 -0.29 2.11 0.31 -1.19 -4.61 118.33 124.60 2ka9 n VAL 65 Ca 0.16 -3.93 0.10 0.00 -0.01 0.00 0.00 64.34 60.67 2ka9 n VAL 65 Cb 0.51 -1.17 0.28 0.00 -0.91 0.00 0.00 33.84 32.55 2ka9 n VAL 65 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2ka9 n ARG 66 N -0.73 2.74 -1.37 5.55 1.85 -1.24 -4.43 116.66 119.02 2ka9 n ARG 66 Ca 0.50 -2.49 -0.00 0.00 -1.00 0.00 0.00 57.85 54.85 2ka9 n ARG 66 Cb 0.79 -1.49 0.01 0.00 -1.05 0.00 0.00 32.46 30.72 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 1.36 0.12 -4.37 2.89 1.02 -1.26 -3.96 120.64 116.43 2ka9 n GLU 67 Ca 0.21 -0.13 -0.29 0.00 -0.02 0.00 0.00 57.16 56.93 2ka9 n GLU 67 Cb 0.57 0.16 -0.12 0.00 -0.02 0.00 0.00 31.44 32.03 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 0.01 2.43 0.83 2.62 -7.23 -1.26 -4.62 120.40 113.19 2ka9 s VAL 68 Ca 0.01 -1.73 -0.15 0.00 -1.81 0.00 0.00 61.98 58.30 2ka9 s VAL 68 Cb 0.04 -2.10 -0.03 0.00 0.56 0.00 0.00 36.38 34.84 2ka9 s VAL 68 CO -0.01 0.06 0.27 0.35 -0.31 0.00 0.00 175.10 175.46 2ka9 n THR 69 N 0.79 0.80 -0.05 5.32 -2.24 -1.26 -1.53 114.28 116.11 2ka9 n THR 69 Ca -0.17 -0.34 -0.09 0.00 -2.27 0.00 0.00 64.05 61.19 2ka9 n THR 69 Cb 0.53 -0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 68.18 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 -0.87 0.14 -0.51 4.78 2.76 -1.84 -2.00 115.15 117.61 2ka9 h HIS 70 Ca -0.44 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 57.76 2ka9 h HIS 70 Cb 1.32 -0.03 -0.03 0.00 1.55 0.00 0.00 27.41 30.23 2ka9 h HIS 70 CO 0.34 0.07 0.34 0.66 -1.30 0.00 0.00 177.93 178.03 2ka9 h SER 71 N 0.18 0.55 -0.21 3.26 4.64 -1.92 0.20 113.55 120.24 2ka9 h SER 71 Ca 0.10 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.27 2ka9 h SER 71 Cb 0.06 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 2ka9 h SER 71 CO -0.10 0.39 -0.34 0.00 -0.87 0.00 0.00 176.83 175.91 2ka9 h ALA 72 N 1.69 0.79 -0.17 5.18 0.00 -1.75 0.11 119.26 125.11 2ka9 h ALA 72 Ca 0.20 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 2ka9 h ALA 72 Cb 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2ka9 h ALA 72 CO -0.05 0.65 -0.41 0.00 0.00 0.00 0.00 179.25 179.44 2ka9 h ALA 73 N 1.01 0.27 -0.38 0.00 0.00 -0.67 -1.50 119.26 118.00 2ka9 h ALA 73 Ca 0.06 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2ka9 h ALA 73 Cb 0.87 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2ka9 h ALA 73 CO 0.08 0.38 0.01 0.28 0.00 0.00 0.00 179.25 180.00 2ka9 h VAL 74 N 0.22 1.21 -0.17 0.00 2.07 -0.92 -1.71 116.25 116.95 2ka9 h VAL 74 Ca -0.00 -0.83 -0.12 0.00 0.82 0.00 0.00 66.70 66.57 2ka9 h VAL 74 Cb 1.03 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2ka9 h VAL 74 CO 0.09 0.29 -0.40 -0.08 0.02 0.00 0.00 177.57 177.48 2ka9 h GLU 75 N 0.56 0.39 -0.35 1.57 4.81 -0.65 0.83 114.58 121.74 2ka9 h GLU 75 Ca 0.12 -0.19 -0.13 0.00 -0.13 0.00 0.00 59.36 59.02 2ka9 h GLU 75 Cb 0.35 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 2ka9 h GLU 75 CO 0.01 0.73 -0.31 0.00 -0.73 0.00 0.00 179.01 178.72 2ka9 h ALA 76 N 1.25 0.51 0.00 2.92 0.00 -0.62 0.62 119.26 123.94 2ka9 h ALA 76 Ca 0.03 -0.42 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 2ka9 h ALA 76 Cb 0.85 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2ka9 h ALA 76 CO 0.07 0.55 -0.70 1.37 0.00 0.00 0.00 179.25 180.53 2ka9 h LEU 77 N 0.61 0.00 -0.58 0.00 8.10 -1.23 -2.72 115.31 119.49 2ka9 h LEU 77 Ca 0.06 0.00 -0.15 0.00 0.11 0.00 0.00 57.88 57.90 2ka9 h LEU 77 Cb 0.89 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.10 2ka9 h LEU 77 CO 0.08 0.70 -0.52 0.50 -4.11 0.00 0.00 178.44 175.09 2ka9 h LYS 78 N 0.00 0.50 -0.69 0.17 3.64 0.85 -2.65 116.57 118.40 2ka9 h LYS 78 Ca -0.01 -0.30 -0.08 0.00 -1.27 0.00 0.00 60.65 58.99 2ka9 h LYS 78 Cb 1.54 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 33.34 2ka9 h LYS 78 CO 0.09 0.90 0.10 -0.85 -2.27 0.00 0.00 179.45 177.42 2ka9 n GLU 79 N -3.96 4.12 -0.18 1.90 -0.00 0.20 -3.91 120.64 118.80 2ka9 n GLU 79 Ca -0.03 -2.80 0.03 0.00 -0.00 0.00 0.00 57.16 54.36 2ka9 n GLU 79 Cb 0.58 -2.17 0.04 0.00 -0.00 0.00 0.00 31.44 29.90 2ka9 n GLU 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ka9 n ALA 80 N 0.31 1.90 -1.63 -1.84 0.00 -1.01 -5.01 120.51 113.23 2ka9 n ALA 80 Ca 0.30 -1.43 -0.28 0.00 0.00 0.00 0.00 53.44 52.04 2ka9 n ALA 80 Cb 1.18 -0.28 -0.05 0.00 0.00 0.00 0.00 19.45 20.31 2ka9 n ALA 80 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ka9 s GLY 81 N -1.41 -0.50 0.00 0.00 0.00 -1.18 -3.46 107.32 100.77 2ka9 s GLY 81 Ca 0.10 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.40 2ka9 s GLY 81 CO 0.01 4.08 0.00 1.44 0.00 0.00 0.00 173.10 178.63 2ka9 n SER 82 N 16.57 0.00 -3.28 1.64 7.64 -1.26 -4.85 113.62 130.08 2ka9 n SER 82 Ca 0.39 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 60.20 2ka9 n SER 82 Cb 0.50 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.65 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 0.00 -0.68 -0.11 0.44 1.01 -1.22 0.54 121.20 121.17 2ka9 s ILE 83 Ca 0.00 -0.38 -0.06 0.00 0.00 0.00 0.00 60.65 60.21 2ka9 s ILE 83 Cb 0.00 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 2ka9 s ILE 83 CO 0.00 -0.27 0.12 -0.69 0.00 0.00 0.00 174.94 174.10 2ka9 s VAL 84 N 2.10 5.28 -0.81 2.92 1.01 -1.05 -4.89 120.40 124.96 2ka9 s VAL 84 Ca 0.13 0.10 -0.22 0.00 0.00 0.00 0.00 61.98 62.00 2ka9 s VAL 84 Cb -0.11 -3.30 0.09 0.00 0.00 0.00 0.00 36.38 33.06 2ka9 s VAL 84 CO -0.17 0.60 1.11 -0.60 0.00 0.00 0.00 175.10 176.05 2ka9 s ARG 85 N -1.05 3.36 -0.34 2.72 6.06 -1.26 -0.00 118.95 128.43 2ka9 s ARG 85 Ca 0.15 -1.16 -0.25 0.00 -2.50 0.00 0.00 55.73 51.97 2ka9 s ARG 85 Cb -0.12 -4.63 0.01 0.00 0.06 0.00 0.00 34.95 30.27 2ka9 s ARG 85 CO 0.04 -1.88 0.88 -1.17 -2.50 0.00 0.00 175.30 170.67 2ka9 s LEU 86 N 3.82 4.04 -0.21 -0.88 1.98 0.25 -2.85 118.68 124.83 2ka9 s LEU 86 Ca 0.30 0.64 0.02 0.00 -2.89 0.00 0.00 54.13 52.20 2ka9 s LEU 86 Cb -0.10 -3.21 0.04 0.00 0.66 0.00 0.00 46.19 43.59 2ka9 s LEU 86 CO 0.01 -0.76 -0.13 -0.47 -1.89 0.00 0.00 176.35 173.10 2ka9 s TYR 87 N 3.28 2.80 0.29 5.38 5.04 0.16 -0.04 117.35 134.25 2ka9 s TYR 87 Ca 0.36 -1.86 0.04 0.00 -2.44 0.00 0.00 57.07 53.18 2ka9 s TYR 87 Cb -0.13 -1.81 -0.06 0.00 0.35 0.00 0.00 41.96 40.31 2ka9 s TYR 87 CO 0.16 -0.81 0.03 0.14 -1.34 0.00 0.00 175.55 173.73 2ka9 s VAL 88 N 1.27 1.14 -0.28 3.14 -7.23 0.37 0.43 120.40 119.23 2ka9 s VAL 88 Ca -0.02 -2.03 0.02 0.00 -1.81 0.00 0.00 61.98 58.14 2ka9 s VAL 88 Cb -0.17 -2.61 0.06 0.00 0.56 0.00 0.00 36.38 34.23 2ka9 s VAL 88 CO -0.08 -0.13 -0.06 -0.32 -0.31 0.00 0.00 175.10 174.19 2ka9 s MET 89 N -3.88 2.23 0.07 4.82 1.75 -0.28 -2.03 119.30 121.97 2ka9 s MET 89 Ca 0.33 -1.37 0.08 0.00 -1.25 0.00 0.00 55.69 53.48 2ka9 s MET 89 Cb 0.07 -3.00 -0.03 0.00 2.84 0.00 0.00 34.83 34.71 2ka9 s MET 89 CO 0.13 -0.62 -0.22 0.50 -0.65 0.00 0.00 175.02 174.16 2ka9 s ARG 90 N 1.13 1.35 -0.10 4.11 3.52 -0.65 -2.18 118.95 126.13 2ka9 s ARG 90 Ca -0.06 -1.04 -0.15 0.00 -0.13 0.00 0.00 55.73 54.35 2ka9 s ARG 90 Cb -0.20 -1.54 -0.05 0.00 -1.56 0.00 0.00 34.95 31.61 2ka9 s ARG 90 CO -0.04 0.38 0.37 1.03 -0.81 0.00 0.00 175.30 176.23 2ka9 s ARG 91 N -1.44 4.14 0.58 5.12 3.00 -1.26 0.39 118.95 129.49 2ka9 s ARG 91 Ca 0.08 0.28 -0.19 0.00 0.00 0.00 0.00 55.73 55.90 2ka9 s ARG 91 Cb -0.09 -3.36 -0.05 0.00 0.00 0.00 0.00 34.95 31.45 2ka9 s ARG 91 CO 0.03 0.38 0.95 1.63 0.00 0.00 0.00 175.30 178.29 2ka9 n LYS 92 N 3.00 0.93 -2.02 3.54 4.76 -1.26 -4.83 118.16 122.28 2ka9 n LYS 92 Ca -0.12 0.36 -0.42 0.00 -2.87 0.00 0.00 58.31 55.26 2ka9 n LYS 92 Cb 0.52 -2.14 -0.03 0.00 -1.84 0.00 0.00 35.03 31.54 2ka9 n LYS 92 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2ka9 s PRO 93 N -2.66 4.25 0.00 1.97 0.04 -1.26 -4.74 135.00 132.60 2ka9 s PRO 93 Ca 0.74 2.25 0.00 0.00 0.04 0.00 0.00 61.00 64.03 2ka9 s PRO 93 Cb -0.43 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 30.89 2ka9 s PRO 93 CO 0.48 -0.56 0.00 -2.30 0.04 0.00 0.00 177.00 174.67 2ka9 n PRO 94 N 4.10 0.76 -0.39 0.56 -0.02 -1.26 -4.98 135.00 133.76 2ka9 n PRO 94 Ca 0.13 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.69 2ka9 n PRO 94 Cb 0.40 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 34.05 2ka9 n PRO 94 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ka9 n ALA 95 N -3.00 2.94 -1.76 3.55 0.00 -1.26 -4.74 120.51 116.24 2ka9 n ALA 95 Ca 0.00 -2.90 -0.40 0.00 0.00 0.00 0.00 53.44 50.14 2ka9 n ALA 95 Cb 0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 19.45 19.02 2ka9 n ALA 95 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2ka9 s GLU 96 N -2.87 4.70 0.33 0.00 2.12 -1.26 -4.60 118.70 117.13 2ka9 s GLU 96 Ca 0.34 1.59 -0.04 0.00 0.36 0.00 0.00 54.97 57.22 2ka9 s GLU 96 Cb 0.32 -3.15 0.02 0.00 0.26 0.00 0.00 34.13 31.58 2ka9 s GLU 96 CO -0.03 0.34 0.51 1.63 -0.54 0.00 0.00 175.26 177.17 2ka9 n LYS 97 N 1.18 0.74 -5.05 4.30 5.02 -1.20 -4.98 118.16 118.16 2ka9 n LYS 97 Ca -0.01 -2.47 -0.32 0.00 -2.02 0.00 0.00 58.31 53.49 2ka9 n LYS 97 Cb 0.47 2.51 -0.15 0.00 -0.02 0.00 0.00 35.03 37.83 2ka9 n LYS 97 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2ka9 s VAL 98 N -2.65 2.55 0.37 -0.18 1.01 -1.26 -1.18 120.40 119.05 2ka9 s VAL 98 Ca 0.24 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.42 2ka9 s VAL 98 Cb -0.02 -1.98 -0.06 0.00 0.00 0.00 0.00 36.38 34.32 2ka9 s VAL 98 CO 0.17 0.56 0.06 -0.04 0.00 0.00 0.00 175.10 175.86 2ka9 s MET 99 N -0.18 2.12 -0.23 2.72 -1.94 0.11 -4.94 119.30 116.96 2ka9 s MET 99 Ca -0.02 -1.80 -0.03 0.00 -1.71 0.00 0.00 55.69 52.13 2ka9 s MET 99 Cb -0.14 -1.92 0.07 0.00 2.01 0.00 0.00 34.83 34.86 2ka9 s MET 99 CO 0.03 0.05 0.07 -1.21 -0.01 0.00 0.00 175.02 173.95 2ka9 s GLU 100 N -3.77 0.56 0.19 2.03 8.01 -1.26 -1.58 118.70 122.88 2ka9 s GLU 100 Ca 0.37 -0.56 0.09 0.00 0.01 0.00 0.00 54.97 54.88 2ka9 s GLU 100 Cb 0.02 -1.93 -0.04 0.00 -4.31 0.00 0.00 34.13 27.86 2ka9 s GLU 100 CO 0.20 -0.77 -0.08 0.42 0.01 0.00 0.00 175.26 175.04 2ka9 s ILE 101 N 1.86 3.24 -0.19 -1.63 -1.09 0.09 -4.95 121.20 118.52 2ka9 s ILE 101 Ca 0.03 -1.69 -0.02 0.00 -2.23 0.00 0.00 60.65 56.73 2ka9 s ILE 101 Cb -0.17 -2.62 -0.01 0.00 -1.58 0.00 0.00 42.46 38.08 2ka9 s ILE 101 CO -0.16 -0.15 -0.08 -0.54 -1.23 0.00 0.00 174.94 172.78 2ka9 s LYS 102 N -2.96 3.36 -0.16 2.79 1.02 -1.26 0.12 119.74 122.66 2ka9 s LYS 102 Ca 0.26 -0.65 0.00 0.00 0.02 0.00 0.00 55.97 55.60 2ka9 s LYS 102 Cb -0.08 -2.86 0.03 0.00 -0.52 0.00 0.00 37.83 34.39 2ka9 s LYS 102 CO 0.16 -0.06 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.23 2ka9 s LEU 103 N 1.09 1.80 0.02 3.17 0.20 0.99 -2.71 118.68 123.24 2ka9 s LEU 103 Ca 0.01 -0.58 -0.07 0.00 0.69 0.00 0.00 54.13 54.18 2ka9 s LEU 103 Cb -0.15 -1.17 -0.05 0.00 -0.43 0.00 0.00 46.19 44.40 2ka9 s LEU 103 CO -0.01 -0.08 0.29 0.27 -0.29 0.00 0.00 176.35 176.52 2ka9 s ILE 104 N 1.48 5.27 0.61 6.68 -4.36 -1.26 -2.00 121.20 127.62 2ka9 s ILE 104 Ca 0.03 0.21 -0.15 0.00 -0.26 0.00 0.00 60.65 60.49 2ka9 s ILE 104 Cb -0.14 -3.58 -0.03 0.00 1.25 0.00 0.00 42.46 39.96 2ka9 s ILE 104 CO -0.10 0.35 1.05 -0.75 0.24 0.00 0.00 174.94 175.73 2ka9 s LYS 105 N -1.78 3.31 0.32 0.37 2.20 0.19 -4.40 119.74 119.95 2ka9 s LYS 105 Ca 0.28 1.11 0.04 0.00 -0.36 0.00 0.00 55.97 57.05 2ka9 s LYS 105 Cb -0.13 -2.04 -0.02 0.00 -1.51 0.00 0.00 37.83 34.14 2ka9 s LYS 105 CO 0.16 -0.81 0.15 0.41 -0.36 0.00 0.00 175.35 174.90 2ka9 n GLY 106 N -1.31 3.32 0.20 5.54 0.00 0.35 -4.93 105.19 108.37 2ka9 n GLY 106 Ca 0.08 -2.02 -0.04 0.00 0.00 0.00 0.00 46.02 44.04 2ka9 n GLY 106 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ka9 h PRO 107 N 0.00 0.32 -0.66 1.61 0.13 -1.99 -2.57 132.00 128.85 2ka9 h PRO 107 Ca -0.24 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2ka9 h PRO 107 Cb 0.99 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2ka9 h PRO 107 CO 0.38 0.72 0.00 1.63 -0.23 0.00 0.00 178.00 180.50 2ka9 n LYS 108 N -3.99 3.76 0.00 0.86 5.02 -1.26 -5.03 118.16 117.52 2ka9 n LYS 108 Ca -0.02 -2.40 0.00 0.00 -2.02 0.00 0.00 58.31 53.87 2ka9 n LYS 108 Cb 0.52 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 2ka9 n LYS 108 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ka9 n GLY 109 N 0.66 0.21 0.13 0.72 0.00 -0.97 -4.46 105.19 101.48 2ka9 n GLY 109 Ca 0.21 -1.86 0.12 0.00 0.00 0.00 0.00 46.02 44.49 2ka9 n GLY 109 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ka9 h LEU 110 N 0.00 0.00 -1.97 0.99 3.38 -1.87 1.02 115.31 116.86 2ka9 h LEU 110 Ca 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2ka9 h LEU 110 Cb 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2ka9 h LEU 110 CO 0.00 0.02 -0.05 0.61 0.09 0.00 0.00 178.44 179.11 2ka9 n GLY 111 N 1.19 0.39 3.63 0.83 0.00 -1.26 -3.25 105.19 106.72 2ka9 n GLY 111 Ca 0.02 -0.44 -0.03 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.02 -0.07 -0.24 1.61 -0.71 -1.26 -3.86 117.98 110.42 2ka9 s PHE 112 Ca 0.00 0.11 -0.03 0.00 -1.04 0.00 0.00 56.93 55.97 2ka9 s PHE 112 Cb -0.00 0.49 0.01 0.00 -1.21 0.00 0.00 43.02 42.32 2ka9 s PHE 112 CO 0.05 -0.07 -0.04 -1.12 -1.34 0.00 0.00 175.22 172.69 2ka9 s SER 113 N -1.23 4.36 0.14 1.98 0.01 0.23 -4.98 113.70 114.20 2ka9 s SER 113 Ca 0.08 -0.69 0.06 0.00 1.31 0.00 0.00 55.95 56.72 2ka9 s SER 113 Cb -0.01 -1.71 -0.04 0.00 0.21 0.00 0.00 66.02 64.47 2ka9 s SER 113 CO -0.06 -0.10 -0.14 0.27 0.41 0.00 0.00 173.24 173.62 2ka9 s ILE 114 N 1.40 1.41 -0.23 1.44 -4.36 -1.26 0.12 121.20 119.72 2ka9 s ILE 114 Ca 0.03 -1.81 -0.10 0.00 -0.26 0.00 0.00 60.65 58.50 2ka9 s ILE 114 Cb -0.16 -1.64 0.09 0.00 1.25 0.00 0.00 42.46 42.00 2ka9 s ILE 114 CO -0.04 -0.45 0.52 0.00 0.24 0.00 0.00 174.94 175.22 2ka9 s ALA 115 N -2.30 -1.47 0.20 2.27 0.00 -0.65 -4.92 121.76 114.88 2ka9 s ALA 115 Ca 0.12 1.89 -0.05 0.00 0.00 0.00 0.00 51.96 53.92 2ka9 s ALA 115 Cb -0.04 -1.33 0.02 0.00 0.00 0.00 0.00 23.12 21.77 2ka9 s ALA 115 CO 0.04 -0.56 0.34 0.41 0.00 0.00 0.00 175.76 175.98 2ka9 n GLY 116 N 4.84 1.98 0.00 0.00 0.00 -1.26 -2.73 105.19 108.01 2ka9 n GLY 116 Ca -0.16 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2ka9 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ka9 n GLY 117 N -0.29 -2.12 3.93 -0.02 0.00 0.28 -3.24 105.19 103.72 2ka9 n GLY 117 Ca -0.02 -2.13 -0.26 0.00 0.00 0.00 0.00 46.02 43.60 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 -0.41 5.21 0.00 1.61 1.01 -1.26 -3.74 120.40 122.82 2ka9 s VAL 118 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.24 2ka9 s VAL 118 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2ka9 s VAL 118 CO 0.00 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.61 2ka9 n GLY 119 N -0.54 3.07 2.68 4.51 0.00 -1.26 -3.27 105.19 110.39 2ka9 n GLY 119 Ca -0.07 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.90 2ka9 n GLY 119 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ka9 n ASN 120 N 0.12 -1.65 -4.72 1.61 6.94 -1.26 -5.04 115.26 111.25 2ka9 n ASN 120 Ca 0.00 -1.71 -0.42 0.00 -0.02 0.00 0.00 54.58 52.43 2ka9 n ASN 120 Cb 0.00 0.90 -0.03 0.00 -2.36 0.00 0.00 39.78 38.29 2ka9 n ASN 120 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2ka9 s GLN 121 N 0.52 4.50 0.46 -3.83 1.11 -1.25 -4.73 119.66 116.45 2ka9 s GLN 121 Ca 0.26 1.63 0.32 0.00 0.01 0.00 0.00 55.36 57.58 2ka9 s GLN 121 Cb 0.17 -3.38 1.44 0.00 -1.01 0.00 0.00 33.01 30.23 2ka9 s GLN 121 CO -0.11 -0.14 1.65 1.25 0.01 0.00 0.00 175.29 177.96 2ka9 h HIS 122 N 6.58 0.42 -3.35 0.91 -0.00 -1.83 -3.37 115.15 114.52 2ka9 h HIS 122 Ca -0.42 0.02 -0.67 0.00 -0.00 0.00 0.00 60.37 59.30 2ka9 h HIS 122 Cb 1.22 -0.11 -0.16 0.00 -0.00 0.00 0.00 27.41 28.36 2ka9 h HIS 122 CO 0.67 -0.13 -0.63 0.42 -0.00 0.00 0.00 177.93 178.26 2ka9 s ILE 123 N -5.23 4.24 -0.93 6.26 1.01 -1.26 -5.01 121.20 120.28 2ka9 s ILE 123 Ca -0.07 -0.27 -0.08 0.00 0.00 0.00 0.00 60.65 60.24 2ka9 s ILE 123 Cb 0.28 -2.79 -0.06 0.00 0.01 0.00 0.00 42.46 39.90 2ka9 s ILE 123 CO 0.83 0.58 2.11 -0.81 0.00 0.00 0.00 174.94 177.65 2ka9 n PRO 124 N 2.38 2.08 0.00 2.79 -0.04 -1.26 -3.37 135.00 137.58 2ka9 n PRO 124 Ca -0.18 -1.53 0.00 0.00 -0.04 0.00 0.00 63.50 61.74 2ka9 n PRO 124 Cb 0.53 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 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 3.85 0.21 3.02 0.55 0.00 -1.26 -5.14 105.19 106.42 2ka9 n GLY 125 Ca 0.46 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.52 2ka9 n GLY 125 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ka9 s ASP 126 N -0.05 -0.37 0.63 1.61 1.01 -1.22 -5.01 116.67 113.28 2ka9 s ASP 126 Ca 0.00 -0.03 0.36 0.00 0.71 0.00 0.00 52.55 53.58 2ka9 s ASP 126 Cb 0.00 0.96 2.00 0.00 1.01 0.00 0.00 42.92 46.90 2ka9 s ASP 126 CO 0.00 -0.06 2.21 0.78 0.21 0.00 0.00 175.17 178.32 2ka9 h ASN 127 N 6.61 0.00 -2.77 0.27 4.21 -1.87 -3.41 115.58 118.62 2ka9 h ASN 127 Ca -0.07 0.00 -0.59 0.00 1.21 0.00 0.00 56.30 56.85 2ka9 h ASN 127 Cb 1.20 0.00 0.09 0.00 -1.12 0.00 0.00 38.32 38.49 2ka9 h ASN 127 CO -0.09 0.00 0.49 -1.20 -1.29 0.00 0.00 177.43 175.34 2ka9 n SER 128 N -3.38 2.46 -4.66 5.81 7.64 -1.26 0.98 113.62 121.21 2ka9 n SER 128 Ca -0.02 1.17 -0.43 0.00 1.01 0.00 0.00 58.87 60.60 2ka9 n SER 128 Cb 0.18 -1.41 -0.02 0.00 -1.01 0.00 0.00 64.21 61.95 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 -0.49 4.15 0.08 0.44 1.01 -1.23 -4.54 121.20 120.62 2ka9 s ILE 129 Ca 0.64 1.41 0.08 0.00 0.00 0.00 0.00 60.65 62.77 2ka9 s ILE 129 Cb -0.65 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 37.88 2ka9 s ILE 129 CO 0.55 -0.11 -0.18 -0.31 0.00 0.00 0.00 174.94 174.89 2ka9 s TYR 130 N 3.44 2.54 0.16 3.97 1.51 -1.11 -0.72 117.35 127.14 2ka9 s TYR 130 Ca 0.58 -0.26 -0.25 0.00 -1.01 0.00 0.00 57.07 56.12 2ka9 s TYR 130 Cb -0.24 -1.40 -0.08 0.00 -0.11 0.00 0.00 41.96 40.13 2ka9 s TYR 130 CO 0.18 0.32 0.78 0.08 -1.11 0.00 0.00 175.55 175.80 2ka9 s VAL 131 N -1.03 4.39 -0.18 0.71 1.01 0.66 -1.64 120.40 124.31 2ka9 s VAL 131 Ca 0.16 1.72 -0.16 0.00 0.00 0.00 0.00 61.98 63.70 2ka9 s VAL 131 Cb -0.11 -4.15 -0.06 0.00 0.00 0.00 0.00 36.38 32.07 2ka9 s VAL 131 CO 0.08 0.51 -0.30 0.35 0.00 0.00 0.00 175.10 175.74 2ka9 n THR 132 N 1.70 1.48 -3.63 3.92 -2.24 0.32 -2.82 114.28 113.02 2ka9 n THR 132 Ca -0.05 0.11 -0.15 0.00 -2.27 0.00 0.00 64.05 61.68 2ka9 n THR 132 Cb 0.49 -2.31 -0.07 0.00 -2.10 0.00 0.00 70.33 66.34 2ka9 n THR 132 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2ka9 s LYS 133 N -2.71 0.90 0.01 -0.78 0.00 -1.12 -4.67 119.74 111.37 2ka9 s LYS 133 Ca -0.27 -0.01 0.05 0.00 0.00 0.00 0.00 55.97 55.74 2ka9 s LYS 133 Cb 0.05 0.41 -0.02 0.00 0.00 0.00 0.00 37.83 38.27 2ka9 s LYS 133 CO 0.39 -0.28 -0.16 0.42 0.00 0.00 0.00 175.35 175.72 2ka9 s ILE 134 N -1.47 1.27 1.00 3.79 1.01 -1.26 0.75 121.20 126.29 2ka9 s ILE 134 Ca -0.11 -0.81 -0.15 0.00 0.00 0.00 0.00 60.65 59.59 2ka9 s ILE 134 Cb -0.02 -1.09 0.19 0.00 0.01 0.00 0.00 42.46 41.56 2ka9 s ILE 134 CO 0.06 0.26 1.17 -0.63 0.00 0.00 0.00 174.94 175.80 2ka9 s ILE 135 N -0.52 1.90 0.23 2.92 1.01 -1.25 -5.00 121.20 120.48 2ka9 s ILE 135 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 60.65 60.54 2ka9 s ILE 135 Cb -0.07 -2.72 -0.08 0.00 0.01 0.00 0.00 42.46 39.60 2ka9 s ILE 135 CO 0.00 0.00 0.68 -0.70 0.00 0.00 0.00 174.94 174.92 2ka9 s GLU 136 N -5.42 4.10 -1.70 2.79 2.12 -1.26 -3.92 118.70 115.41 2ka9 s GLU 136 Ca 0.68 0.70 0.00 0.00 0.36 0.00 0.00 54.97 56.71 2ka9 s GLU 136 Cb -0.11 -2.77 0.00 0.00 0.26 0.00 0.00 34.13 31.51 2ka9 s GLU 136 CO 0.54 0.35 0.00 0.41 -0.54 0.00 0.00 175.26 176.02 2ka9 n GLY 137 N 0.42 0.37 3.89 -1.50 0.00 -1.26 -4.95 105.19 102.15 2ka9 n GLY 137 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.24 1.62 0.09 -0.02 0.00 -1.25 -4.91 107.32 100.61 2ka9 s GLY 138 Ca 0.00 -0.39 -0.26 0.00 0.00 0.00 0.00 44.72 44.07 2ka9 s GLY 138 CO 0.00 -0.04 1.69 0.00 0.00 0.00 0.00 173.10 174.75 2ka9 h ALA 139 N -0.55 -0.27 -0.07 3.20 0.00 -1.84 -2.15 119.26 117.58 2ka9 h ALA 139 Ca -0.45 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 2ka9 h ALA 139 Cb 1.25 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 2ka9 h ALA 139 CO 0.63 -0.67 -0.49 0.00 0.00 0.00 0.00 179.25 178.72 2ka9 h ALA 140 N 0.53 1.04 0.20 0.00 0.00 -1.75 -0.53 119.26 118.74 2ka9 h ALA 140 Ca -0.00 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 54.45 2ka9 h ALA 140 Cb 0.27 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2ka9 h ALA 140 CO -0.02 0.64 -0.26 1.25 0.00 0.00 0.00 179.25 180.87 2ka9 h HIS 141 N 0.15 -0.70 0.03 0.00 6.17 -1.71 1.64 115.15 120.73 2ka9 h HIS 141 Ca 0.01 0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.09 2ka9 h HIS 141 Cb 0.92 0.28 0.00 0.00 2.52 0.00 0.00 27.41 31.13 2ka9 h HIS 141 CO 0.01 -0.37 -0.01 0.87 0.71 0.00 0.00 177.93 179.14 2ka9 h LYS 142 N -0.52 -0.04 0.00 5.26 1.57 -1.39 -2.84 116.57 118.62 2ka9 h LYS 142 Ca 0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2ka9 h LYS 142 Cb 0.50 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 2ka9 h LYS 142 CO -0.10 0.57 -0.03 -0.44 -0.57 0.00 0.00 179.45 178.88 2ka9 h ASP 143 N -0.68 0.00 -0.22 0.86 3.32 -1.09 -3.38 116.42 115.23 2ka9 h ASP 143 Ca -0.00 -0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.05 2ka9 h ASP 143 Cb 0.62 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.13 2ka9 h ASP 143 CO 0.01 0.54 -0.06 1.23 -1.72 0.00 0.00 179.24 179.23 2ka9 h GLY 144 N -1.00 0.15 -0.86 2.75 0.00 0.21 -3.43 103.07 100.90 2ka9 h GLY 144 Ca -0.00 0.08 -0.37 0.00 0.00 0.00 0.00 47.33 47.04 2ka9 h GLY 144 CO -0.00 -0.09 -0.33 0.54 0.00 0.00 0.00 176.54 176.66 2ka9 n ARG 145 N -5.21 -1.34 -3.11 4.80 5.12 0.33 -4.80 116.66 112.44 2ka9 n ARG 145 Ca -0.02 1.13 -0.44 0.00 -1.93 0.00 0.00 57.85 56.59 2ka9 n ARG 145 Cb 0.14 -5.44 0.00 0.00 -1.16 0.00 0.00 32.46 26.00 2ka9 n ARG 145 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 2ka9 n LEU 146 N -2.05 5.37 -4.37 0.55 -0.00 -1.26 -5.03 117.00 110.22 2ka9 n LEU 146 Ca -0.18 -4.72 -0.30 0.00 -0.00 0.00 0.00 56.01 50.82 2ka9 n LEU 146 Cb 0.61 -1.56 0.28 0.00 -0.00 0.00 0.00 43.42 42.75 2ka9 n LEU 146 CO 0.27 1.01 0.45 0.00 -0.00 0.00 0.00 177.39 179.12 2ka9 s GLN 147 N 0.30 -2.22 0.09 1.47 -2.07 -1.26 -4.66 119.66 111.29 2ka9 s GLN 147 Ca 0.38 0.38 -0.36 0.00 -1.82 0.00 0.00 55.36 53.94 2ka9 s GLN 147 Cb -0.06 -1.44 -0.16 0.00 -1.09 0.00 0.00 33.01 30.26 2ka9 s GLN 147 CO -0.03 -4.47 1.41 -0.89 -1.32 0.00 0.00 175.29 169.99 2ka9 n ILE 148 N -5.38 0.02 0.00 3.63 5.41 -1.26 -2.01 119.36 119.77 2ka9 n ILE 148 Ca 0.09 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.83 2ka9 n ILE 148 Cb 0.58 -0.99 0.00 0.00 -0.71 0.00 0.00 39.64 38.51 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 2.79 1.94 3.72 7.39 0.00 -1.13 -5.03 105.19 114.86 2ka9 n GLY 149 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.17 6.41 -0.15 1.61 1.01 -0.85 -4.62 116.67 118.91 2ka9 s ASP 150 Ca 0.00 2.82 0.01 0.00 0.71 0.00 0.00 52.55 56.09 2ka9 s ASP 150 Cb 0.00 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.34 2ka9 s ASP 150 CO 0.00 -0.96 -0.17 -1.59 0.21 0.00 0.00 175.17 172.66 2ka9 s LYS 151 N 1.39 3.15 -0.18 8.23 -2.85 -1.26 -0.24 119.74 127.98 2ka9 s LYS 151 Ca 0.75 -0.78 -0.09 0.00 -1.00 0.00 0.00 55.97 54.85 2ka9 s LYS 151 Cb -0.48 -2.57 -0.05 0.00 -2.06 0.00 0.00 37.83 32.67 2ka9 s LYS 151 CO 0.32 0.01 0.12 0.42 0.10 0.00 0.00 175.35 176.32 2ka9 s ILE 152 N 0.82 5.35 -2.72 3.79 1.09 0.11 -0.35 121.20 129.29 2ka9 s ILE 152 Ca -0.06 0.17 0.24 0.00 -1.10 0.00 0.00 60.65 59.90 2ka9 s ILE 152 Cb -0.15 -3.42 0.16 0.00 -1.06 0.00 0.00 42.46 37.99 2ka9 s ILE 152 CO -0.01 0.48 1.24 0.00 -0.10 0.00 0.00 174.94 176.56 2ka9 n LEU 153 N 3.17 2.66 0.00 2.97 -0.00 0.45 -3.53 117.00 122.73 2ka9 n LEU 153 Ca -0.17 -0.91 0.00 0.00 -0.00 0.00 0.00 56.01 54.93 2ka9 n LEU 153 Cb 0.53 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 2ka9 n LEU 153 CO 0.35 0.45 0.00 0.00 -0.00 0.00 0.00 177.39 178.20 2ka9 n ALA 154 N 0.93 0.00 -3.89 1.47 0.00 -1.20 -4.64 120.51 113.17 2ka9 n ALA 154 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.23 2ka9 n ALA 154 Cb 0.55 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.87 2ka9 n ALA 154 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2ka9 s VAL 155 N -2.00 2.80 0.00 0.00 1.01 -1.14 0.76 120.40 121.84 2ka9 s VAL 155 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 61.98 59.79 2ka9 s VAL 155 Cb 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2ka9 s VAL 155 CO 0.00 -0.64 0.00 0.59 0.00 0.00 0.00 175.10 175.05 2ka9 n ASN 156 N 4.43 0.00 -0.75 3.32 3.02 0.63 -1.33 115.26 124.58 2ka9 n ASN 156 Ca 0.01 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.52 2ka9 n ASN 156 Cb 0.42 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.55 2ka9 n ASN 156 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2ka9 n SER 157 N 1.74 -0.55 -4.88 6.41 3.41 -1.26 -4.97 113.62 113.52 2ka9 n SER 157 Ca 0.00 -1.38 -0.26 0.00 -0.26 0.00 0.00 58.87 56.97 2ka9 n SER 157 Cb 0.00 0.16 -0.04 0.00 -0.26 0.00 0.00 64.21 64.07 2ka9 n SER 157 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2ka9 s VAL 158 N 0.00 4.96 -0.74 -3.33 1.01 -0.45 -5.07 120.40 116.78 2ka9 s VAL 158 Ca 0.00 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.15 2ka9 s VAL 158 Cb 0.00 -3.55 0.19 0.00 0.00 0.00 0.00 36.38 33.02 2ka9 s VAL 158 CO 0.00 -0.10 0.58 0.61 0.00 0.00 0.00 175.10 176.19 2ka9 n GLY 159 N -0.48 4.13 0.72 4.51 0.00 -1.26 -2.87 105.19 109.95 2ka9 n GLY 159 Ca -0.08 -2.62 0.00 0.00 0.00 0.00 0.00 46.02 43.33 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 1.90 1.64 -2.66 0.99 4.77 -1.26 -3.22 117.00 119.17 2ka9 n LEU 160 Ca 0.21 -0.82 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 2ka9 n LEU 160 Cb 0.36 -0.44 0.05 0.00 -2.33 0.00 0.00 43.42 41.05 2ka9 n LEU 160 CO 0.30 0.31 0.00 -0.62 -1.33 0.00 0.00 177.39 176.06 2ka9 n GLU 161 N 0.28 1.52 -1.22 3.23 1.02 -1.26 -4.20 120.64 120.00 2ka9 n GLU 161 Ca 0.00 -3.32 0.00 0.00 -0.02 0.00 0.00 57.16 53.82 2ka9 n GLU 161 Cb 0.31 -1.40 -0.01 0.00 -0.02 0.00 0.00 31.44 30.32 2ka9 n GLU 161 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2ka9 n ASP 162 N -0.46 0.28 0.00 1.62 2.03 -1.20 -4.91 116.55 113.91 2ka9 n ASP 162 Ca 0.07 -1.95 0.00 0.00 0.52 0.00 0.00 54.79 53.43 2ka9 n ASP 162 Cb 0.85 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 41.15 2ka9 n ASP 162 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2ka9 n VAL 163 N 0.28 0.00 0.00 5.18 0.31 -1.26 -5.08 118.33 117.76 2ka9 n VAL 163 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 2ka9 n VAL 163 Cb 0.95 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.88 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 -1.61 0.00 -0.03 5.55 2.81 -1.26 -4.47 117.12 118.11 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 1.25 1.51 0.00 0.00 175.97 178.73 2ka9 h HIS 165 N 0.00 0.00 -0.06 2.03 2.76 -1.53 0.21 115.15 118.56 2ka9 h HIS 165 Ca 0.00 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.09 2ka9 h HIS 165 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 2ka9 h HIS 165 CO 0.00 0.00 -0.27 0.93 -1.30 0.00 0.00 177.93 177.29 2ka9 h GLU 166 N 0.00 0.29 -0.15 5.26 4.39 -1.89 -0.19 114.58 122.28 2ka9 h GLU 166 Ca 0.28 -0.23 -0.18 0.00 0.34 0.00 0.00 59.36 59.57 2ka9 h GLU 166 Cb 1.14 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.84 2ka9 h GLU 166 CO -0.00 0.88 -0.66 -0.44 -1.16 0.00 0.00 179.01 177.63 2ka9 h ASP 167 N -0.23 0.67 0.10 1.42 5.19 -1.67 -1.40 116.42 120.50 2ka9 h ASP 167 Ca -0.02 -0.40 -0.14 0.00 -0.62 0.00 0.00 57.03 55.85 2ka9 h ASP 167 Cb 0.92 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 40.23 2ka9 h ASP 167 CO 0.06 1.15 -0.51 0.00 -3.12 0.00 0.00 179.24 176.82 2ka9 h ALA 168 N 0.85 0.82 -0.24 3.45 0.00 -0.71 -0.46 119.26 122.98 2ka9 h ALA 168 Ca -0.02 -0.49 -0.20 0.00 0.00 0.00 0.00 54.91 54.21 2ka9 h ALA 168 Cb 1.23 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2ka9 h ALA 168 CO 0.12 0.67 -0.62 0.28 0.00 0.00 0.00 179.25 179.71 2ka9 h VAL 169 N 0.36 1.28 -0.16 0.00 2.07 -0.93 -1.16 116.25 117.70 2ka9 h VAL 169 Ca 0.01 -1.81 -0.17 0.00 0.82 0.00 0.00 66.70 65.56 2ka9 h VAL 169 Cb 1.01 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 32.55 2ka9 h VAL 169 CO 0.09 0.58 -0.61 0.00 0.02 0.00 0.00 177.57 177.65 2ka9 h ALA 170 N 0.63 0.64 0.00 1.67 0.00 -1.20 -1.42 119.26 119.58 2ka9 h ALA 170 Ca -0.01 -0.54 -0.11 0.00 0.00 0.00 0.00 54.91 54.25 2ka9 h ALA 170 Cb 1.24 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2ka9 h ALA 170 CO 0.13 0.70 -0.53 0.00 0.00 0.00 0.00 179.25 179.56 2ka9 h ALA 171 N 0.92 0.81 0.16 0.00 0.00 -1.08 -1.02 119.26 119.06 2ka9 h ALA 171 Ca -0.01 -0.48 -0.31 0.00 0.00 0.00 0.00 54.91 54.11 2ka9 h ALA 171 Cb 1.17 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2ka9 h ALA 171 CO 0.11 0.66 -1.45 1.37 0.00 0.00 0.00 179.25 179.94 2ka9 h LEU 172 N 0.00 0.53 -0.58 0.00 8.10 -1.14 -3.26 115.31 118.95 2ka9 h LEU 172 Ca -0.01 -0.64 -0.10 0.00 0.11 0.00 0.00 57.88 57.24 2ka9 h LEU 172 Cb 1.18 -0.17 -0.01 0.00 -0.44 0.00 0.00 40.66 41.21 2ka9 h LEU 172 CO 0.07 1.52 -0.48 0.07 -4.11 0.00 0.00 178.44 175.50 2ka9 h LYS 173 N 0.09 0.00 0.00 0.17 2.10 -1.27 -2.80 116.57 114.87 2ka9 h LYS 173 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 2ka9 h LYS 173 Cb 2.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.38 2ka9 h LYS 173 CO 0.20 0.48 0.00 0.09 -2.00 0.00 0.00 179.45 178.23 2ka9 n ASN 174 N -3.45 0.00 -4.06 7.07 3.02 -0.39 -4.86 115.26 112.60 2ka9 n ASN 174 Ca 0.00 0.46 -0.37 0.00 -0.03 0.00 0.00 54.58 54.64 2ka9 n ASN 174 Cb 0.62 -0.48 0.06 0.00 -0.61 0.00 0.00 39.78 39.37 2ka9 n ASN 174 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2ka9 n THR 175 N -1.48 0.00 -3.06 3.41 -2.24 -1.06 -4.99 114.28 104.86 2ka9 n THR 175 Ca 0.04 -0.18 -0.20 0.00 -2.27 0.00 0.00 64.05 61.44 2ka9 n THR 175 Cb 0.16 -0.12 0.01 0.00 -2.10 0.00 0.00 70.33 68.28 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 -2.05 3.01 0.55 4.78 5.04 -1.26 -4.97 117.35 122.45 2ka9 s TYR 176 Ca 0.41 -0.11 0.36 0.00 -2.44 0.00 0.00 57.07 55.28 2ka9 s TYR 176 Cb -0.01 -2.33 1.51 0.00 0.35 0.00 0.00 41.96 41.48 2ka9 s TYR 176 CO 0.70 -0.38 1.78 0.22 -1.34 0.00 0.00 175.55 176.53 2ka9 h ASP 177 N 0.53 0.00 -1.98 4.32 1.82 -1.91 -3.30 116.42 115.91 2ka9 h ASP 177 Ca -0.44 0.00 -0.36 0.00 -0.39 0.00 0.00 57.03 55.84 2ka9 h ASP 177 Cb 1.27 0.00 -0.31 0.00 0.68 0.00 0.00 39.33 40.97 2ka9 h ASP 177 CO 0.52 0.00 -0.68 -0.69 -1.61 0.00 0.00 179.24 176.78 2ka9 s VAL 178 N -4.87 -0.34 0.10 2.25 1.01 -1.26 0.54 120.40 117.83 2ka9 s VAL 178 Ca -0.05 -0.93 0.10 0.00 0.00 0.00 0.00 61.98 61.11 2ka9 s VAL 178 Cb 0.22 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2ka9 s VAL 178 CO 0.76 -0.57 -0.26 0.68 0.00 0.00 0.00 175.10 175.71 2ka9 s VAL 179 N 1.56 2.27 -0.22 2.92 -7.23 -0.85 -4.96 120.40 113.90 2ka9 s VAL 179 Ca 0.16 -1.62 -0.08 0.00 -1.81 0.00 0.00 61.98 58.63 2ka9 s VAL 179 Cb -0.15 -1.97 -0.04 0.00 0.56 0.00 0.00 36.38 34.78 2ka9 s VAL 179 CO -0.08 0.18 0.09 -0.72 -0.31 0.00 0.00 175.10 174.27 2ka9 s TYR 180 N -0.99 3.20 0.18 2.82 -0.85 -1.26 -0.01 117.35 120.45 2ka9 s TYR 180 Ca 0.14 -0.05 0.06 0.00 -0.52 0.00 0.00 57.07 56.70 2ka9 s TYR 180 Cb -0.10 -2.18 -0.04 0.00 0.38 0.00 0.00 41.96 40.02 2ka9 s TYR 180 CO 0.05 -0.04 0.12 -0.48 -1.52 0.00 0.00 175.55 173.68 2ka9 s LEU 181 N 0.99 3.71 -0.37 -3.49 2.34 0.33 -0.27 118.68 121.92 2ka9 s LEU 181 Ca 0.05 -0.21 -0.16 0.00 0.06 0.00 0.00 54.13 53.87 2ka9 s LEU 181 Cb -0.14 -2.31 0.00 0.00 -0.56 0.00 0.00 46.19 43.18 2ka9 s LEU 181 CO 0.03 0.05 0.39 -0.54 -1.06 0.00 0.00 176.35 175.23 2ka9 s LYS 182 N -3.22 3.40 0.33 1.48 3.01 0.23 -0.74 119.74 124.23 2ka9 s LYS 182 Ca 0.31 -0.53 0.07 0.00 -1.01 0.00 0.00 55.97 54.81 2ka9 s LYS 182 Cb -0.09 -3.86 -0.02 0.00 -1.01 0.00 0.00 37.83 32.85 2ka9 s LYS 182 CO 0.23 -0.64 0.40 0.08 0.51 0.00 0.00 175.35 175.92 2ka9 s VAL 183 N 2.07 3.98 -0.06 3.17 1.01 -0.61 -0.41 120.40 129.54 2ka9 s VAL 183 Ca 0.12 -1.13 0.02 0.00 0.00 0.00 0.00 61.98 60.99 2ka9 s VAL 183 Cb -0.17 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.87 2ka9 s VAL 183 CO 0.12 -0.18 -0.10 0.00 0.00 0.00 0.00 175.10 174.95 2ka9 s ALA 184 N -2.20 1.09 -0.04 5.51 0.00 0.53 0.08 121.76 126.72 2ka9 s ALA 184 Ca 0.43 -0.32 -0.26 0.00 0.00 0.00 0.00 51.96 51.81 2ka9 s ALA 184 Cb -0.08 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 2ka9 s ALA 184 CO 0.29 0.03 0.82 0.15 0.00 0.00 0.00 175.76 177.06 2ka9 s LYS 185 N 0.82 4.49 0.35 0.00 1.02 -0.33 -4.22 119.74 121.87 2ka9 s LYS 185 Ca -0.12 1.11 -0.26 0.00 0.02 0.00 0.00 55.97 56.73 2ka9 s LYS 185 Cb -0.15 -3.46 -0.13 0.00 -0.52 0.00 0.00 37.83 33.57 2ka9 s LYS 185 CO 0.02 0.00 0.85 -2.30 -0.92 0.00 0.00 175.35 173.00 2ka9 n PRO 186 N 3.87 1.03 -0.14 -1.68 -0.02 -1.26 -3.20 135.00 133.60 2ka9 n PRO 186 Ca 0.02 0.37 -0.10 0.00 -2.02 0.00 0.00 63.50 61.76 2ka9 n PRO 186 Cb 0.51 -1.73 0.10 0.00 -0.02 0.00 0.00 33.50 32.36 2ka9 n PRO 186 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2ka9 n SER 187 N 1.12 -2.49 -3.97 2.55 3.41 -1.26 -4.04 113.62 108.93 2ka9 n SER 187 Ca 0.11 -0.29 -0.35 0.00 -0.26 0.00 0.00 58.87 58.07 2ka9 n SER 187 Cb 0.35 -0.38 -0.09 0.00 -0.26 0.00 0.00 64.21 63.84 2ka9 n SER 187 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2ka9 n ASN 188 N -3.03 2.03 0.00 4.04 5.15 -1.26 -4.54 115.26 117.65 2ka9 n ASN 188 Ca 0.05 -2.60 0.00 0.00 -0.60 0.00 0.00 54.58 51.42 2ka9 n ASN 188 Cb 0.20 -1.20 0.00 0.00 -0.53 0.00 0.00 39.78 38.26 2ka9 n ASN 188 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66